smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cccc2c(O)c(C(=O)Nc3nc(C(C)C)n[nH]3)cnc12 ZINC000218373985 536934002 /nfs/dbraw/zinc/93/40/02/536934002.db2.gz FHMWFSLPCHBPOQ-UHFFFAOYSA-N 0 1 327.344 2.443 50 70 EEIAMN COC(=O)C[C@@H](c1ccc(O)c(OC)c1)c1c(O)cc(C)oc1=O ZINC000218086394 536313481 /nfs/dbraw/zinc/31/34/81/536313481.db2.gz ZMENOSBMOVAOFU-NSHDSACASA-N 0 1 334.324 2.063 50 70 biogenic EEIAMN O=C(N[C@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1n[nH]c2ccccc21 ZINC000218058212 241293664 /nfs/dbraw/zinc/29/36/64/241293664.db2.gz LXLLOWDNIDCOFB-SUYBPPKGSA-N 0 1 336.395 2.070 50 70 EEIAMN C[C@@H]1Cc2cc(C(=O)NCCCCCN3CCOCC3)ccc2O1 ZINC000218549003 241330569 /nfs/dbraw/zinc/33/05/69/241330569.db2.gz JQPMTFUVPRLWFY-OAHLLOKOSA-N 0 1 332.444 2.242 50 70 EEIAMN Cc1cc([C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2CNCCO2)ccc1F ZINC000217899312 241283015 /nfs/dbraw/zinc/28/30/15/241283015.db2.gz CEOSQQNGUXWBNR-DFGXFYAUSA-N 0 1 332.419 2.360 50 70 EEIAMN Cc1ccc2nc([C@H](C)NC(=O)CSc3nnc(N)s3)[nH]c2c1 ZINC000217965466 241288049 /nfs/dbraw/zinc/28/80/49/241288049.db2.gz KFPJVVZLJWYENH-QMMMGPOBSA-N 0 1 348.457 2.275 50 70 EEIAMN CN1CCN(c2ccc(C(=O)N[C@@H]3COc4ccccc43)cc2)CC1 ZINC000218765431 241343435 /nfs/dbraw/zinc/34/34/35/241343435.db2.gz XAIQQDOLPCFHRR-GOSISDBHSA-N 0 1 337.423 2.302 50 70 EEIAMN COC(=O)C[C@H](c1ccc2c(c1)OCCO2)c1c(O)cc(C)oc1=O ZINC000218029992 241291502 /nfs/dbraw/zinc/29/15/02/241291502.db2.gz SZBYGNNHLYMQKY-GFCCVEGCSA-N 0 1 346.335 2.120 50 70 biogenic EEIAMN Nc1nc(CCNC(=O)[C@@H]2CCCCN2Cc2ccccc2)cs1 ZINC000218366364 241318373 /nfs/dbraw/zinc/31/83/73/241318373.db2.gz YZSFBYOIHGIHDR-INIZCTEOSA-N 0 1 344.484 2.439 50 70 EEIAMN O=C(c1ccc(N2CCCC2)cc1)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000217950865 241285545 /nfs/dbraw/zinc/28/55/45/241285545.db2.gz DJNXCNWNEKRRFC-HNNXBMFYSA-N 0 1 325.416 2.425 50 70 EEIAMN O=C(NCCN1CCc2ccccc2C1)[C@@H](O)c1cccc(F)c1 ZINC000218324073 241316230 /nfs/dbraw/zinc/31/62/30/241316230.db2.gz QSSDWSQOCPFSGW-SFHVURJKSA-N 0 1 328.387 2.034 50 70 EEIAMN O=C(c1ccccc1-c1ccccc1)N1CCN(Cc2nnc[nH]2)CC1 ZINC000218058071 241294154 /nfs/dbraw/zinc/29/41/54/241294154.db2.gz SSBHSOFAELADPJ-UHFFFAOYSA-N 0 1 347.422 2.430 50 70 EEIAMN CCc1nc(C)ccc1OCC(=O)N1CCC[C@H]1c1n[nH]c(C)n1 ZINC000216994762 241229618 /nfs/dbraw/zinc/22/96/18/241229618.db2.gz CXTFSSZXNFCHAS-AWEZNQCLSA-N 0 1 329.404 2.121 50 70 EEIAMN CCN(C)CC(=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000218450856 241324754 /nfs/dbraw/zinc/32/47/54/241324754.db2.gz XMPJQUYOGAXJEM-GSQSYGFSSA-N 0 1 327.428 2.115 50 70 EEIAMN O=C(c1ccc(N2CCCC2)cc1)N1CCC[C@@H](c2nc[nH]n2)C1 ZINC000217950770 241286140 /nfs/dbraw/zinc/28/61/40/241286140.db2.gz DJNXCNWNEKRRFC-OAHLLOKOSA-N 0 1 325.416 2.425 50 70 EEIAMN O=C(CN1CC[C@@H](c2ccccc2)C1)NCc1ccc2nonc2c1 ZINC000218260319 241310980 /nfs/dbraw/zinc/31/09/80/241310980.db2.gz LEHIDRZEAGDYSV-MRXNPFEDSA-N 0 1 336.395 2.329 50 70 EEIAMN CSc1ccc(CC(=O)N2CCN(CC3CC3)[C@H](CCO)C2)cc1 ZINC000218214546 241306084 /nfs/dbraw/zinc/30/60/84/241306084.db2.gz QRHBMXWTTJICEM-QGZVFWFLSA-N 0 1 348.512 2.256 50 70 EEIAMN O=C(NC1CCN(Cc2cccnc2)CC1)c1ccn(C(F)F)n1 ZINC000218224501 241308813 /nfs/dbraw/zinc/30/88/13/241308813.db2.gz LJKUDXKVHFCLPY-UHFFFAOYSA-N 0 1 335.358 2.068 50 70 EEIAMN Cc1ncc(CN2CCn3nc([C@H](O)Cc4ccccc4)cc3C2)[nH]1 ZINC000218147733 241302539 /nfs/dbraw/zinc/30/25/39/241302539.db2.gz MLOXBOTXWKPEIJ-LJQANCHMSA-N 0 1 337.427 2.207 50 70 EEIAMN O=C(NC[C@H]1CC(=O)N(C2CCCC2)C1)c1n[nH]c2ccccc21 ZINC000217424422 241249274 /nfs/dbraw/zinc/24/92/74/241249274.db2.gz GVLWNZNEVPTYLE-GFCCVEGCSA-N 0 1 326.400 2.084 50 70 EEIAMN O=C(N[C@@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1n[nH]c2ccccc21 ZINC000218058146 241293770 /nfs/dbraw/zinc/29/37/70/241293770.db2.gz LXLLOWDNIDCOFB-JDFRZJQESA-N 0 1 336.395 2.070 50 70 EEIAMN O=C(COCC(F)(F)C(F)F)NCc1nc2ccc(F)cc2[nH]1 ZINC000217763743 241273617 /nfs/dbraw/zinc/27/36/17/241273617.db2.gz VDYGDWGALMAVOF-UHFFFAOYSA-N 0 1 337.248 2.235 50 70 EEIAMN Cc1[nH+]ccn1CC[C@H](NC(=O)c1cc(=O)[n-]o1)c1ccccc1 ZINC000217626403 241262938 /nfs/dbraw/zinc/26/29/38/241262938.db2.gz KKDSWZTZMYZTKN-AWEZNQCLSA-N 0 1 326.356 2.447 50 70 EEIAMN O=C(c1ccc(-c2ccco2)cc1)N1CCN(Cc2nnc[nH]2)CC1 ZINC000217479435 241252341 /nfs/dbraw/zinc/25/23/41/241252341.db2.gz GTRBWNDLDYZZJD-UHFFFAOYSA-N 0 1 337.383 2.023 50 70 EEIAMN CSCc1ccc(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2N2CCCC2)o1 ZINC000218030731 241291676 /nfs/dbraw/zinc/29/16/76/241291676.db2.gz PHLQJKPNZHWZPW-SLBVQIDZSA-N 0 1 336.457 2.124 50 70 EEIAMN CCN(CCc1nc2ccc(F)cc2[nH]1)C(=O)c1cc(CO)ccn1 ZINC000218161424 241302633 /nfs/dbraw/zinc/30/26/33/241302633.db2.gz QVQBHFCBNTUNDZ-UHFFFAOYSA-N 0 1 342.374 2.294 50 70 EEIAMN Cc1cc([C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@H]2CNCCO2)ccc1F ZINC000217899411 485531066 /nfs/dbraw/zinc/53/10/66/485531066.db2.gz CEOSQQNGUXWBNR-KYHPRHEASA-N 0 1 332.419 2.360 50 70 EEIAMN O=C(CCN1CCCCCC1=O)NCc1nc2ccc(F)cc2[nH]1 ZINC000217448826 241251238 /nfs/dbraw/zinc/25/12/38/241251238.db2.gz KLMAVQKVSMJITD-UHFFFAOYSA-N 0 1 332.379 2.111 50 70 EEIAMN O=S(=O)(NCC[C@@H](O)c1ccsc1)c1c(F)cccc1F ZINC000217536251 241257007 /nfs/dbraw/zinc/25/70/07/241257007.db2.gz XCUMXKRBKMCXGJ-GFCCVEGCSA-N 0 1 333.381 2.428 50 70 EEIAMN COC(=O)CS[C@H]1CCN(C(=O)c2cc(-c3ccccc3)[nH]n2)C1 ZINC000217562682 241258500 /nfs/dbraw/zinc/25/85/00/241258500.db2.gz GKEMSRNSXRZGOE-ZDUSSCGKSA-N 0 1 345.424 2.197 50 70 EEIAMN Cc1nc([C@H]2CCCN2C(=O)c2cc(CC(C)C)nc(C)n2)n[nH]1 ZINC000217601084 241263694 /nfs/dbraw/zinc/26/36/94/241263694.db2.gz CGHHJRZBLDRGNO-OAHLLOKOSA-N 0 1 328.420 2.387 50 70 EEIAMN Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)Nc1nc(C(C)C)n[nH]1 ZINC000218485016 241326656 /nfs/dbraw/zinc/32/66/56/241326656.db2.gz OGBCZLFEXUVQOD-UHFFFAOYSA-N 0 1 329.404 2.369 50 70 EEIAMN Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)Nc1n[nH]c(C(C)C)n1 ZINC000218485016 241326660 /nfs/dbraw/zinc/32/66/60/241326660.db2.gz OGBCZLFEXUVQOD-UHFFFAOYSA-N 0 1 329.404 2.369 50 70 EEIAMN Cc1ccnn1CCC(=O)NCCCc1nc2ccc(F)cc2[nH]1 ZINC000218185824 241303440 /nfs/dbraw/zinc/30/34/40/241303440.db2.gz NKUBCIDMZDBHAM-UHFFFAOYSA-N 0 1 329.379 2.346 50 70 EEIAMN CN1CCN(C)[C@@H](Cc2ncnn2-c2cccc(C(F)(F)F)c2)C1 ZINC000217862879 241279955 /nfs/dbraw/zinc/27/99/55/241279955.db2.gz FFCXLYANUYPQNO-AWEZNQCLSA-N 0 1 339.365 2.074 50 70 EEIAMN Cc1cc(C[C@@H](C)NC(=O)Cn2c(C)cc(=O)c3ccccc32)n[nH]1 ZINC000218288859 241313467 /nfs/dbraw/zinc/31/34/67/241313467.db2.gz KKMJDOQSAYLGQO-GFCCVEGCSA-N 0 1 338.411 2.089 50 70 EEIAMN CSc1ccc(CC(=O)N2CCN(CC3CC3)[C@@H](CCO)C2)cc1 ZINC000218214484 241305080 /nfs/dbraw/zinc/30/50/80/241305080.db2.gz QRHBMXWTTJICEM-KRWDZBQOSA-N 0 1 348.512 2.256 50 70 EEIAMN O=C(NC[C@@H]1CC(=O)N(C2CCCC2)C1)c1n[nH]c2ccccc21 ZINC000217424340 241248898 /nfs/dbraw/zinc/24/88/98/241248898.db2.gz GVLWNZNEVPTYLE-LBPRGKRZSA-N 0 1 326.400 2.084 50 70 EEIAMN Cc1cc(C)n(C2CN(C(=O)CN3CC[C@H](c4ccccc4)C3)C2)n1 ZINC000218348882 241314921 /nfs/dbraw/zinc/31/49/21/241314921.db2.gz JYPPASFILCMGSL-SFHVURJKSA-N 0 1 338.455 2.373 50 70 EEIAMN O=C(c1cc(-c2ccsc2)n[nH]1)N1CCC(c2nc[nH]n2)CC1 ZINC000217880116 241280900 /nfs/dbraw/zinc/28/09/00/241280900.db2.gz MRTDYWVKIQZOAI-UHFFFAOYSA-N 0 1 328.401 2.276 50 70 EEIAMN CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)Cn1nc2ccccc2n1 ZINC000218117907 241298672 /nfs/dbraw/zinc/29/86/72/241298672.db2.gz GLQPGTXCHQUTOS-UHFFFAOYSA-N 0 1 338.346 2.105 50 70 EEIAMN C[C@H]1Cc2cc(C(=O)NCCCCCN3CCOCC3)ccc2O1 ZINC000218549097 241331643 /nfs/dbraw/zinc/33/16/43/241331643.db2.gz JQPMTFUVPRLWFY-HNNXBMFYSA-N 0 1 332.444 2.242 50 70 EEIAMN O=C(N[C@H](CCn1cncn1)c1ccccc1)c1ccc2[nH]nnc2c1 ZINC000217805367 241274175 /nfs/dbraw/zinc/27/41/75/241274175.db2.gz VXJKIRSZFMSWOT-OAHLLOKOSA-N 0 1 347.382 2.111 50 70 EEIAMN O=C(N[C@H]1[C@H]2CCO[C@H]2[C@@H]1N1CCCC1)c1ccc(Cl)s1 ZINC000218644904 241336536 /nfs/dbraw/zinc/33/65/36/241336536.db2.gz SGOADPYXWLAMCT-GJQVQUKXSA-N 0 1 326.849 2.383 50 70 EEIAMN COc1ccc(-c2nc3c([nH]2)CN(C(=O)c2cccc(C)n2)CC3)cn1 ZINC000218764774 241344211 /nfs/dbraw/zinc/34/42/11/241344211.db2.gz RZRMHHSBWZNCFI-UHFFFAOYSA-N 0 1 349.394 2.382 50 70 EEIAMN Cc1[nH+]ccn1CC[C@@H](NC(=O)c1cc(=O)[n-]o1)c1ccccc1 ZINC000217626320 241263341 /nfs/dbraw/zinc/26/33/41/241263341.db2.gz KKDSWZTZMYZTKN-CQSZACIVSA-N 0 1 326.356 2.447 50 70 EEIAMN O=C(N[C@@H](CCn1cncn1)c1ccccc1)c1ccc2[nH]nnc2c1 ZINC000217805251 241274041 /nfs/dbraw/zinc/27/40/41/241274041.db2.gz VXJKIRSZFMSWOT-HNNXBMFYSA-N 0 1 347.382 2.111 50 70 EEIAMN O=S(=O)(NCCSC1CCOCC1)c1c(F)cccc1F ZINC000217710017 241270607 /nfs/dbraw/zinc/27/06/07/241270607.db2.gz GNWYVPBAZPTUNN-UHFFFAOYSA-N 0 1 337.413 2.155 50 70 EEIAMN CSCC[C@@H](CO)NC(=O)c1c[nH]c2c(cccc2C(C)C)c1=O ZINC000217652391 241265749 /nfs/dbraw/zinc/26/57/49/241265749.db2.gz WWEVQTOVFGIPEX-LBPRGKRZSA-N 0 1 348.468 2.495 50 70 biogenic EEIAMN Cc1cc(=O)cc(C(=O)N(C)CCc2nc3ccc(F)cc3[nH]2)o1 ZINC000218772907 241345612 /nfs/dbraw/zinc/34/56/12/241345612.db2.gz JNJSJHLGMCQVPF-UHFFFAOYSA-N 0 1 329.331 2.278 50 70 EEIAMN Cc1cn[nH]c1C1CCN(C(=O)CCN2CCCCCC2=O)CC1 ZINC000217148451 241238675 /nfs/dbraw/zinc/23/86/75/241238675.db2.gz JQMUQTIMUZPPHS-UHFFFAOYSA-N 0 1 332.448 2.217 50 70 EEIAMN Cc1cc(N)n(CC(=O)N[C@H](c2nc3ccc(C)cc3[nH]2)C(C)C)n1 ZINC000217659746 241267674 /nfs/dbraw/zinc/26/76/74/241267674.db2.gz UUCRLPQODMBZHV-KRWDZBQOSA-N 0 1 340.431 2.472 50 70 EEIAMN OC1CC(c2cc(N3CCN(CCc4ccccc4)CC3)ncn2)C1 ZINC000218639538 241336471 /nfs/dbraw/zinc/33/64/71/241336471.db2.gz PWSHQKBFXANIQV-UHFFFAOYSA-N 0 1 338.455 2.080 50 70 EEIAMN Cc1nc2ccc(C(=O)N[C@H]3[C@H]4CCO[C@H]4[C@@H]3N3CCCC3)cc2o1 ZINC000217986994 282060061 /nfs/dbraw/zinc/06/00/61/282060061.db2.gz OWKQPWAZVKGUOW-BVPBIZIASA-N 0 1 341.411 2.118 50 70 EEIAMN c1nc2c(ncnc2N[C@@H]2COCC[C@@H]2OCc2ccccc2)[nH]1 ZINC000217996716 241289265 /nfs/dbraw/zinc/28/92/65/241289265.db2.gz GNRAWFHVKWLADN-KGLIPLIRSA-N 0 1 325.372 2.139 50 70 EEIAMN O=C(CN1CC[C@H](c2ccccc2)C1)NCc1ccc2nonc2c1 ZINC000218260377 241311717 /nfs/dbraw/zinc/31/17/17/241311717.db2.gz LEHIDRZEAGDYSV-INIZCTEOSA-N 0 1 336.395 2.329 50 70 EEIAMN CC[C@H](O)c1cc2n(n1)CCN(C(=O)c1cccc3[nH]c(C)nc31)C2 ZINC000216965226 241229448 /nfs/dbraw/zinc/22/94/48/241229448.db2.gz JEAIGKVGBPETFC-INIZCTEOSA-N 0 1 339.399 2.167 50 70 EEIAMN COC(=O)CS[C@@H]1CCN(C(=O)c2cc(-c3ccccc3)[nH]n2)C1 ZINC000217562601 241259553 /nfs/dbraw/zinc/25/95/53/241259553.db2.gz GKEMSRNSXRZGOE-CYBMUJFWSA-N 0 1 345.424 2.197 50 70 EEIAMN Cc1nonc1CC(=O)N1CCC(c2nc3ccc(F)cc3[nH]2)CC1 ZINC000217061407 241235944 /nfs/dbraw/zinc/23/59/44/241235944.db2.gz DWZPVXJCJHSNKU-UHFFFAOYSA-N 0 1 343.362 2.342 50 70 EEIAMN O=S(=O)(NCC[C@H](O)c1ccsc1)c1c(F)cccc1F ZINC000217536168 241257827 /nfs/dbraw/zinc/25/78/27/241257827.db2.gz XCUMXKRBKMCXGJ-LBPRGKRZSA-N 0 1 333.381 2.428 50 70 EEIAMN Nc1nc(CCNC(=O)[C@H]2CCCCN2Cc2ccccc2)cs1 ZINC000218366420 241318572 /nfs/dbraw/zinc/31/85/72/241318572.db2.gz YZSFBYOIHGIHDR-MRXNPFEDSA-N 0 1 344.484 2.439 50 70 EEIAMN CN(C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)CCc1nc2ccccc2s1 ZINC000218324270 241315268 /nfs/dbraw/zinc/31/52/68/241315268.db2.gz WQCJOIOFCMGLDG-JZDMUPLMSA-N 0 1 345.468 2.063 50 70 EEIAMN Cc1nc([C@@H]2CCCN2C(=O)c2cc(CC(C)C)nc(C)n2)n[nH]1 ZINC000217600985 241262701 /nfs/dbraw/zinc/26/27/01/241262701.db2.gz CGHHJRZBLDRGNO-HNNXBMFYSA-N 0 1 328.420 2.387 50 70 EEIAMN O=C(Cc1cnccn1)N1CCC[C@H]1c1nc2ccc(F)cc2[nH]1 ZINC000217632597 241265706 /nfs/dbraw/zinc/26/57/06/241265706.db2.gz OEFYEQFUPQDVJI-HNNXBMFYSA-N 0 1 325.347 2.398 50 70 EEIAMN CC[C@@H](O)c1cc2n(n1)CCN(C(=O)c1cccc3[nH]c(C)nc31)C2 ZINC000216965214 241229640 /nfs/dbraw/zinc/22/96/40/241229640.db2.gz JEAIGKVGBPETFC-MRXNPFEDSA-N 0 1 339.399 2.167 50 70 EEIAMN Cc1ccc2nc([C@@H](C)NC(=O)CSc3nnc(N)s3)[nH]c2c1 ZINC000217965383 241288340 /nfs/dbraw/zinc/28/83/40/241288340.db2.gz KFPJVVZLJWYENH-MRVPVSSYSA-N 0 1 348.457 2.275 50 70 EEIAMN COC(=O)C[C@H](c1ccc(O)c(OC)c1)c1c(O)cc(C)oc1=O ZINC000218086327 241296505 /nfs/dbraw/zinc/29/65/05/241296505.db2.gz ZMENOSBMOVAOFU-LLVKDONJSA-N 0 1 334.324 2.063 50 70 biogenic EEIAMN CCN(C)CC(=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000218450950 241324119 /nfs/dbraw/zinc/32/41/19/241324119.db2.gz XMPJQUYOGAXJEM-KJXMEXGPSA-N 0 1 327.428 2.115 50 70 EEIAMN CN(Cc1cc(C(C)(C)C)[nH]n1)C(=O)CC1=CSC2=NCCN12 ZINC000218370876 241317431 /nfs/dbraw/zinc/31/74/31/241317431.db2.gz HPEWJXLYVBYQOL-UHFFFAOYSA-N 0 1 333.461 2.316 50 70 EEIAMN Cc1cc(N)n(CC(=O)N[C@@H](c2nc3ccc(C)cc3[nH]2)C(C)C)n1 ZINC000217659670 241267243 /nfs/dbraw/zinc/26/72/43/241267243.db2.gz UUCRLPQODMBZHV-QGZVFWFLSA-N 0 1 340.431 2.472 50 70 EEIAMN CCc1n[nH]c(C(=O)N[C@@H]2CCOC[C@H]2OCc2ccccc2)c1C ZINC000218256516 241308884 /nfs/dbraw/zinc/30/88/84/241308884.db2.gz VIYVACMSCTZXNQ-IAGOWNOFSA-N 0 1 343.427 2.385 50 70 EEIAMN O=C(CCCn1nnc2ccccc2c1=O)Nc1ccc2nc[nH]c2c1 ZINC000218265485 241311512 /nfs/dbraw/zinc/31/15/12/241311512.db2.gz SOJCWXNOBMKJHA-UHFFFAOYSA-N 0 1 348.366 2.087 50 70 EEIAMN Cc1nnc(CCNC(=O)CN2CCC(c3ccccc3)CC2)s1 ZINC000216993345 241230073 /nfs/dbraw/zinc/23/00/73/241230073.db2.gz IJQXJXDREANPHV-UHFFFAOYSA-N 0 1 344.484 2.385 50 70 EEIAMN Cc1ncc(CN2CCn3nc([C@@H](O)Cc4ccccc4)cc3C2)[nH]1 ZINC000218147660 241301063 /nfs/dbraw/zinc/30/10/63/241301063.db2.gz MLOXBOTXWKPEIJ-IBGZPJMESA-N 0 1 337.427 2.207 50 70 EEIAMN Cc1cccc2nc(CNC(=O)c3nc(N)nc4c3CCCC4)[nH]c21 ZINC000218224612 241308455 /nfs/dbraw/zinc/30/84/55/241308455.db2.gz XNWVEQZUJRIALU-UHFFFAOYSA-N 0 1 336.399 2.052 50 70 EEIAMN Cn1c2ccccc2nc1[C@@H]1CCCN(C(=O)CN2CCCC2)C1 ZINC000217627070 241263808 /nfs/dbraw/zinc/26/38/08/241263808.db2.gz VZFICAKCXLXZPU-OAHLLOKOSA-N 0 1 326.444 2.375 50 70 EEIAMN CN1CCN(c2ccc(C(=O)NCCCc3ccncc3)cc2)CC1 ZINC000218437577 241320875 /nfs/dbraw/zinc/32/08/75/241320875.db2.gz ISELIDXMGXDTJW-UHFFFAOYSA-N 0 1 338.455 2.196 50 70 EEIAMN CN1CCN(c2ccc(C(=O)N[C@H]3COc4ccccc43)cc2)CC1 ZINC000218765462 241343668 /nfs/dbraw/zinc/34/36/68/241343668.db2.gz XAIQQDOLPCFHRR-SFHVURJKSA-N 0 1 337.423 2.302 50 70 EEIAMN Cc1ccc(C(F)(F)F)cc1C(=O)NCCN1CCC(O)CC1 ZINC000218263396 241309976 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