smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COC(=O)C[C@H]1C(=O)NCC[N@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000159833322 206265139 /nfs/dbraw/zinc/26/51/39/206265139.db2.gz MZAQWTAOJZTTPE-INIZCTEOSA-N 1 2 344.436 2.279 20 70 EEIDLO COC(=O)C[C@H]1C(=O)NCC[N@@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000159833322 206265141 /nfs/dbraw/zinc/26/51/41/206265141.db2.gz MZAQWTAOJZTTPE-INIZCTEOSA-N 1 2 344.436 2.279 20 70 EEIDLO CCc1nn(C)c(Cl)c1C(=O)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000160135782 206281271 /nfs/dbraw/zinc/28/12/71/206281271.db2.gz CZIDLJSIUOSVIK-LLVKDONJSA-N 1 2 333.823 2.040 20 70 EEIDLO CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000160369243 206293620 /nfs/dbraw/zinc/29/36/20/206293620.db2.gz PYMUEHPWVQJYNN-INIZCTEOSA-N 1 2 339.399 2.440 20 70 EEIDLO CN(Cc1[nH+]ccn1C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000160679902 206309070 /nfs/dbraw/zinc/30/90/70/206309070.db2.gz ITUXGDBJUIACRZ-CVEARBPZSA-N 1 2 328.416 2.482 20 70 EEIDLO C[C@H](C(=O)NC1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161183890 206333932 /nfs/dbraw/zinc/33/39/32/206333932.db2.gz VNJVIAFUUPGXHR-MRXNPFEDSA-N 1 2 330.476 2.037 20 70 EEIDLO C[C@H](C(=O)NC1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161183890 206333935 /nfs/dbraw/zinc/33/39/35/206333935.db2.gz VNJVIAFUUPGXHR-MRXNPFEDSA-N 1 2 330.476 2.037 20 70 EEIDLO CC(=O)Nc1cc(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)ccc1F ZINC000161279123 206338914 /nfs/dbraw/zinc/33/89/14/206338914.db2.gz BKBVUZULBGFGJU-AWEZNQCLSA-N 1 2 342.374 2.188 20 70 EEIDLO Cc1ccccc1CS(=O)(=O)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000159367096 311340525 /nfs/dbraw/zinc/34/05/25/311340525.db2.gz OFJITJWOKXQAIF-MRXNPFEDSA-N 1 2 331.441 2.088 20 70 EEIDLO O=C(NCCc1cscn1)Nc1ccccc1C[NH+]1CCOCC1 ZINC000159418464 311341012 /nfs/dbraw/zinc/34/10/12/311341012.db2.gz ZTUNGGYCAWZIHJ-UHFFFAOYSA-N 1 2 346.456 2.340 20 70 EEIDLO CN(CC[N@H+](C)CN1C[C@H](C2CC2)CC1=O)C(=O)OC(C)(C)C ZINC000160532612 311355067 /nfs/dbraw/zinc/35/50/67/311355067.db2.gz PPSWWKQCQTUQHM-CQSZACIVSA-N 1 2 325.453 2.001 20 70 EEIDLO CN(CC[N@@H+](C)CN1C[C@H](C2CC2)CC1=O)C(=O)OC(C)(C)C ZINC000160532612 311355069 /nfs/dbraw/zinc/35/50/69/311355069.db2.gz PPSWWKQCQTUQHM-CQSZACIVSA-N 1 2 325.453 2.001 20 70 EEIDLO Cc1ccccc1CNC(=O)C[NH+]1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000161480645 311366531 /nfs/dbraw/zinc/36/65/31/311366531.db2.gz KHPACTYYDLGKQL-MRXNPFEDSA-N 1 2 344.377 2.246 20 70 EEIDLO O=C(Nc1ccc(CN2CCCC2=O)cc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000160087258 463318815 /nfs/dbraw/zinc/31/88/15/463318815.db2.gz WXFCEHVFPGDEBG-HNNXBMFYSA-N 1 2 338.411 2.207 20 70 EEIDLO Cc1nc2ccccn2c1C[N@@H+](C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000160593548 463352675 /nfs/dbraw/zinc/35/26/75/463352675.db2.gz WIXLHHIOJLRQRR-ZBFHGGJFSA-N 1 2 335.473 2.430 20 70 EEIDLO Cc1nc2ccccn2c1C[N@H+](C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000160593548 463352676 /nfs/dbraw/zinc/35/26/76/463352676.db2.gz WIXLHHIOJLRQRR-ZBFHGGJFSA-N 1 2 335.473 2.430 20 70 EEIDLO Cc1cc(C)c(NC(=O)[C@@H](C)S(=O)(=O)Cc2[nH+]ccn2C)c(C)c1 ZINC000161205101 463409941 /nfs/dbraw/zinc/40/99/41/463409941.db2.gz GJVUUSDIPJSCKB-CQSZACIVSA-N 1 2 349.456 2.287 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCCc2ccccc21 ZINC000160006925 206274293 /nfs/dbraw/zinc/27/42/93/206274293.db2.gz ISVZFSIDJRZIPO-HNNXBMFYSA-N 1 2 334.485 2.420 20 70 EEIDLO CCOC(=O)C[N@@H+]1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160447543 206297752 /nfs/dbraw/zinc/29/77/52/206297752.db2.gz ZCRVXYMJJJJDOM-CYBMUJFWSA-N 1 2 337.395 2.222 20 70 EEIDLO CCOC(=O)C[N@H+]1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160447543 206297757 /nfs/dbraw/zinc/29/77/57/206297757.db2.gz ZCRVXYMJJJJDOM-CYBMUJFWSA-N 1 2 337.395 2.222 20 70 EEIDLO COc1ccccc1C[N@H+](C)Cc1c(C)nn(C)c1N1CCOCC1 ZINC000160426147 206297954 /nfs/dbraw/zinc/29/79/54/206297954.db2.gz JDYCQEJUFVHTQL-UHFFFAOYSA-N 1 2 344.459 2.206 20 70 EEIDLO COc1ccccc1C[N@@H+](C)Cc1c(C)nn(C)c1N1CCOCC1 ZINC000160426147 206297958 /nfs/dbraw/zinc/29/79/58/206297958.db2.gz JDYCQEJUFVHTQL-UHFFFAOYSA-N 1 2 344.459 2.206 20 70 EEIDLO CC(C)C(=O)NCCN(C)C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000160559745 206303933 /nfs/dbraw/zinc/30/39/33/206303933.db2.gz NOGPSAYXSWSGJU-UHFFFAOYSA-N 1 2 343.431 2.323 20 70 EEIDLO Cc1cc(C)c(C(=O)NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)[nH]1 ZINC000159673539 311344292 /nfs/dbraw/zinc/34/42/92/311344292.db2.gz LVJMHUARRZBPJM-KRWDZBQOSA-N 1 2 327.428 2.262 20 70 EEIDLO Cc1cc(C)c(C(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)[nH]1 ZINC000159673539 311344293 /nfs/dbraw/zinc/34/42/93/311344293.db2.gz LVJMHUARRZBPJM-KRWDZBQOSA-N 1 2 327.428 2.262 20 70 EEIDLO Cc1c[nH+]ccc1NS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000159716182 311345228 /nfs/dbraw/zinc/34/52/28/311345228.db2.gz IYYJRQNBMWFKEY-UHFFFAOYSA-N 1 2 331.397 2.421 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000159792324 311346073 /nfs/dbraw/zinc/34/60/73/311346073.db2.gz IJCQHFPDHXVQCZ-HOTGVXAUSA-N 1 2 326.506 2.233 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N2C[C@@H](C)[C@H]([NH+]3CCOCC3)C2)n1 ZINC000160979051 463387265 /nfs/dbraw/zinc/38/72/65/463387265.db2.gz DVTJUDVDKHBTGI-HZPDHXFCSA-N 1 2 349.479 2.114 20 70 EEIDLO Cc1cc(F)ccc1N1CC(=O)C(C(=O)N[C@H]2CCC[C@@H]([NH3+])C2)=N1 ZINC000161452547 463431316 /nfs/dbraw/zinc/43/13/16/463431316.db2.gz BLXHNRRFZDKJJI-OLZOCXBDSA-N 1 2 332.379 2.025 20 70 EEIDLO CCOc1ccccc1NC(=O)[C@H](C)SCC[NH+]1CCOCC1 ZINC000159832607 206265665 /nfs/dbraw/zinc/26/56/65/206265665.db2.gz OIGBOWAHXQZSEP-AWEZNQCLSA-N 1 2 338.473 2.478 20 70 EEIDLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161196919 206333824 /nfs/dbraw/zinc/33/38/24/206333824.db2.gz QDVKWLWAFLODDP-HNNXBMFYSA-N 1 2 349.438 2.197 20 70 EEIDLO C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161185238 206333906 /nfs/dbraw/zinc/33/39/06/206333906.db2.gz ODOLZAKKUKKVBJ-OKZBNKHCSA-N 1 2 344.503 2.377 20 70 EEIDLO C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161185238 206333909 /nfs/dbraw/zinc/33/39/09/206333909.db2.gz ODOLZAKKUKKVBJ-OKZBNKHCSA-N 1 2 344.503 2.377 20 70 EEIDLO C[C@@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)c1nccs1 ZINC000161244064 206336823 /nfs/dbraw/zinc/33/68/23/206336823.db2.gz LISKRLFLCMQDRP-AWEZNQCLSA-N 1 2 345.472 2.169 20 70 EEIDLO CN1CC[C@@H]([NH2+][C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1=O ZINC000161271657 206339242 /nfs/dbraw/zinc/33/92/42/206339242.db2.gz RILHNQDCFPADNE-IAGOWNOFSA-N 1 2 341.386 2.326 20 70 EEIDLO O=C1[C@H]([N@H+](CCO)Cc2cccnc2)CCCN1c1ccccc1F ZINC000161353725 206343917 /nfs/dbraw/zinc/34/39/17/206343917.db2.gz PVFPVMYYXTWEIL-GOSISDBHSA-N 1 2 343.402 2.211 20 70 EEIDLO O=C1[C@H]([N@@H+](CCO)Cc2cccnc2)CCCN1c1ccccc1F ZINC000161353725 206343921 /nfs/dbraw/zinc/34/39/21/206343921.db2.gz PVFPVMYYXTWEIL-GOSISDBHSA-N 1 2 343.402 2.211 20 70 EEIDLO Cc1cc(C(=O)NCC[NH+]2CCN(c3cccc(Cl)c3)CC2)no1 ZINC000161424418 206348028 /nfs/dbraw/zinc/34/80/28/206348028.db2.gz XTRWRUNQSQYQAP-UHFFFAOYSA-N 1 2 348.834 2.188 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)Nc1nc2c(s1)CCCC2 ZINC000159776494 311346141 /nfs/dbraw/zinc/34/61/41/311346141.db2.gz BIDIWYDRGPZUSY-UHFFFAOYSA-N 1 2 341.502 2.026 20 70 EEIDLO CC(C)[C@@H]1CC(=O)N(C[N@H+](C)CCN(C)C(=O)OC(C)(C)C)C1 ZINC000160556348 311355679 /nfs/dbraw/zinc/35/56/79/311355679.db2.gz VQDFUCNMTOYKKX-CQSZACIVSA-N 1 2 327.469 2.247 20 70 EEIDLO CC(C)[C@@H]1CC(=O)N(C[N@@H+](C)CCN(C)C(=O)OC(C)(C)C)C1 ZINC000160556348 311355680 /nfs/dbraw/zinc/35/56/80/311355680.db2.gz VQDFUCNMTOYKKX-CQSZACIVSA-N 1 2 327.469 2.247 20 70 EEIDLO CCOCCCNC(=O)[C@H](C)[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159407464 463284574 /nfs/dbraw/zinc/28/45/74/463284574.db2.gz SISWDBRDTJWPIR-OXJNMPFZSA-N 1 2 346.471 2.092 20 70 EEIDLO CCOCCCNC(=O)[C@H](C)[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159407464 463284576 /nfs/dbraw/zinc/28/45/76/463284576.db2.gz SISWDBRDTJWPIR-OXJNMPFZSA-N 1 2 346.471 2.092 20 70 EEIDLO COC(=O)[C@H](CC(C)C)NC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160188990 463321999 /nfs/dbraw/zinc/32/19/99/463321999.db2.gz SGTMVGWSOMXYHP-DLBZAZTESA-N 1 2 347.459 2.231 20 70 EEIDLO COC(=O)[C@H](CC(C)C)NC(=O)C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160188990 463322002 /nfs/dbraw/zinc/32/20/02/463322002.db2.gz SGTMVGWSOMXYHP-DLBZAZTESA-N 1 2 347.459 2.231 20 70 EEIDLO CCOC(=O)C[C@@H](C)NC(=O)CSCc1cn2cc(C)ccc2[nH+]1 ZINC000160220494 463324242 /nfs/dbraw/zinc/32/42/42/463324242.db2.gz KBRIPLDMNQHBPY-CYBMUJFWSA-N 1 2 349.456 2.334 20 70 EEIDLO C[C@H](NC(=O)N1C[C@H]2OCC[N@H+](C)[C@H]2C1)c1cc2ccccc2o1 ZINC000160663888 463359648 /nfs/dbraw/zinc/35/96/48/463359648.db2.gz LUDFZUKODIGROO-RVSPLBMKSA-N 1 2 329.400 2.218 20 70 EEIDLO C[C@H](NC(=O)N1C[C@H]2OCC[N@@H+](C)[C@H]2C1)c1cc2ccccc2o1 ZINC000160663888 463359651 /nfs/dbraw/zinc/35/96/51/463359651.db2.gz LUDFZUKODIGROO-RVSPLBMKSA-N 1 2 329.400 2.218 20 70 EEIDLO COc1ccc([C@H]2CCN(C(=O)[C@@H]3CCn4cc[nH+]c4C3)C2)cc1 ZINC000161097858 463399423 /nfs/dbraw/zinc/39/94/23/463399423.db2.gz UHFMNFSSYURIAW-CVEARBPZSA-N 1 2 325.412 2.470 20 70 EEIDLO Cc1cccn2cc(CCNC(=O)NC3C[C@H](C)O[C@@H](C)C3)[nH+]c12 ZINC000159630910 539517244 /nfs/dbraw/zinc/51/72/44/539517244.db2.gz XENMQEHNYRMSLM-KBPBESRZSA-N 1 2 330.432 2.440 20 70 EEIDLO CCC[C@@H]1CN(C(=O)NCc2cc[nH+]c(N3CCCC3)c2)CCO1 ZINC000159495890 206248556 /nfs/dbraw/zinc/24/85/56/206248556.db2.gz ZNRUMJWJZKFGAX-MRXNPFEDSA-N 1 2 332.448 2.392 20 70 EEIDLO C[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000159995058 206275224 /nfs/dbraw/zinc/27/52/24/206275224.db2.gz GPUHJZLLHMYYGD-ZBFHGGJFSA-N 1 2 336.399 2.187 20 70 EEIDLO CCCC[N@H+](Cc1cccc2c1OCO2)[C@H]1CCS(=O)(=O)C1 ZINC000160764597 206313340 /nfs/dbraw/zinc/31/33/40/206313340.db2.gz OAARAHUYZGEBQU-AWEZNQCLSA-N 1 2 325.430 2.205 20 70 EEIDLO CCCC[N@@H+](Cc1cccc2c1OCO2)[C@H]1CCS(=O)(=O)C1 ZINC000160764597 206313345 /nfs/dbraw/zinc/31/33/45/206313345.db2.gz OAARAHUYZGEBQU-AWEZNQCLSA-N 1 2 325.430 2.205 20 70 EEIDLO COc1ccc(OC)c(CN2CC[NH+](Cc3cn(C)nc3C)CC2)c1 ZINC000161041877 206325740 /nfs/dbraw/zinc/32/57/40/206325740.db2.gz XAHPIZWXMJWZMA-UHFFFAOYSA-N 1 2 344.459 2.064 20 70 EEIDLO COc1ccc(OC)c(C[NH+]2CCN(Cc3cn(C)nc3C)CC2)c1 ZINC000161041877 206325744 /nfs/dbraw/zinc/32/57/44/206325744.db2.gz XAHPIZWXMJWZMA-UHFFFAOYSA-N 1 2 344.459 2.064 20 70 EEIDLO CC[C@H](C)c1ccc(NC(=O)CS(=O)(=O)Cc2[nH+]ccn2C)cc1 ZINC000161184494 159721298 /nfs/dbraw/zinc/72/12/98/159721298.db2.gz PAPKMUUKOPCTSF-ZDUSSCGKSA-N 1 2 349.456 2.487 20 70 EEIDLO COC(=O)CC[C@@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000161457567 159725694 /nfs/dbraw/zinc/72/56/94/159725694.db2.gz AFHBLUYDWKRHOA-HZPDHXFCSA-N 1 2 341.411 2.256 20 70 EEIDLO CC(C)C[C@@H](C)NC(=O)c1ccccc1S(=O)(=O)CC[NH+](C)C ZINC000160003440 311348860 /nfs/dbraw/zinc/34/88/60/311348860.db2.gz WOBGWBPDLNJLNR-CQSZACIVSA-N 1 2 340.489 2.186 20 70 EEIDLO COc1cc(C(=O)NCCc2cn3ccccc3[nH+]2)cc(OC)c1O ZINC000161242108 311363764 /nfs/dbraw/zinc/36/37/64/311363764.db2.gz NIUHHJCLTVYQHC-UHFFFAOYSA-N 1 2 341.367 2.030 20 70 EEIDLO CC(C)[C@@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1nc(C2CC2)no1 ZINC000161309341 463418055 /nfs/dbraw/zinc/41/80/55/463418055.db2.gz RSKATIFENFJSNB-TZMCWYRMSA-N 1 2 329.404 2.219 20 70 EEIDLO O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccnc(-n2cc[nH+]c2)c1 ZINC000159871432 206268667 /nfs/dbraw/zinc/26/86/67/206268667.db2.gz LZONXINDKZWIRW-OAHLLOKOSA-N 1 2 326.400 2.489 20 70 EEIDLO CN(C[C@@H]1CCC[C@@H]1O)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000159934552 206272060 /nfs/dbraw/zinc/27/20/60/206272060.db2.gz HKISLIHCTWGJNF-RDJZCZTQSA-N 1 2 328.416 2.175 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(F)c(F)c1 ZINC000159919239 206270340 /nfs/dbraw/zinc/27/03/40/206270340.db2.gz YLMJNOHLVOLHLJ-NSHDSACASA-N 1 2 330.400 2.357 20 70 EEIDLO CC[N@H+](Cc1ccc(OC(F)F)c(F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160537402 206303599 /nfs/dbraw/zinc/30/35/99/206303599.db2.gz ANOOAKVALPFASR-LLVKDONJSA-N 1 2 337.363 2.436 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC(F)F)c(F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160537402 206303604 /nfs/dbraw/zinc/30/36/04/206303604.db2.gz ANOOAKVALPFASR-LLVKDONJSA-N 1 2 337.363 2.436 20 70 EEIDLO O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161194732 255802173 /nfs/dbraw/zinc/80/21/73/255802173.db2.gz QVQABTPNCPYUPE-CYBMUJFWSA-N 1 2 335.367 2.247 20 70 EEIDLO CC[C@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC2(C1)OCCO2 ZINC000160602433 281278162 /nfs/dbraw/zinc/27/81/62/281278162.db2.gz OOUBYUPVCVJINZ-AWEZNQCLSA-N 1 2 336.457 2.033 20 70 EEIDLO CC[C@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC2(C1)OCCO2 ZINC000160602433 281278164 /nfs/dbraw/zinc/27/81/64/281278164.db2.gz OOUBYUPVCVJINZ-AWEZNQCLSA-N 1 2 336.457 2.033 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000159792196 311346232 /nfs/dbraw/zinc/34/62/32/311346232.db2.gz IJCQHFPDHXVQCZ-JKSUJKDBSA-N 1 2 326.506 2.233 20 70 EEIDLO c1ccc(CCc2noc(CSCC[NH+]3CCOCC3)n2)cc1 ZINC000159934014 311347952 /nfs/dbraw/zinc/34/79/52/311347952.db2.gz CXNIUUGOWUEDAL-UHFFFAOYSA-N 1 2 333.457 2.420 20 70 EEIDLO CC(C)[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCC[C@H](C)C1 ZINC000159957752 311348486 /nfs/dbraw/zinc/34/84/86/311348486.db2.gz QKWJMMXSENJMPF-HOTGVXAUSA-N 1 2 328.522 2.335 20 70 EEIDLO COc1ccc(-c2nc(SCCn3cc[nH+]c3)n[nH]2)c(OC)c1 ZINC000160108969 311350181 /nfs/dbraw/zinc/35/01/81/311350181.db2.gz PMAFSWMPIMXAAE-UHFFFAOYSA-N 1 2 331.401 2.478 20 70 EEIDLO COc1ccc(-c2n[nH]c(SCCn3cc[nH+]c3)n2)c(OC)c1 ZINC000160108969 311350182 /nfs/dbraw/zinc/35/01/82/311350182.db2.gz PMAFSWMPIMXAAE-UHFFFAOYSA-N 1 2 331.401 2.478 20 70 EEIDLO CC[N@H+](CC(=O)NCCc1ccc(Cl)cc1)Cc1cnn(C)c1 ZINC000161078549 311361880 /nfs/dbraw/zinc/36/18/80/311361880.db2.gz HDDRLUQWVBYHLT-UHFFFAOYSA-N 1 2 334.851 2.254 20 70 EEIDLO CC[N@@H+](CC(=O)NCCc1ccc(Cl)cc1)Cc1cnn(C)c1 ZINC000161078549 311361881 /nfs/dbraw/zinc/36/18/81/311361881.db2.gz HDDRLUQWVBYHLT-UHFFFAOYSA-N 1 2 334.851 2.254 20 70 EEIDLO CC[N@H+](CC(=O)N(Cc1ccc(C)o1)C1CC1)Cc1cnn(C)c1 ZINC000161130291 463401768 /nfs/dbraw/zinc/40/17/68/463401768.db2.gz CLTUFCHQHXWBKP-UHFFFAOYSA-N 1 2 330.432 2.335 20 70 EEIDLO CC[N@@H+](CC(=O)N(Cc1ccc(C)o1)C1CC1)Cc1cnn(C)c1 ZINC000161130291 463401771 /nfs/dbraw/zinc/40/17/71/463401771.db2.gz CLTUFCHQHXWBKP-UHFFFAOYSA-N 1 2 330.432 2.335 20 70 EEIDLO O=C(c1ccnc(Cl)c1F)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161078039 206326027 /nfs/dbraw/zinc/32/60/27/206326027.db2.gz NDUIRTXVQCDNIT-UHFFFAOYSA-N 1 2 334.782 2.227 20 70 EEIDLO Cn1c(C[N@@H+]2CCC[C@@H]2C(N)=O)nc2cc(C(F)(F)F)ccc21 ZINC000160325961 279307478 /nfs/dbraw/zinc/30/74/78/279307478.db2.gz HIDIXQAEWXWBDV-GFCCVEGCSA-N 1 2 326.322 2.042 20 70 EEIDLO Cn1c(C[N@H+]2CCC[C@@H]2C(N)=O)nc2cc(C(F)(F)F)ccc21 ZINC000160325961 279307480 /nfs/dbraw/zinc/30/74/80/279307480.db2.gz HIDIXQAEWXWBDV-GFCCVEGCSA-N 1 2 326.322 2.042 20 70 EEIDLO COc1ccc(C)cc1NC(=O)[C@H](C)SCC[NH+]1CCOCC1 ZINC000159789548 311346104 /nfs/dbraw/zinc/34/61/04/311346104.db2.gz FLXIITUANSXYHE-AWEZNQCLSA-N 1 2 338.473 2.396 20 70 EEIDLO CC[N@H+](CC(=O)N[C@@H](C)c1ccccc1OC)Cc1cnn(C)c1 ZINC000161091781 311361973 /nfs/dbraw/zinc/36/19/73/311361973.db2.gz CRMNCTRVJXZFCK-AWEZNQCLSA-N 1 2 330.432 2.128 20 70 EEIDLO CC[N@@H+](CC(=O)N[C@@H](C)c1ccccc1OC)Cc1cnn(C)c1 ZINC000161091781 311361974 /nfs/dbraw/zinc/36/19/74/311361974.db2.gz CRMNCTRVJXZFCK-AWEZNQCLSA-N 1 2 330.432 2.128 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)[N@@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159401811 463284492 /nfs/dbraw/zinc/28/44/92/463284492.db2.gz ULBCTIRDOSXBFU-YYAJDYIMSA-N 1 2 348.491 2.146 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)[N@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159401811 463284493 /nfs/dbraw/zinc/28/44/93/463284493.db2.gz ULBCTIRDOSXBFU-YYAJDYIMSA-N 1 2 348.491 2.146 20 70 EEIDLO C[C@@H](C(=O)NCc1ccccc1C[NH+]1CCOCC1)C1CCOCC1 ZINC000159728655 463301466 /nfs/dbraw/zinc/30/14/66/463301466.db2.gz TYTANUYWVQQJOP-MRXNPFEDSA-N 1 2 346.471 2.198 20 70 EEIDLO CCc1cccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000161157432 539525078 /nfs/dbraw/zinc/52/50/78/539525078.db2.gz BONJUXLDIHGSMU-UHFFFAOYSA-N 1 2 338.455 2.400 20 70 EEIDLO CS(=O)(=O)NCC[C@@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000161434092 539528307 /nfs/dbraw/zinc/52/83/07/539528307.db2.gz SJVUGMRVKPDZBR-AWEZNQCLSA-N 1 2 343.518 2.314 20 70 EEIDLO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000161434092 539528313 /nfs/dbraw/zinc/52/83/13/539528313.db2.gz SJVUGMRVKPDZBR-AWEZNQCLSA-N 1 2 343.518 2.314 20 70 EEIDLO CC(C)c1ccc(C(=O)N2CCN(C3=[NH+]C[C@@H](C)S3)CC2)cn1 ZINC000159724269 206261117 /nfs/dbraw/zinc/26/11/17/206261117.db2.gz SCYDKVXTFRLZKD-CYBMUJFWSA-N 1 2 332.473 2.454 20 70 EEIDLO CC1(NC(=O)NCc2cccc(OCC[NH+]3CCOCC3)c2)CCC1 ZINC000160052562 206278340 /nfs/dbraw/zinc/27/83/40/206278340.db2.gz SPCOQMSIXJTMHP-UHFFFAOYSA-N 1 2 347.459 2.139 20 70 EEIDLO CCn1nccc1C[N@H+](CC)CC(=O)Nc1ccc2c(c1)OCCO2 ZINC000160670894 206309028 /nfs/dbraw/zinc/30/90/28/206309028.db2.gz AKZAIFTXHNNKAR-UHFFFAOYSA-N 1 2 344.415 2.135 20 70 EEIDLO CCn1nccc1C[N@@H+](CC)CC(=O)Nc1ccc2c(c1)OCCO2 ZINC000160670894 206309032 /nfs/dbraw/zinc/30/90/32/206309032.db2.gz AKZAIFTXHNNKAR-UHFFFAOYSA-N 1 2 344.415 2.135 20 70 EEIDLO COC(=O)c1ccc(C[N@H+](C)CCCS(=O)(=O)C(C)C)cc1 ZINC000160784291 206312119 /nfs/dbraw/zinc/31/21/19/206312119.db2.gz LDJIBOCWCRYXDD-UHFFFAOYSA-N 1 2 327.446 2.118 20 70 EEIDLO COC(=O)c1ccc(C[N@@H+](C)CCCS(=O)(=O)C(C)C)cc1 ZINC000160784291 206312124 /nfs/dbraw/zinc/31/21/24/206312124.db2.gz LDJIBOCWCRYXDD-UHFFFAOYSA-N 1 2 327.446 2.118 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCC(NC(=O)OC(C)(C)C)CC2)n1 ZINC000160871998 206317203 /nfs/dbraw/zinc/31/72/03/206317203.db2.gz MYTPEIOXMCRBPY-UHFFFAOYSA-N 1 2 336.436 2.234 20 70 EEIDLO CCCOc1cccc(C[NH+]2CCN(C(=O)[C@H]3CCCO3)CC2)c1 ZINC000161016617 206324193 /nfs/dbraw/zinc/32/41/93/206324193.db2.gz OHCOFXXGBXGTQW-GOSISDBHSA-N 1 2 332.444 2.299 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161185110 206334704 /nfs/dbraw/zinc/33/47/04/206334704.db2.gz ODOLZAKKUKKVBJ-FGTMMUONSA-N 1 2 344.503 2.377 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161185110 206334708 /nfs/dbraw/zinc/33/47/08/206334708.db2.gz ODOLZAKKUKKVBJ-FGTMMUONSA-N 1 2 344.503 2.377 20 70 EEIDLO CN(CC1(O)CCCC1)C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161386575 206345333 /nfs/dbraw/zinc/34/53/33/206345333.db2.gz CXEIDCOWZGCNMU-UHFFFAOYSA-N 1 2 347.459 2.288 20 70 EEIDLO COC(=O)c1ccc(N(C)Cc2[nH+]ccn2Cc2ccccc2)nn1 ZINC000159714058 311345195 /nfs/dbraw/zinc/34/51/95/311345195.db2.gz WYNCMGNLYQAKCI-UHFFFAOYSA-N 1 2 337.383 2.144 20 70 EEIDLO COC(=O)[C@@H](C)[N@@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000159854043 463307968 /nfs/dbraw/zinc/30/79/68/463307968.db2.gz CYARVUHAOOMZGR-GFCCVEGCSA-N 1 2 339.823 2.441 20 70 EEIDLO COC(=O)[C@@H](C)[N@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000159854043 463307973 /nfs/dbraw/zinc/30/79/73/463307973.db2.gz CYARVUHAOOMZGR-GFCCVEGCSA-N 1 2 339.823 2.441 20 70 EEIDLO CC(C)n1cc[nH+]c1CS(=O)(=O)CC(=O)N(C)C1CCCCC1 ZINC000161216127 463410258 /nfs/dbraw/zinc/41/02/58/463410258.db2.gz ZDWCURPGEDOXNE-UHFFFAOYSA-N 1 2 341.477 2.170 20 70 EEIDLO CCc1nnc(C[NH2+][C@H](C)c2ccc(OCCOC)c(OC)c2)[nH]1 ZINC000160326821 206291662 /nfs/dbraw/zinc/29/16/62/206291662.db2.gz VWUKGYJZTXBQGW-GFCCVEGCSA-N 1 2 334.420 2.252 20 70 EEIDLO CC(C)c1ccc(N2CC[C@@H](C(=O)NCCn3cc[nH+]c3)C2=O)cc1 ZINC000160451762 206297476 /nfs/dbraw/zinc/29/74/76/206297476.db2.gz QWYKHMJVAYIRIE-KRWDZBQOSA-N 1 2 340.427 2.176 20 70 EEIDLO CO[C@@]1(C)C[C@H](NC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1(C)C ZINC000160518313 206302291 /nfs/dbraw/zinc/30/22/91/206302291.db2.gz SVGKPVKNNPOOEO-LPHOPBHVSA-N 1 2 346.475 2.112 20 70 EEIDLO COC(=O)c1ccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000160734664 206311794 /nfs/dbraw/zinc/31/17/94/206311794.db2.gz DINZYOYETATQPV-HNNXBMFYSA-N 1 2 340.383 2.269 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCNC(=O)N[C@H](CCO)C(C)(C)C ZINC000161450562 206349140 /nfs/dbraw/zinc/34/91/40/206349140.db2.gz LQOWNQDSSXUCBY-MRXNPFEDSA-N 1 2 332.448 2.441 20 70 EEIDLO O=C(NCc1ccc(N2CCCCCC2)[nH+]c1)C1(O)CCSCC1 ZINC000159799870 463305451 /nfs/dbraw/zinc/30/54/51/463305451.db2.gz QLSFKPWYCWNAJY-UHFFFAOYSA-N 1 2 349.500 2.336 20 70 EEIDLO CC[C@@H](C)OCC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCOCC1 ZINC000159756528 529377397 /nfs/dbraw/zinc/37/73/97/529377397.db2.gz PDZDWKINKGTZBW-SJLPKXTDSA-N 1 2 334.460 2.300 20 70 EEIDLO CCc1ccc(/C=C/C(=O)Nc2cnn(CC[NH+]3CCOCC3)c2)o1 ZINC000159910447 529584851 /nfs/dbraw/zinc/58/48/51/529584851.db2.gz IAWBKMPDBVQUHW-AATRIKPKSA-N 1 2 344.415 2.023 20 70 EEIDLO C[N@@H+]1CCc2nc(NC(=O)C[C@H]3CSCCS3)sc2C1 ZINC000160002088 283175235 /nfs/dbraw/zinc/17/52/35/283175235.db2.gz PBCJKRDCJYXEBU-VIFPVBQESA-N 1 2 329.516 2.308 20 70 EEIDLO C[N@H+]1CCc2nc(NC(=O)C[C@H]3CSCCS3)sc2C1 ZINC000160002088 283175236 /nfs/dbraw/zinc/17/52/36/283175236.db2.gz PBCJKRDCJYXEBU-VIFPVBQESA-N 1 2 329.516 2.308 20 70 EEIDLO C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CCC4)C3)c[nH+]2)CCO1 ZINC000160077397 225334277 /nfs/dbraw/zinc/33/42/77/225334277.db2.gz VFFGAPAPRMGCRX-HNNXBMFYSA-N 1 2 344.459 2.392 20 70 EEIDLO C[C@H]([NH2+]CC1(N2CCOCC2)CCCCC1)C(=O)OC(C)(C)C ZINC000160658197 311356997 /nfs/dbraw/zinc/35/69/97/311356997.db2.gz MIELZMIYMZOSSU-HNNXBMFYSA-N 1 2 326.481 2.341 20 70 EEIDLO CC[N@H+](Cc1cn(-c2ccccc2)nc1C)[C@H]1CCS(=O)(=O)C1 ZINC000160539618 463348450 /nfs/dbraw/zinc/34/84/50/463348450.db2.gz HLPMGNDDUUKYCS-KRWDZBQOSA-N 1 2 333.457 2.190 20 70 EEIDLO CC[N@@H+](Cc1cn(-c2ccccc2)nc1C)[C@H]1CCS(=O)(=O)C1 ZINC000160539618 463348451 /nfs/dbraw/zinc/34/84/51/463348451.db2.gz HLPMGNDDUUKYCS-KRWDZBQOSA-N 1 2 333.457 2.190 20 70 EEIDLO Cc1ccoc1C[NH+]1CCN(C(=O)COc2ccc(F)cc2)CC1 ZINC000160617539 463355865 /nfs/dbraw/zinc/35/58/65/463355865.db2.gz YUALAPYEPNYQKE-UHFFFAOYSA-N 1 2 332.375 2.450 20 70 EEIDLO COc1cc2nc(N[C@@H](CO)CC(C)(C)C)[nH+]c(N)c2cc1OC ZINC000161468503 463432035 /nfs/dbraw/zinc/43/20/35/463432035.db2.gz REVRZZSFQYSZIC-SNVBAGLBSA-N 1 2 334.420 2.438 20 70 EEIDLO O=C(N[C@H]1CCN(c2cccc[nH+]2)C1)c1ccc2nsnc2c1 ZINC000218082013 464108491 /nfs/dbraw/zinc/10/84/91/464108491.db2.gz RYVNWUNSEHAYOR-LBPRGKRZSA-N 1 2 325.397 2.095 20 70 EEIDLO Cc1cc(S(=O)(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc(C)c1F ZINC000159380408 225207522 /nfs/dbraw/zinc/20/75/22/225207522.db2.gz QDKZWWCVTXGOIU-AWEZNQCLSA-N 1 2 349.431 2.395 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)Nc1cccnc1Cl ZINC000159872122 225293475 /nfs/dbraw/zinc/29/34/75/225293475.db2.gz ZXPVTXRGVTTXJJ-NSHDSACASA-N 1 2 329.853 2.127 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N[C@H](c1ccccc1)C1CC1 ZINC000159978076 225314036 /nfs/dbraw/zinc/31/40/36/225314036.db2.gz GGEPPTPTSSHNDY-GOSISDBHSA-N 1 2 334.485 2.319 20 70 EEIDLO C[C@H](C(=O)NCC(C)(C)[NH+]1CCOCC1)c1c(F)cccc1F ZINC000160331129 225388168 /nfs/dbraw/zinc/38/81/68/225388168.db2.gz NIVMPPWZCZQFDJ-LBPRGKRZSA-N 1 2 326.387 2.295 20 70 EEIDLO CC(C)c1nc(N(C)C)nc(NCCCOCC2CCOCC2)[nH+]1 ZINC000159957372 311348453 /nfs/dbraw/zinc/34/84/53/311348453.db2.gz QMDBWEYWDSLLQR-UHFFFAOYSA-N 1 2 337.468 2.306 20 70 EEIDLO CC(C)c1nc(NCCCOCC2CCOCC2)nc(N(C)C)[nH+]1 ZINC000159957372 311348455 /nfs/dbraw/zinc/34/84/55/311348455.db2.gz QMDBWEYWDSLLQR-UHFFFAOYSA-N 1 2 337.468 2.306 20 70 EEIDLO COCCCOC1CCN(c2nc(C(C)C)[nH+]c(N(C)C)n2)CC1 ZINC000160000413 311348899 /nfs/dbraw/zinc/34/88/99/311348899.db2.gz YHKXTUOPEYIRQS-UHFFFAOYSA-N 1 2 337.468 2.083 20 70 EEIDLO COCCCOC1CCN(c2nc(N(C)C)nc(C(C)C)[nH+]2)CC1 ZINC000160000413 311348902 /nfs/dbraw/zinc/34/89/02/311348902.db2.gz YHKXTUOPEYIRQS-UHFFFAOYSA-N 1 2 337.468 2.083 20 70 EEIDLO CC(C)N(C[C@@H](C)O)C(=O)NCc1cccc(Cn2cc[nH+]c2)c1 ZINC000160139646 311350442 /nfs/dbraw/zinc/35/04/42/311350442.db2.gz OQOSYSMMMNGMIB-OAHLLOKOSA-N 1 2 330.432 2.232 20 70 EEIDLO C[C@H](NC(=O)N1C[C@H]2OCC[N@H+](C)[C@@H]2C1)c1cc2ccccc2o1 ZINC000160663626 311357559 /nfs/dbraw/zinc/35/75/59/311357559.db2.gz LUDFZUKODIGROO-DXCKQFNASA-N 1 2 329.400 2.218 20 70 EEIDLO C[C@H](NC(=O)N1C[C@H]2OCC[N@@H+](C)[C@@H]2C1)c1cc2ccccc2o1 ZINC000160663626 311357561 /nfs/dbraw/zinc/35/75/61/311357561.db2.gz LUDFZUKODIGROO-DXCKQFNASA-N 1 2 329.400 2.218 20 70 EEIDLO CCCn1nc(C)c(C[N@H+](CCC)[C@@H]2CCS(=O)(=O)C2)c1C ZINC000161075514 311361919 /nfs/dbraw/zinc/36/19/19/311361919.db2.gz UATHREAWFWXSIY-OAHLLOKOSA-N 1 2 327.494 2.309 20 70 EEIDLO CCCn1nc(C)c(C[N@@H+](CCC)[C@@H]2CCS(=O)(=O)C2)c1C ZINC000161075514 311361921 /nfs/dbraw/zinc/36/19/21/311361921.db2.gz UATHREAWFWXSIY-OAHLLOKOSA-N 1 2 327.494 2.309 20 70 EEIDLO Cn1cc[nH+]c1CN1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 ZINC000160732456 463365473 /nfs/dbraw/zinc/36/54/73/463365473.db2.gz ZWLPCSLSLLHLFU-UHFFFAOYSA-N 1 2 342.487 2.281 20 70 EEIDLO Cc1cc2ccccc2[nH+]c1NCCNS(=O)(=O)c1cccnc1 ZINC000161201219 463409480 /nfs/dbraw/zinc/40/94/80/463409480.db2.gz UDXJVOYSJGFOFX-UHFFFAOYSA-N 1 2 342.424 2.329 20 70 EEIDLO CCCN(C(=O)c1cccs1)C1CC[NH+](Cc2nncn2C)CC1 ZINC000159779532 311346247 /nfs/dbraw/zinc/34/62/47/311346247.db2.gz ZHEWCOKITITJTN-UHFFFAOYSA-N 1 2 347.488 2.393 20 70 EEIDLO COc1cccc(-c2cc(C(=O)N(C)[C@H]3CCC[N@H+](C)C3)n[nH]2)c1 ZINC000159909171 311347810 /nfs/dbraw/zinc/34/78/10/311347810.db2.gz KRKJEOOFDKKDON-AWEZNQCLSA-N 1 2 328.416 2.252 20 70 EEIDLO COc1cccc(-c2cc(C(=O)N(C)[C@H]3CCC[N@@H+](C)C3)n[nH]2)c1 ZINC000159909171 311347811 /nfs/dbraw/zinc/34/78/11/311347811.db2.gz KRKJEOOFDKKDON-AWEZNQCLSA-N 1 2 328.416 2.252 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@@H](C)C1CCOCC1 ZINC000160512402 463345473 /nfs/dbraw/zinc/34/54/73/463345473.db2.gz VNJPRDFEEXDSTC-ZDUSSCGKSA-N 1 2 333.432 2.228 20 70 EEIDLO C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@H]1n1cc[nH+]c1 ZINC000160531960 463346726 /nfs/dbraw/zinc/34/67/26/463346726.db2.gz AFHJGBYKQCFUGJ-DZUCGIPZSA-N 1 2 332.448 2.433 20 70 EEIDLO CC(C)(CNC(=O)NC1(c2cccc(F)c2)CC1)[NH+]1CCOCC1 ZINC000160918072 463381964 /nfs/dbraw/zinc/38/19/64/463381964.db2.gz RBKXMPLKSSNLGJ-UHFFFAOYSA-N 1 2 335.423 2.225 20 70 EEIDLO C[C@@H]1CCC[C@@H](C(=O)N2CC[NH+](CC(=O)N3CCCC[C@@H]3C)CC2)C1 ZINC000159922427 143805030 /nfs/dbraw/zinc/80/50/30/143805030.db2.gz OEJWJERPQWBOFP-FGTMMUONSA-N 1 2 349.519 2.358 20 70 EEIDLO O=C(NC1CC1)[C@H](SCC[NH+]1CCOCC1)c1ccc(F)cc1 ZINC000159786977 311346067 /nfs/dbraw/zinc/34/60/67/311346067.db2.gz FWCYZCRVZOLFPS-MRXNPFEDSA-N 1 2 338.448 2.211 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000159815492 311346429 /nfs/dbraw/zinc/34/64/29/311346429.db2.gz MHIKIBJEPIMTDS-OAHLLOKOSA-N 1 2 344.436 2.279 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000159815492 311346430 /nfs/dbraw/zinc/34/64/30/311346430.db2.gz MHIKIBJEPIMTDS-OAHLLOKOSA-N 1 2 344.436 2.279 20 70 EEIDLO C[C@@H]1CCC[C@H](NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)[C@@H]1C ZINC000161142192 311362776 /nfs/dbraw/zinc/36/27/76/311362776.db2.gz IZHPSVBXFDHNCH-LMMKCTJWSA-N 1 2 344.503 2.140 20 70 EEIDLO CC(C)c1ccc(S(=O)(=O)NC[C@H](C)C[NH+]2CCOCC2)cc1 ZINC000160382381 463332789 /nfs/dbraw/zinc/33/27/89/463332789.db2.gz CNFUJWBCUKOGQU-HNNXBMFYSA-N 1 2 340.489 2.057 20 70 EEIDLO C[N@H+](CCOc1cc(Cl)cc(Cl)c1)CCS(C)(=O)=O ZINC000160431053 463338498 /nfs/dbraw/zinc/33/84/98/463338498.db2.gz OXANYCXJZJOAKG-UHFFFAOYSA-N 1 2 326.245 2.349 20 70 EEIDLO C[N@@H+](CCOc1cc(Cl)cc(Cl)c1)CCS(C)(=O)=O ZINC000160431053 463338502 /nfs/dbraw/zinc/33/85/02/463338502.db2.gz OXANYCXJZJOAKG-UHFFFAOYSA-N 1 2 326.245 2.349 20 70 EEIDLO O=C([C@H]1CCn2cc[nH+]c2C1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000160752490 463367878 /nfs/dbraw/zinc/36/78/78/463367878.db2.gz QCBJERMPIGJGPL-AWEZNQCLSA-N 1 2 344.846 2.448 20 70 EEIDLO Cc1ccc(C)c(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000161148813 463404876 /nfs/dbraw/zinc/40/48/76/463404876.db2.gz OXYMKTGEDZSNOV-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO CCN(C(=O)CN1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000161155753 463405235 /nfs/dbraw/zinc/40/52/35/463405235.db2.gz YRILUPGASJYZAR-UHFFFAOYSA-N 1 2 338.455 2.252 20 70 EEIDLO CC[C@@H](C)c1ccc(NC(=O)CS(=O)(=O)Cc2[nH+]ccn2C)cc1 ZINC000161184380 463408296 /nfs/dbraw/zinc/40/82/96/463408296.db2.gz PAPKMUUKOPCTSF-CYBMUJFWSA-N 1 2 349.456 2.487 20 70 EEIDLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)CS(=O)(=O)C(C)(C)C ZINC000160092714 526594179 /nfs/dbraw/zinc/59/41/79/526594179.db2.gz XLJUVGMQDCJXTO-UHFFFAOYSA-N 1 2 328.434 2.411 20 70 EEIDLO C[C@@H](C(=O)N1CCC[N@H+](CC(=O)N2CCCC2)CC1)c1cccs1 ZINC000160063600 533199242 /nfs/dbraw/zinc/19/92/42/533199242.db2.gz NJDVJBHRKDCWFE-OAHLLOKOSA-N 1 2 349.500 2.008 20 70 EEIDLO C[C@@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)c1cccs1 ZINC000160063600 533199248 /nfs/dbraw/zinc/19/92/48/533199248.db2.gz NJDVJBHRKDCWFE-OAHLLOKOSA-N 1 2 349.500 2.008 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)NCc1ccc(Cl)cc1 ZINC000159962582 225310009 /nfs/dbraw/zinc/31/00/09/225310009.db2.gz AYQHJBJJOONKNK-ZDUSSCGKSA-N 1 2 342.892 2.410 20 70 EEIDLO CCCCn1ncc(NC(=O)N[C@H](C)[C@H](C)[NH+]2CCOCC2)c1C ZINC000159800826 311346476 /nfs/dbraw/zinc/34/64/76/311346476.db2.gz WMABXQOGZFTHRG-KGLIPLIRSA-N 1 2 337.468 2.222 20 70 EEIDLO CC[C@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(OC)cc1 ZINC000159875006 311347378 /nfs/dbraw/zinc/34/73/78/311347378.db2.gz KGDUCLSPVIUQNV-INIZCTEOSA-N 1 2 338.473 2.478 20 70 EEIDLO CC(C)CN(CC(C)C)C(=O)CN1CC[NH+](Cc2ccncc2)CC1 ZINC000161161662 311362731 /nfs/dbraw/zinc/36/27/31/311362731.db2.gz KXWUDGKQMRMPCQ-UHFFFAOYSA-N 1 2 346.519 2.340 20 70 EEIDLO O=C(C[NH+]1CCC([C@H](O)C(F)(F)F)CC1)NCc1ccccc1F ZINC000161423076 311365570 /nfs/dbraw/zinc/36/55/70/311365570.db2.gz XETVEKNCSKVYDD-HNNXBMFYSA-N 1 2 348.340 2.077 20 70 EEIDLO C[C@@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)COCc1ccccc1 ZINC000160390968 463335107 /nfs/dbraw/zinc/33/51/07/463335107.db2.gz RQDSYWVDZGQJQX-DOTOQJQBSA-N 1 2 327.428 2.415 20 70 EEIDLO Cc1cccc2c(CCC(=O)N[C@@H](C)C[NH+]3CCOCC3)c[nH]c21 ZINC000160597325 463353683 /nfs/dbraw/zinc/35/36/83/463353683.db2.gz XBBIDPKYSNIFSI-HNNXBMFYSA-N 1 2 329.444 2.246 20 70 EEIDLO COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000160741599 463367185 /nfs/dbraw/zinc/36/71/85/463367185.db2.gz FFOYZDRXPCEGCL-HNNXBMFYSA-N 1 2 340.383 2.269 20 70 EEIDLO CC(C)c1ccc(C(=O)NCc2ccc[nH+]c2N2CCOCC2)cn1 ZINC000160902392 463380201 /nfs/dbraw/zinc/38/02/01/463380201.db2.gz JCCZJOAMWGEYEU-UHFFFAOYSA-N 1 2 340.427 2.367 20 70 EEIDLO CC(C)c1ccccc1NC(=O)[C@@H](C)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161167555 463406834 /nfs/dbraw/zinc/40/68/34/463406834.db2.gz CQIXFRAIMKQEEG-CYBMUJFWSA-N 1 2 349.456 2.486 20 70 EEIDLO CCSc1cc(Cl)ccc1C(=O)NC[C@H]1C[NH+]2CCN1CC2 ZINC000161316233 463419183 /nfs/dbraw/zinc/41/91/83/463419183.db2.gz XARPWJMNLOSESN-ZDUSSCGKSA-N 1 2 339.892 2.182 20 70 EEIDLO CCNC(=O)C(C)(C)CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000161348133 463424094 /nfs/dbraw/zinc/42/40/94/463424094.db2.gz WUNYEHBLJXQRRR-UHFFFAOYSA-N 1 2 338.415 2.390 20 70 EEIDLO C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@@H]1n1cc[nH+]c1 ZINC000160531755 296519249 /nfs/dbraw/zinc/51/92/49/296519249.db2.gz AFHJGBYKQCFUGJ-SIXLDLHFSA-N 1 2 332.448 2.433 20 70 EEIDLO Cc1ccccc1CS(=O)(=O)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000159367215 311340663 /nfs/dbraw/zinc/34/06/63/311340663.db2.gz OFJITJWOKXQAIF-INIZCTEOSA-N 1 2 331.441 2.088 20 70 EEIDLO C[C@H](C(=O)N1CC[NH+](CCOc2ccccc2)CC1)C1CCOCC1 ZINC000159505733 311342149 /nfs/dbraw/zinc/34/21/49/311342149.db2.gz CQZNPDXWIMUBPC-KRWDZBQOSA-N 1 2 346.471 2.272 20 70 EEIDLO CC[N@H+](CC(=O)NCc1ccc(F)cc1)Cc1cc(C(N)=O)cs1 ZINC000160237319 311351587 /nfs/dbraw/zinc/35/15/87/311351587.db2.gz OVIJCFZXLALKAP-UHFFFAOYSA-N 1 2 349.431 2.124 20 70 EEIDLO CC[N@@H+](CC(=O)NCc1ccc(F)cc1)Cc1cc(C(N)=O)cs1 ZINC000160237319 311351590 /nfs/dbraw/zinc/35/15/90/311351590.db2.gz OVIJCFZXLALKAP-UHFFFAOYSA-N 1 2 349.431 2.124 20 70 EEIDLO C[C@@H]([NH2+]CC1(N2CCOCC2)CCCCC1)C(=O)OC(C)(C)C ZINC000160658332 311356858 /nfs/dbraw/zinc/35/68/58/311356858.db2.gz MIELZMIYMZOSSU-OAHLLOKOSA-N 1 2 326.481 2.341 20 70 EEIDLO CCOC(=O)C[N@@H+]1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160447672 463339711 /nfs/dbraw/zinc/33/97/11/463339711.db2.gz ZCRVXYMJJJJDOM-ZDUSSCGKSA-N 1 2 337.395 2.222 20 70 EEIDLO CCOC(=O)C[N@H+]1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160447672 463339715 /nfs/dbraw/zinc/33/97/15/463339715.db2.gz ZCRVXYMJJJJDOM-ZDUSSCGKSA-N 1 2 337.395 2.222 20 70 EEIDLO Cc1cnc([C@@H](C)NC(=O)N2CC[NH+](Cc3ccccn3)CC2)s1 ZINC000160606457 463354857 /nfs/dbraw/zinc/35/48/57/463354857.db2.gz MULMYPVVYWGRJU-CQSZACIVSA-N 1 2 345.472 2.435 20 70 EEIDLO C[C@H](NC(=O)[C@H](C)SCC[NH+]1CCOCC1)c1ccc(F)cc1 ZINC000159760393 533728428 /nfs/dbraw/zinc/72/84/28/533728428.db2.gz BSEBUSGMAPPYLT-KBPBESRZSA-N 1 2 340.464 2.457 20 70 EEIDLO C[C@H]1CCc2ccccc2N1C(=O)CSCC[NH+]1CCOCC1 ZINC000159917025 533779961 /nfs/dbraw/zinc/77/99/61/533779961.db2.gz PCKFQRRNXPHMBR-HNNXBMFYSA-N 1 2 334.485 2.420 20 70 EEIDLO CC[N@H+](CCOc1ccc(Br)cc1)[C@H]1CCOC1=O ZINC000159657179 528573630 /nfs/dbraw/zinc/57/36/30/528573630.db2.gz WVUIIYZVBLMPKM-ZDUSSCGKSA-N 1 2 328.206 2.465 20 70 EEIDLO CC[N@@H+](CCOc1ccc(Br)cc1)[C@H]1CCOC1=O ZINC000159657179 528573634 /nfs/dbraw/zinc/57/36/34/528573634.db2.gz WVUIIYZVBLMPKM-ZDUSSCGKSA-N 1 2 328.206 2.465 20 70 EEIDLO C[C@H](CSCc1ccccc1)C(=O)N(C)CC[NH+]1CCOCC1 ZINC000161458004 255803104 /nfs/dbraw/zinc/80/31/04/255803104.db2.gz BLHTVBYQAWDJTG-MRXNPFEDSA-N 1 2 336.501 2.347 20 70 EEIDLO CC[N@H+](CC(=O)NCc1ccc(F)cc1)Cc1cnc2cnccn12 ZINC000160231775 311351691 /nfs/dbraw/zinc/35/16/91/311351691.db2.gz UJRNBAXVTRDQBJ-UHFFFAOYSA-N 1 2 341.390 2.007 20 70 EEIDLO CC[N@@H+](CC(=O)NCc1ccc(F)cc1)Cc1cnc2cnccn12 ZINC000160231775 311351694 /nfs/dbraw/zinc/35/16/94/311351694.db2.gz UJRNBAXVTRDQBJ-UHFFFAOYSA-N 1 2 341.390 2.007 20 70 EEIDLO CCc1ccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000161142690 311362727 /nfs/dbraw/zinc/36/27/27/311362727.db2.gz KTOYINNJHWWWNL-UHFFFAOYSA-N 1 2 338.455 2.400 20 70 EEIDLO Cc1cc(S(=O)(=O)F)cnc1N1CC[NH+](C2CCCC2)CC1 ZINC001165033316 721862644 /nfs/dbraw/zinc/86/26/44/721862644.db2.gz JOYAOIOTXIJVCR-UHFFFAOYSA-N 1 2 327.425 2.113 20 70 EEIDLO CCc1ccccc1NC(=O)CN1CC[NH+](Cc2ccncc2)CC1 ZINC000161192887 529593813 /nfs/dbraw/zinc/59/38/13/529593813.db2.gz YYATXMKHPWKPMA-UHFFFAOYSA-N 1 2 338.455 2.400 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000159792601 311346096 /nfs/dbraw/zinc/34/60/96/311346096.db2.gz IJCQHFPDHXVQCZ-CVEARBPZSA-N 1 2 326.506 2.233 20 70 EEIDLO CC[C@@H]1CCCCN1C(=O)[C@@H](C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161177730 311363283 /nfs/dbraw/zinc/36/32/83/311363283.db2.gz TVBUQRUMXUVILM-IEBWSBKVSA-N 1 2 344.503 2.379 20 70 EEIDLO CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161177730 311363285 /nfs/dbraw/zinc/36/32/85/311363285.db2.gz TVBUQRUMXUVILM-IEBWSBKVSA-N 1 2 344.503 2.379 20 70 EEIDLO C[C@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159385603 463283553 /nfs/dbraw/zinc/28/35/53/463283553.db2.gz LUXBCLJEGLVIPM-DNVCBOLYSA-N 1 2 348.491 2.147 20 70 EEIDLO C[C@H](C(=O)N(C)C1CCCCC1)[N@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159385603 463283562 /nfs/dbraw/zinc/28/35/62/463283562.db2.gz LUXBCLJEGLVIPM-DNVCBOLYSA-N 1 2 348.491 2.147 20 70 EEIDLO Cc1cnc([C@H](C)NC(=O)N2CC[NH+](Cc3ccccn3)CC2)s1 ZINC000160606583 463355103 /nfs/dbraw/zinc/35/51/03/463355103.db2.gz MULMYPVVYWGRJU-AWEZNQCLSA-N 1 2 345.472 2.435 20 70 EEIDLO CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000160371843 527068654 /nfs/dbraw/zinc/06/86/54/527068654.db2.gz FYTBFXTVZJVQNC-INIZCTEOSA-N 1 2 339.399 2.440 20 70 EEIDLO Cc1cc(CC(=O)N2CC[NH+](Cc3ccccc3Cl)CC2)[nH]n1 ZINC000161384989 225616782 /nfs/dbraw/zinc/61/67/82/225616782.db2.gz OUIQMBOSGPKPCC-UHFFFAOYSA-N 1 2 332.835 2.258 20 70 EEIDLO Cc1cccn2cc(-c3ccc(NC(=O)C4(NC(N)=O)CC4)cc3)[nH+]c12 ZINC000160830730 311359084 /nfs/dbraw/zinc/35/90/84/311359084.db2.gz PMKZOCRFTKWQPE-UHFFFAOYSA-N 1 2 349.394 2.449 20 70 EEIDLO CC(C)Cn1cc[nH+]c1CNC(=O)Nc1ccnn1C[C@@H]1CCOC1 ZINC000159669021 463298825 /nfs/dbraw/zinc/29/88/25/463298825.db2.gz OYMRTAIYDIXOMC-AWEZNQCLSA-N 1 2 346.435 2.094 20 70 EEIDLO CCOc1ccc(CNC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1OC ZINC000159849177 463308260 /nfs/dbraw/zinc/30/82/60/463308260.db2.gz ZLUUMWLRDAVWGP-CQSZACIVSA-N 1 2 329.400 2.169 20 70 EEIDLO CC(C)c1ccc(N2CC[C@H](C(=O)NCCn3cc[nH+]c3)C2=O)cc1 ZINC000160451639 463340479 /nfs/dbraw/zinc/34/04/79/463340479.db2.gz QWYKHMJVAYIRIE-QGZVFWFLSA-N 1 2 340.427 2.176 20 70 EEIDLO CCCOc1cc(C[N@H+](CC)[C@@H]2CCS(=O)(=O)C2)ccc1OC ZINC000160574097 463351563 /nfs/dbraw/zinc/35/15/63/463351563.db2.gz IMMKUXDPVPXGEJ-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCOc1cc(C[N@@H+](CC)[C@@H]2CCS(=O)(=O)C2)ccc1OC ZINC000160574097 463351570 /nfs/dbraw/zinc/35/15/70/463351570.db2.gz IMMKUXDPVPXGEJ-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CC(C)S(=O)(=O)CCCN1CC[NH+](CCc2ccccc2)CC1 ZINC000160609657 463354874 /nfs/dbraw/zinc/35/48/74/463354874.db2.gz IPTWXFZZOLLDFK-UHFFFAOYSA-N 1 2 338.517 2.060 20 70 EEIDLO CCCC[N@H+](Cc1ccc(OC)cc1OC)[C@H]1CCS(=O)(=O)C1 ZINC000160753314 463368249 /nfs/dbraw/zinc/36/82/49/463368249.db2.gz QZXMAOXZAANCSU-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCC[N@@H+](Cc1ccc(OC)cc1OC)[C@H]1CCS(=O)(=O)C1 ZINC000160753314 463368254 /nfs/dbraw/zinc/36/82/54/463368254.db2.gz QZXMAOXZAANCSU-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO C[C@H](C(=O)Nc1ccccc1Cl)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161178266 463408038 /nfs/dbraw/zinc/40/80/38/463408038.db2.gz GGTTVAQBZYIOAL-SNVBAGLBSA-N 1 2 341.820 2.016 20 70 EEIDLO CN1CC[C@H]([NH2+][C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1=O ZINC000161271282 463414935 /nfs/dbraw/zinc/41/49/35/463414935.db2.gz RILHNQDCFPADNE-IRXDYDNUSA-N 1 2 341.386 2.326 20 70 EEIDLO COc1ccc(OC)c(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000159946072 532974047 /nfs/dbraw/zinc/97/40/47/532974047.db2.gz AACQBDPSENSOGY-ZDUSSCGKSA-N 1 2 342.399 2.499 20 70 EEIDLO CC(=O)NC1CC[NH+]([C@H]2CCCN(c3ccccc3Cl)C2=O)CC1 ZINC000159871489 143804216 /nfs/dbraw/zinc/80/42/16/143804216.db2.gz LHKLAQQKESMNNJ-KRWDZBQOSA-N 1 2 349.862 2.436 20 70 EEIDLO COc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCC[N@H+](C)C3)n[nH]2)cc1 ZINC000159920026 225300992 /nfs/dbraw/zinc/30/09/92/225300992.db2.gz BCHJEVRRVCINNV-CQSZACIVSA-N 1 2 328.416 2.252 20 70 EEIDLO COc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)n[nH]2)cc1 ZINC000159920026 225300997 /nfs/dbraw/zinc/30/09/97/225300997.db2.gz BCHJEVRRVCINNV-CQSZACIVSA-N 1 2 328.416 2.252 20 70 EEIDLO Cn1cc[nH+]c1[C@H](NC(=O)N1CCC[C@](C)(O)C1)c1cccc(F)c1 ZINC000160034029 225324830 /nfs/dbraw/zinc/32/48/30/225324830.db2.gz BOBLNJHUJCOGHF-QAPCUYQASA-N 1 2 346.406 2.205 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)NCc1ccc(Cl)s1 ZINC000159991322 311348883 /nfs/dbraw/zinc/34/88/83/311348883.db2.gz IMSAAVDIAQAPIO-UHFFFAOYSA-N 1 2 334.894 2.083 20 70 EEIDLO O=C1[C@H]([NH+]2CCC(c3nc[nH]n3)CC2)CCCN1c1ccccc1F ZINC000160913724 463381499 /nfs/dbraw/zinc/38/14/99/463381499.db2.gz CTFHMBJVVOFZAG-MRXNPFEDSA-N 1 2 343.406 2.319 20 70 EEIDLO C[C@H]1OCCN(C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)[C@H]1C ZINC000161047677 463393772 /nfs/dbraw/zinc/39/37/72/463393772.db2.gz FGEBRAQPYFZZRF-LSDHHAIUSA-N 1 2 332.448 2.391 20 70 EEIDLO CC(C)c1cccc(NC(=O)CS(=O)(=O)Cc2[nH+]ccn2C)c1 ZINC000161199066 463408796 /nfs/dbraw/zinc/40/87/96/463408796.db2.gz GJQBIMPZACACAD-UHFFFAOYSA-N 1 2 335.429 2.097 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N(C)Cc1cccc(F)c1 ZINC000159878581 533993335 /nfs/dbraw/zinc/99/33/35/533993335.db2.gz LZIMFPMTCPLYQH-CQSZACIVSA-N 1 2 340.464 2.238 20 70 EEIDLO C[C@@H]1C[N@@H+](CCCCNC(=O)c2cccc3nc[nH]c32)C[C@H](C)O1 ZINC000159828941 225285134 /nfs/dbraw/zinc/28/51/34/225285134.db2.gz WQICATUOSGFUSV-OKILXGFUSA-N 1 2 330.432 2.182 20 70 EEIDLO C[C@@H]1C[N@H+](CCCCNC(=O)c2cccc3nc[nH]c32)C[C@H](C)O1 ZINC000159828941 225285137 /nfs/dbraw/zinc/28/51/37/225285137.db2.gz WQICATUOSGFUSV-OKILXGFUSA-N 1 2 330.432 2.182 20 70 EEIDLO Cn1nc(Br)c2c1nc[nH+]c2N[C@@H]1CCOC(C)(C)C1 ZINC000160579524 279395483 /nfs/dbraw/zinc/39/54/83/279395483.db2.gz MFXPSDIVDDLHKT-MRVPVSSYSA-N 1 2 340.225 2.495 20 70 EEIDLO CC[N@H+](Cc1cnn(-c2ccc(F)cc2)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160586254 311356165 /nfs/dbraw/zinc/35/61/65/311356165.db2.gz AJFWFFWHHUHLNH-INIZCTEOSA-N 1 2 337.420 2.020 20 70 EEIDLO CC[N@@H+](Cc1cnn(-c2ccc(F)cc2)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160586254 311356166 /nfs/dbraw/zinc/35/61/66/311356166.db2.gz AJFWFFWHHUHLNH-INIZCTEOSA-N 1 2 337.420 2.020 20 70 EEIDLO C[C@@H]1CCC[C@H](C(=O)N2CC[NH+](CC(=O)N3CCCC[C@@H]3C)CC2)C1 ZINC000159922167 463310754 /nfs/dbraw/zinc/31/07/54/463310754.db2.gz OEJWJERPQWBOFP-SQNIBIBYSA-N 1 2 349.519 2.358 20 70 EEIDLO CC[N@H+](Cc1ccc(OC(F)F)c(F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160537500 463348356 /nfs/dbraw/zinc/34/83/56/463348356.db2.gz ANOOAKVALPFASR-NSHDSACASA-N 1 2 337.363 2.436 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC(F)F)c(F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160537500 463348362 /nfs/dbraw/zinc/34/83/62/463348362.db2.gz ANOOAKVALPFASR-NSHDSACASA-N 1 2 337.363 2.436 20 70 EEIDLO C[C@]1(O)CCCN(C(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000160951514 463385309 /nfs/dbraw/zinc/38/53/09/463385309.db2.gz YLFCQAHQENVCGY-KRWDZBQOSA-N 1 2 332.379 2.068 20 70 EEIDLO C[C@@H](C(=O)NC1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161183764 463407969 /nfs/dbraw/zinc/40/79/69/463407969.db2.gz VNJVIAFUUPGXHR-INIZCTEOSA-N 1 2 330.476 2.037 20 70 EEIDLO C[C@@H](C(=O)NC1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161183764 463407976 /nfs/dbraw/zinc/40/79/76/463407976.db2.gz VNJVIAFUUPGXHR-INIZCTEOSA-N 1 2 330.476 2.037 20 70 EEIDLO O=C(Nc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCn2cc[nH+]c2C1 ZINC000161336009 463421975 /nfs/dbraw/zinc/42/19/75/463421975.db2.gz QPMXKAKREMMPLG-ZDUSSCGKSA-N 1 2 344.390 2.060 20 70 EEIDLO COc1ccc([C@H](NC(=O)NCCn2cc[nH+]c2)C(F)(F)F)cc1 ZINC000161504606 463435446 /nfs/dbraw/zinc/43/54/46/463435446.db2.gz OCFWNTBXRWPSKN-ZDUSSCGKSA-N 1 2 342.321 2.495 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@H+](C)Cc3cnn(C)c3)c2c1 ZINC000160376958 534247201 /nfs/dbraw/zinc/24/72/01/534247201.db2.gz NEPHJZFVCQRRNP-UHFFFAOYSA-N 1 2 340.383 2.003 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@@H+](C)Cc3cnn(C)c3)c2c1 ZINC000160376958 534247205 /nfs/dbraw/zinc/24/72/05/534247205.db2.gz NEPHJZFVCQRRNP-UHFFFAOYSA-N 1 2 340.383 2.003 20 70 EEIDLO C[C@@H]1CCc2ccccc2N1C(=O)CSCC[NH+]1CCOCC1 ZINC000159916894 534268496 /nfs/dbraw/zinc/26/84/96/534268496.db2.gz PCKFQRRNXPHMBR-OAHLLOKOSA-N 1 2 334.485 2.420 20 70 EEIDLO COc1ccccc1[C@@H](NC(=O)[C@@H]1CCCCO1)c1[nH+]ccn1C ZINC000160320407 159708164 /nfs/dbraw/zinc/70/81/64/159708164.db2.gz AIBCDIBCTRTVPX-JKSUJKDBSA-N 1 2 329.400 2.203 20 70 EEIDLO CCCCCS(=O)(=O)N1CC[NH+](CCOc2ccccc2)CC1 ZINC000217140618 160216145 /nfs/dbraw/zinc/21/61/45/160216145.db2.gz VCRJTACJVMJDKS-UHFFFAOYSA-N 1 2 340.489 2.203 20 70 EEIDLO COC(=O)c1oc(C[NH+]2CCN(Cc3nc(C)c(C)o3)CC2)cc1C ZINC000216931631 160216460 /nfs/dbraw/zinc/21/64/60/160216460.db2.gz MUMWJYZMQUKJHZ-UHFFFAOYSA-N 1 2 347.415 2.297 20 70 EEIDLO Cc1ccc(Nc2nc(N)nc(C[N@H+](C)C[C@@H]3CCC[C@@H]3O)n2)cc1 ZINC000159731694 311345176 /nfs/dbraw/zinc/34/51/76/311345176.db2.gz JRKUFDCZDUXDNV-ZFWWWQNUSA-N 1 2 342.447 2.099 20 70 EEIDLO Cc1ccc(Nc2nc(N)nc(C[N@@H+](C)C[C@@H]3CCC[C@@H]3O)n2)cc1 ZINC000159731694 311345177 /nfs/dbraw/zinc/34/51/77/311345177.db2.gz JRKUFDCZDUXDNV-ZFWWWQNUSA-N 1 2 342.447 2.099 20 70 EEIDLO Cc1ccccc1C[C@@H](C)NC(=O)CSCC[NH+]1CCOCC1 ZINC000159775500 311346064 /nfs/dbraw/zinc/34/60/64/311346064.db2.gz OOCJTIKPHJMADV-MRXNPFEDSA-N 1 2 336.501 2.108 20 70 EEIDLO CCCCn1ncc(NC(=O)N[C@@H](C)[C@H](C)[NH+]2CCOCC2)c1C ZINC000159800710 311346570 /nfs/dbraw/zinc/34/65/70/311346570.db2.gz WMABXQOGZFTHRG-KBPBESRZSA-N 1 2 337.468 2.222 20 70 EEIDLO C[C@@]1(O)CCCN(C(=O)NCCc2[nH+]ccn2Cc2ccccc2)C1 ZINC000160131357 311350555 /nfs/dbraw/zinc/35/05/55/311350555.db2.gz PAZARABQYQPLJU-LJQANCHMSA-N 1 2 342.443 2.030 20 70 EEIDLO Cc1csc(=O)n1CC[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159396447 463284890 /nfs/dbraw/zinc/28/48/90/463284890.db2.gz QJVAUMYSHMKQQS-GOSISDBHSA-N 1 2 330.453 2.392 20 70 EEIDLO Cc1csc(=O)n1CC[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159396447 463284895 /nfs/dbraw/zinc/28/48/95/463284895.db2.gz QJVAUMYSHMKQQS-GOSISDBHSA-N 1 2 330.453 2.392 20 70 EEIDLO CCC(CC)CS(=O)(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159481070 463288226 /nfs/dbraw/zinc/28/82/26/463288226.db2.gz STKFENNKZPVWMQ-UHFFFAOYSA-N 1 2 334.526 2.043 20 70 EEIDLO C[C@@H](C(=O)N1CCC[N@H+](CC(=O)N2CCCC2)CC1)c1ccsc1 ZINC000160064315 463316688 /nfs/dbraw/zinc/31/66/88/463316688.db2.gz PXCBHUQTSZHQDO-OAHLLOKOSA-N 1 2 349.500 2.008 20 70 EEIDLO C[C@@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)c1ccsc1 ZINC000160064315 463316692 /nfs/dbraw/zinc/31/66/92/463316692.db2.gz PXCBHUQTSZHQDO-OAHLLOKOSA-N 1 2 349.500 2.008 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N[C@H](C)[C@@H](C)[NH+]2CCOCC2)n1 ZINC000160485995 463342213 /nfs/dbraw/zinc/34/22/13/463342213.db2.gz PYPWTVBGEJCTCS-HUUCEWRRSA-N 1 2 337.468 2.160 20 70 EEIDLO O=C(/C=C/c1cnc2ccccc2n1)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000161267517 463415149 /nfs/dbraw/zinc/41/51/49/463415149.db2.gz TURAUUHBUHNPEH-FDMDGMSGSA-N 1 2 345.406 2.433 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)N1CCC[C@](C)(O)C1 ZINC000159886868 534680348 /nfs/dbraw/zinc/68/03/48/534680348.db2.gz LTLFBWLGWZLVQV-SFHVURJKSA-N 1 2 330.432 2.291 20 70 EEIDLO CCOc1ccc(NC(=O)[C@H](C)SCC[NH+]2CCOCC2)cc1 ZINC000159918665 528545831 /nfs/dbraw/zinc/54/58/31/528545831.db2.gz QUULLZKVZNHNQQ-AWEZNQCLSA-N 1 2 338.473 2.478 20 70 EEIDLO CCCC[C@@H](COC)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160306356 528827628 /nfs/dbraw/zinc/82/76/28/528827628.db2.gz UFGMVJQJESWDBM-KRWDZBQOSA-N 1 2 334.464 2.114 20 70 EEIDLO COC(=O)CCCNC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000159485834 533387176 /nfs/dbraw/zinc/38/71/76/533387176.db2.gz FULDOKJXYUAYFR-CYBMUJFWSA-N 1 2 339.461 2.090 20 70 EEIDLO Cn1cc[nH+]c1[C@@H](NC(=O)N1CCC[C@@](C)(O)C1)c1cccc(F)c1 ZINC000160033908 225322660 /nfs/dbraw/zinc/32/26/60/225322660.db2.gz BOBLNJHUJCOGHF-MAUKXSAKSA-N 1 2 346.406 2.205 20 70 EEIDLO CCOc1ccc(C[NH+]2CCN(C(=O)c3cc(C)ncn3)CC2)cc1 ZINC000161348237 311365320 /nfs/dbraw/zinc/36/53/20/311365320.db2.gz CORJAISQBBNRNR-UHFFFAOYSA-N 1 2 340.427 2.142 20 70 EEIDLO CCc1nc(CN2CC[NH+](CCC(=O)c3ccc(C)cc3)CC2)no1 ZINC000160618403 463355813 /nfs/dbraw/zinc/35/58/13/463355813.db2.gz JMRXYUDEVCDCDJ-UHFFFAOYSA-N 1 2 342.443 2.331 20 70 EEIDLO O=C(Nc1ccc(-n2nccn2)cc1)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000160863619 463377042 /nfs/dbraw/zinc/37/70/42/463377042.db2.gz RQYPJQFYHLBBCG-HNNXBMFYSA-N 1 2 349.398 2.063 20 70 EEIDLO CC(C)(C)c1ccc(S(=O)(=O)NCCC[NH+]2CCOCC2)s1 ZINC000161094135 463398604 /nfs/dbraw/zinc/39/86/04/463398604.db2.gz FDFSXZKEWLMMIY-UHFFFAOYSA-N 1 2 346.518 2.046 20 70 EEIDLO COC(=O)CC1([NH2+]Cc2noc(-c3ccsc3)n2)CCOCC1 ZINC000161136203 463403273 /nfs/dbraw/zinc/40/32/73/463403273.db2.gz WSRMXEBKUQJJSF-UHFFFAOYSA-N 1 2 337.401 2.000 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)Cc1ccc(F)c(Br)c1 ZINC000161203899 463410443 /nfs/dbraw/zinc/41/04/43/463410443.db2.gz MGYITEVCHDZKRF-UHFFFAOYSA-N 1 2 347.209 2.437 20 70 EEIDLO COCc1nc2n(n1)C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)CC2 ZINC000161356115 463424235 /nfs/dbraw/zinc/42/42/35/463424235.db2.gz BZJYYMQXRWDBPC-JTQLQIEISA-N 1 2 327.310 2.265 20 70 EEIDLO COc1ccc([NH2+][C@H](C)CCn2cccn2)cc1-n1nnnc1C ZINC000159446058 225218287 /nfs/dbraw/zinc/21/82/87/225218287.db2.gz OCSVBTRSBGKBDX-GFCCVEGCSA-N 1 2 327.392 2.067 20 70 EEIDLO Cc1ccccc1CN(C)C(=O)[C@H](C)SCC[NH+]1CCOCC1 ZINC000159980502 225313903 /nfs/dbraw/zinc/31/39/03/225313903.db2.gz GDTYNURCVRSISD-INIZCTEOSA-N 1 2 336.501 2.407 20 70 EEIDLO C[C@@H]1CCCC[C@H]1NC(=O)C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161303317 311364249 /nfs/dbraw/zinc/36/42/49/311364249.db2.gz GEVAGXNNOHKQTO-KYOSRNDESA-N 1 2 336.398 2.317 20 70 EEIDLO COc1ccc(CCC(=O)N2CC[NH+](CCOCC3CC3)CC2)cc1 ZINC000159676493 463298414 /nfs/dbraw/zinc/29/84/14/463298414.db2.gz XALKNFZEQCLBQO-UHFFFAOYSA-N 1 2 346.471 2.199 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N2C[C@@H](C)[C@@H]([NH+]3CCOCC3)C2)n1 ZINC000160978869 463387134 /nfs/dbraw/zinc/38/71/34/463387134.db2.gz DVTJUDVDKHBTGI-CVEARBPZSA-N 1 2 349.479 2.114 20 70 EEIDLO C[C@@H](CNC(=O)[C@@H](C)SCC[NH+]1CCOCC1)c1ccccc1 ZINC000159833370 534009242 /nfs/dbraw/zinc/00/92/42/534009242.db2.gz ZVDREGRKUUJJMC-JKSUJKDBSA-N 1 2 336.501 2.360 20 70 EEIDLO CC(C)N(C[C@@H](C)O)C(=O)NCCc1[nH+]ccn1Cc1ccccc1 ZINC000159897397 311347576 /nfs/dbraw/zinc/34/75/76/311347576.db2.gz CZJYAHJAEXXFSY-MRXNPFEDSA-N 1 2 344.459 2.275 20 70 EEIDLO CC[N@H+](Cc1cc(OC)cc2c1O[C@@H](C)C2)[C@@H]1CCS(=O)(=O)C1 ZINC000160535114 311355096 /nfs/dbraw/zinc/35/50/96/311355096.db2.gz VCMTVAXNYZPVER-SWLSCSKDSA-N 1 2 339.457 2.028 20 70 EEIDLO CC[N@@H+](Cc1cc(OC)cc2c1O[C@@H](C)C2)[C@@H]1CCS(=O)(=O)C1 ZINC000160535114 311355097 /nfs/dbraw/zinc/35/50/97/311355097.db2.gz VCMTVAXNYZPVER-SWLSCSKDSA-N 1 2 339.457 2.028 20 70 EEIDLO COC(=O)CN(C(=O)c1ccc(Cn2cc[nH+]c2)cc1)C1CCCC1 ZINC000160832067 463375003 /nfs/dbraw/zinc/37/50/03/463375003.db2.gz KPJZITGUOJWZEH-UHFFFAOYSA-N 1 2 341.411 2.489 20 70 EEIDLO Cn1cc[nH+]c1CN1CCCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000160840713 463375917 /nfs/dbraw/zinc/37/59/17/463375917.db2.gz IQSRVDHZBOUCBA-UHFFFAOYSA-N 1 2 332.835 2.422 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)CC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000161175694 463406365 /nfs/dbraw/zinc/40/63/65/463406365.db2.gz RNJHBKXNBNFLCD-UHFFFAOYSA-N 1 2 349.456 2.271 20 70 EEIDLO CC(C)n1cc[nH+]c1CS(=O)(=O)CC(=O)N[C@H]1CCCC[C@@H]1C ZINC000161215132 463410761 /nfs/dbraw/zinc/41/07/61/463410761.db2.gz QZKCIZBPRQBFNK-KBPBESRZSA-N 1 2 341.477 2.074 20 70 EEIDLO O=C1[C@@H]([N@H+](CCO)Cc2cccnc2)CCCN1c1ccccc1F ZINC000161353601 463424504 /nfs/dbraw/zinc/42/45/04/463424504.db2.gz PVFPVMYYXTWEIL-SFHVURJKSA-N 1 2 343.402 2.211 20 70 EEIDLO O=C1[C@@H]([N@@H+](CCO)Cc2cccnc2)CCCN1c1ccccc1F ZINC000161353601 463424507 /nfs/dbraw/zinc/42/45/07/463424507.db2.gz PVFPVMYYXTWEIL-SFHVURJKSA-N 1 2 343.402 2.211 20 70 EEIDLO Cc1cc(F)ccc1N1CC(=O)C(C(=O)N[C@@H]2CCC[C@H]([NH3+])C2)=N1 ZINC000161452194 463430771 /nfs/dbraw/zinc/43/07/71/463430771.db2.gz BLXHNRRFZDKJJI-QWHCGFSZSA-N 1 2 332.379 2.025 20 70 EEIDLO O=C(/C=C\c1ccc2c(c1)CCO2)N1CC[NH+](Cc2ccncc2)CC1 ZINC000216740834 576055355 /nfs/dbraw/zinc/05/53/55/576055355.db2.gz SUOLVRFYVWRPHT-RQOWECAXSA-N 1 2 349.434 2.374 20 70 EEIDLO CN(CCC(=O)OC(C)(C)C)C(=O)NCCc1cn2ccccc2[nH+]1 ZINC000159758410 529873059 /nfs/dbraw/zinc/87/30/59/529873059.db2.gz LVSIOLGATQKUQY-UHFFFAOYSA-N 1 2 346.431 2.250 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N1CCSc2ccccc21 ZINC000159838849 225288248 /nfs/dbraw/zinc/28/82/48/225288248.db2.gz WOVYJOACAQFPFY-UHFFFAOYSA-N 1 2 338.498 2.191 20 70 EEIDLO OCCC[N@H+](CCO)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159609618 225248242 /nfs/dbraw/zinc/24/82/42/225248242.db2.gz BGWWPANVXKPOCA-UHFFFAOYSA-N 1 2 328.384 2.265 20 70 EEIDLO OCCC[N@@H+](CCO)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159609618 225248246 /nfs/dbraw/zinc/24/82/46/225248246.db2.gz BGWWPANVXKPOCA-UHFFFAOYSA-N 1 2 328.384 2.265 20 70 EEIDLO CCO[C@H](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)C(C)C ZINC000160528286 463346610 /nfs/dbraw/zinc/34/66/10/463346610.db2.gz UIGFGGYMRDRODF-GOSISDBHSA-N 1 2 348.491 2.360 20 70 EEIDLO CC[C@@H](O)CCNC(=O)N[C@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000160838037 463374741 /nfs/dbraw/zinc/37/47/41/463374741.db2.gz JZQPDEPPVUQMHF-CABCVRRESA-N 1 2 334.395 2.109 20 70 EEIDLO Cc1ccc(OCCCC(=O)N(C)CC[NH+]2CCOCC2)c(C)c1 ZINC000161247539 463414079 /nfs/dbraw/zinc/41/40/79/463414079.db2.gz JOIRWTCOVNSTJI-UHFFFAOYSA-N 1 2 334.460 2.253 20 70 EEIDLO CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000160369121 527011781 /nfs/dbraw/zinc/01/17/81/527011781.db2.gz PYMUEHPWVQJYNN-MRXNPFEDSA-N 1 2 339.399 2.440 20 70 EEIDLO CC(C)OC(=O)CCCNC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000160170916 527774717 /nfs/dbraw/zinc/77/47/17/527774717.db2.gz HHQDRASJKIBZNX-LSDHHAIUSA-N 1 2 336.436 2.207 20 70 EEIDLO CCN(Cc1cccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1)C(C)=O ZINC000159771767 528813906 /nfs/dbraw/zinc/81/39/06/528813906.db2.gz KXYOYIJWSXHFNM-INIZCTEOSA-N 1 2 340.427 2.453 20 70 EEIDLO O=C([C@@H]1CCn2cc[nH+]c2C1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000161241903 255802415 /nfs/dbraw/zinc/80/24/15/255802415.db2.gz WMRALINOPZXONA-CJNGLKHVSA-N 1 2 347.365 2.324 20 70 EEIDLO C[C@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)COCc1ccccc1 ZINC000160391385 159709627 /nfs/dbraw/zinc/70/96/27/159709627.db2.gz RQDSYWVDZGQJQX-WBVHZDCISA-N 1 2 327.428 2.415 20 70 EEIDLO Cc1c(/C=C/C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)cnn1C ZINC000160066103 225330109 /nfs/dbraw/zinc/33/01/09/225330109.db2.gz XKYYSBAHQDKADH-VOTSOKGWSA-N 1 2 339.443 2.443 20 70 EEIDLO COc1cccc(N2CC[NH+](Cc3cc(C(N)=O)cs3)CC2)c1 ZINC000160695461 311357937 /nfs/dbraw/zinc/35/79/37/311357937.db2.gz IMJAWEXTOHLSDD-UHFFFAOYSA-N 1 2 331.441 2.178 20 70 EEIDLO CCCC[N@H+](Cc1cnn(C(C)(C)C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160793356 311358944 /nfs/dbraw/zinc/35/89/44/311358944.db2.gz KZCQVLUROLUSEB-HNNXBMFYSA-N 1 2 327.494 2.427 20 70 EEIDLO CCCC[N@@H+](Cc1cnn(C(C)(C)C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160793356 311358945 /nfs/dbraw/zinc/35/89/45/311358945.db2.gz KZCQVLUROLUSEB-HNNXBMFYSA-N 1 2 327.494 2.427 20 70 EEIDLO CC(C)(C)[C@@H]([NH2+]Cc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000160525372 463347158 /nfs/dbraw/zinc/34/71/58/463347158.db2.gz BOPSPXLUKGEVEW-LBPRGKRZSA-N 1 2 339.237 2.315 20 70 EEIDLO O=C1[C@@H]([NH+]2CCC(c3nc[nH]n3)CC2)CCCN1c1ccccc1F ZINC000160913616 463381702 /nfs/dbraw/zinc/38/17/02/463381702.db2.gz CTFHMBJVVOFZAG-INIZCTEOSA-N 1 2 343.406 2.319 20 70 EEIDLO O=C(NCCCNc1cccc[nH+]1)NCCOc1ccc(Cl)cn1 ZINC000161034920 463392635 /nfs/dbraw/zinc/39/26/35/463392635.db2.gz WWGDZOYIOTURHF-UHFFFAOYSA-N 1 2 349.822 2.310 20 70 EEIDLO Cc1cc(C)cc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000161148197 463404418 /nfs/dbraw/zinc/40/44/18/463404418.db2.gz JNFPHPVRJDTKSU-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)CCCOc1ccc2c(c1)CCC2 ZINC000161246477 463414050 /nfs/dbraw/zinc/41/40/50/463414050.db2.gz BVZMZISMMDWDQX-UHFFFAOYSA-N 1 2 346.471 2.125 20 70 EEIDLO O=C(Nc1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000159689501 225261371 /nfs/dbraw/zinc/26/13/71/225261371.db2.gz ZZKQVQIDRGDUKP-CQSZACIVSA-N 1 2 340.383 2.253 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)Nc1ccccc1OC(F)F ZINC000159880295 225296079 /nfs/dbraw/zinc/29/60/79/225296079.db2.gz CQFSEVGBNAXUOQ-UHFFFAOYSA-N 1 2 346.399 2.292 20 70 EEIDLO Cc1c(CCC(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)cnn1C ZINC000159945905 225308112 /nfs/dbraw/zinc/30/81/12/225308112.db2.gz JPGHWMVGXXVYLE-UHFFFAOYSA-N 1 2 341.390 2.302 20 70 EEIDLO CCCOC(=O)[C@@H](C)[NH+]1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000159525236 463291409 /nfs/dbraw/zinc/29/14/09/463291409.db2.gz LBOFDFCEFLANBO-CQSZACIVSA-N 1 2 333.432 2.382 20 70 EEIDLO O=C(Nc1ccc(N2CCCCC2)cn1)[C@H]1CCn2cc[nH+]c2C1 ZINC000160022019 463315511 /nfs/dbraw/zinc/31/55/11/463315511.db2.gz HDCYLFMMZPIQSY-AWEZNQCLSA-N 1 2 325.416 2.470 20 70 EEIDLO CC(C)c1ccc(N2CC(=O)C(C(=O)N3CCC[C@H]3C[NH3+])=N2)cc1 ZINC000160394657 463334672 /nfs/dbraw/zinc/33/46/72/463334672.db2.gz VFFOFTWHDPZCPQ-HNNXBMFYSA-N 1 2 328.416 2.265 20 70 EEIDLO COC(=O)[C@@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CCO1 ZINC000160513521 463345081 /nfs/dbraw/zinc/34/50/81/463345081.db2.gz NZPXUFIBNQXHBG-ZDUSSCGKSA-N 1 2 334.199 2.246 20 70 EEIDLO COC(=O)[C@@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CCO1 ZINC000160513521 463345091 /nfs/dbraw/zinc/34/50/91/463345091.db2.gz NZPXUFIBNQXHBG-ZDUSSCGKSA-N 1 2 334.199 2.246 20 70 EEIDLO CC[C@@](C)([NH2+]Cc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000160659087 463360084 /nfs/dbraw/zinc/36/00/84/463360084.db2.gz UBEPJPDZXQKUPQ-CYBMUJFWSA-N 1 2 325.210 2.069 20 70 EEIDLO Cc1ccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)c(C)c1 ZINC000161149236 463404351 /nfs/dbraw/zinc/40/43/51/463404351.db2.gz IAPKSWMMMKJVPQ-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO C[C@H](C(=O)N[C@H]1CCN(c2cccc[nH+]2)C1)n1cnc2ccccc21 ZINC000161382023 463426525 /nfs/dbraw/zinc/42/65/25/463426525.db2.gz RBAVINROPILLJG-CABCVRRESA-N 1 2 335.411 2.387 20 70 EEIDLO CC1(NC(=O)NCc2ccccc2OCC[NH+]2CCOCC2)CCC1 ZINC000160235884 528024455 /nfs/dbraw/zinc/02/44/55/528024455.db2.gz ZZMUMAUWKLGDAE-UHFFFAOYSA-N 1 2 347.459 2.139 20 70 EEIDLO COC(=O)[C@H](C)[N@@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000159853942 533199251 /nfs/dbraw/zinc/19/92/51/533199251.db2.gz CYARVUHAOOMZGR-LBPRGKRZSA-N 1 2 339.823 2.441 20 70 EEIDLO COC(=O)[C@H](C)[N@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000159853942 533199255 /nfs/dbraw/zinc/19/92/55/533199255.db2.gz CYARVUHAOOMZGR-LBPRGKRZSA-N 1 2 339.823 2.441 20 70 EEIDLO CO[C@@H](C)C(=O)Nc1cccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1 ZINC000160588066 159713368 /nfs/dbraw/zinc/71/33/68/159713368.db2.gz DUCXGCMULTXBMP-STQMWFEESA-N 1 2 342.399 2.058 20 70 EEIDLO C[C@H](NC(=O)c1cccc2nc[nH]c21)C1([NH+]2CCOCC2)CCCC1 ZINC000159703126 225263185 /nfs/dbraw/zinc/26/31/85/225263185.db2.gz XXBVBWJHQOHECX-AWEZNQCLSA-N 1 2 342.443 2.326 20 70 EEIDLO CC1(NC(=O)N[C@H](Cc2ccccc2)C[NH+]2CCOCC2)CCC1 ZINC000161170825 281586041 /nfs/dbraw/zinc/58/60/41/281586041.db2.gz WGXXVVKFEAUIKJ-QGZVFWFLSA-N 1 2 331.460 2.172 20 70 EEIDLO CC(C)CCn1cccc1C[NH+]1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC000161041611 311361511 /nfs/dbraw/zinc/36/15/11/311361511.db2.gz LITVNJBAGGYEPW-GOSISDBHSA-N 1 2 333.476 2.357 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N[C@@H](C)[C@H](C)[NH+]2CCOCC2)n1 ZINC000160486131 463342485 /nfs/dbraw/zinc/34/24/85/463342485.db2.gz PYPWTVBGEJCTCS-GJZGRUSLSA-N 1 2 337.468 2.160 20 70 EEIDLO COCCC1(CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)CCC1 ZINC000160727236 463365952 /nfs/dbraw/zinc/36/59/52/463365952.db2.gz LUAMRHWIZFFPSL-UHFFFAOYSA-N 1 2 346.475 2.116 20 70 EEIDLO CC1CC[NH+](Cc2csc(NC(=O)c3cccc(=O)n3C)n2)CC1 ZINC000160821505 463374247 /nfs/dbraw/zinc/37/42/47/463374247.db2.gz DTVPCFRGIUDSEP-UHFFFAOYSA-N 1 2 346.456 2.326 20 70 EEIDLO COc1cc(NC(=O)C[N@H+](C)Cc2c(C)nn(C)c2C)cc(OC)c1 ZINC000161056215 463395466 /nfs/dbraw/zinc/39/54/66/463395466.db2.gz WLICJEHKNPTPDE-UHFFFAOYSA-N 1 2 346.431 2.125 20 70 EEIDLO COc1cc(NC(=O)C[N@@H+](C)Cc2c(C)nn(C)c2C)cc(OC)c1 ZINC000161056215 463395471 /nfs/dbraw/zinc/39/54/71/463395471.db2.gz WLICJEHKNPTPDE-UHFFFAOYSA-N 1 2 346.431 2.125 20 70 EEIDLO O=C(N[C@@H]1CCN(c2cccc[nH+]2)C1)c1ccc2nsnc2c1 ZINC000218082091 464109380 /nfs/dbraw/zinc/10/93/80/464109380.db2.gz RYVNWUNSEHAYOR-GFCCVEGCSA-N 1 2 325.397 2.095 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCc2ccccc2C1 ZINC000159965199 533994162 /nfs/dbraw/zinc/99/41/62/533994162.db2.gz LLEHLYPLDQWXQM-OAHLLOKOSA-N 1 2 334.485 2.025 20 70 EEIDLO CCCC(=O)N[C@@H]1CCC[N@@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)C1 ZINC000160191020 527946445 /nfs/dbraw/zinc/94/64/45/527946445.db2.gz JYHSNDABHNQABR-SJLPKXTDSA-N 1 2 343.471 2.481 20 70 EEIDLO CCCC(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)C1 ZINC000160191020 527946450 /nfs/dbraw/zinc/94/64/50/527946450.db2.gz JYHSNDABHNQABR-SJLPKXTDSA-N 1 2 343.471 2.481 20 70 EEIDLO O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc(-n2cc[nH+]c2)nc1 ZINC000159726499 225266432 /nfs/dbraw/zinc/26/64/32/225266432.db2.gz HIBKLZLQQGQWMC-HNNXBMFYSA-N 1 2 326.400 2.489 20 70 EEIDLO COC(C[NH+]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)CC1)OC ZINC000160415764 463337014 /nfs/dbraw/zinc/33/70/14/463337014.db2.gz QNKPTQWKQOWHAF-UHFFFAOYSA-N 1 2 347.242 2.370 20 70 EEIDLO Cc1cccc(C[NH+]2CCN(CCCS(=O)(=O)C(C)C)CC2)c1 ZINC000160549445 463349356 /nfs/dbraw/zinc/34/93/56/463349356.db2.gz QFIWAYKRRAJVCF-UHFFFAOYSA-N 1 2 338.517 2.326 20 70 EEIDLO CCc1nnc(C[N@H+](Cc2ccc(OC)cc2)[C@H](CO)C(C)C)[nH]1 ZINC000160691016 463362592 /nfs/dbraw/zinc/36/25/92/463362592.db2.gz UXCNXUWDOQTZNQ-MRXNPFEDSA-N 1 2 332.448 2.395 20 70 EEIDLO CCc1nnc(C[N@@H+](Cc2ccc(OC)cc2)[C@H](CO)C(C)C)[nH]1 ZINC000160691016 463362595 /nfs/dbraw/zinc/36/25/95/463362595.db2.gz UXCNXUWDOQTZNQ-MRXNPFEDSA-N 1 2 332.448 2.395 20 70 EEIDLO Cc1nsc(N2CC[NH+](Cc3c(C)nc4ccccn43)CC2)n1 ZINC000160884704 463379725 /nfs/dbraw/zinc/37/97/25/463379725.db2.gz FKYQKXHFTBQZJN-UHFFFAOYSA-N 1 2 328.445 2.125 20 70 EEIDLO O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)N1CCC(n2cc[nH+]c2)CC1 ZINC000161073732 463397000 /nfs/dbraw/zinc/39/70/00/463397000.db2.gz DTCVVAPDTVNFEL-OAGGEKHMSA-N 1 2 330.432 2.187 20 70 EEIDLO O=C(NCCc1nc2c(s1)CCCC2)[C@H]1CCn2cc[nH+]c2C1 ZINC000161126448 463401671 /nfs/dbraw/zinc/40/16/71/463401671.db2.gz OGHGVCUKLLWACZ-LBPRGKRZSA-N 1 2 330.457 2.140 20 70 EEIDLO CC(C)n1cc[nH+]c1CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@@H]1C ZINC000161215349 463410746 /nfs/dbraw/zinc/41/07/46/463410746.db2.gz QZKCIZBPRQBFNK-UONOGXRCSA-N 1 2 341.477 2.074 20 70 EEIDLO Cc1nccc(NC(=O)N[C@H](C)[C@H](C)[NH+]2CCOCC2)c1Cl ZINC000159726598 539517752 /nfs/dbraw/zinc/51/77/52/539517752.db2.gz HIOQUWQGDBWFRA-PWSUYJOCSA-N 1 2 326.828 2.274 20 70 EEIDLO CCCC[N@H+](Cc1cnn(C(C)(C)C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160793211 311358907 /nfs/dbraw/zinc/35/89/07/311358907.db2.gz KZCQVLUROLUSEB-OAHLLOKOSA-N 1 2 327.494 2.427 20 70 EEIDLO CCCC[N@@H+](Cc1cnn(C(C)(C)C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160793211 311358908 /nfs/dbraw/zinc/35/89/08/311358908.db2.gz KZCQVLUROLUSEB-OAHLLOKOSA-N 1 2 327.494 2.427 20 70 EEIDLO Cc1csc(=O)n1CC[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159396565 463284167 /nfs/dbraw/zinc/28/41/67/463284167.db2.gz QJVAUMYSHMKQQS-SFHVURJKSA-N 1 2 330.453 2.392 20 70 EEIDLO Cc1csc(=O)n1CC[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159396565 463284171 /nfs/dbraw/zinc/28/41/71/463284171.db2.gz QJVAUMYSHMKQQS-SFHVURJKSA-N 1 2 330.453 2.392 20 70 EEIDLO COC(C)(C)C[C@H](C)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160403328 463335260 /nfs/dbraw/zinc/33/52/60/463335260.db2.gz VSHKZNGWYMSYIO-HNNXBMFYSA-N 1 2 334.464 2.112 20 70 EEIDLO CC(C)(C)[C@H]([NH2+]Cc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000160525271 463346924 /nfs/dbraw/zinc/34/69/24/463346924.db2.gz BOPSPXLUKGEVEW-GFCCVEGCSA-N 1 2 339.237 2.315 20 70 EEIDLO CCCOc1cc(C[N@H+](CC)[C@H]2CCS(=O)(=O)C2)ccc1OC ZINC000160574236 463350979 /nfs/dbraw/zinc/35/09/79/463350979.db2.gz IMMKUXDPVPXGEJ-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCOc1cc(C[N@@H+](CC)[C@H]2CCS(=O)(=O)C2)ccc1OC ZINC000160574236 463350982 /nfs/dbraw/zinc/35/09/82/463350982.db2.gz IMMKUXDPVPXGEJ-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO CC(C)[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCCC[C@@H]1C ZINC000160020643 311349255 /nfs/dbraw/zinc/34/92/55/311349255.db2.gz BHVDTDLJUNSOCK-JKSUJKDBSA-N 1 2 328.522 2.477 20 70 EEIDLO CCC[N@H+](Cc1cnc(N(CC)CC)s1)[C@@H]1CCS(=O)(=O)C1 ZINC000161073123 311361872 /nfs/dbraw/zinc/36/18/72/311361872.db2.gz OFBXHNQUUPRYCU-CYBMUJFWSA-N 1 2 345.534 2.388 20 70 EEIDLO CCC[N@@H+](Cc1cnc(N(CC)CC)s1)[C@@H]1CCS(=O)(=O)C1 ZINC000161073123 311361874 /nfs/dbraw/zinc/36/18/74/311361874.db2.gz OFBXHNQUUPRYCU-CYBMUJFWSA-N 1 2 345.534 2.388 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000161113649 311362491 /nfs/dbraw/zinc/36/24/91/311362491.db2.gz CTKHSDQDPSEHCY-CYBMUJFWSA-N 1 2 343.431 2.228 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000161113649 311362494 /nfs/dbraw/zinc/36/24/94/311362494.db2.gz CTKHSDQDPSEHCY-CYBMUJFWSA-N 1 2 343.431 2.228 20 70 EEIDLO C[C@@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160389996 463333361 /nfs/dbraw/zinc/33/33/61/463333361.db2.gz XOQCGJDQWRAGAK-VQIMIIECSA-N 1 2 346.471 2.066 20 70 EEIDLO C[C@@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160389996 463333365 /nfs/dbraw/zinc/33/33/65/463333365.db2.gz XOQCGJDQWRAGAK-VQIMIIECSA-N 1 2 346.471 2.066 20 70 EEIDLO Cn1cc([C@H]2CCC[N@@H+]2CC(=O)Nc2cc(C(C)(C)C)nn2C)cn1 ZINC000160521073 463345691 /nfs/dbraw/zinc/34/56/91/463345691.db2.gz QPWMSQMOKPQOJZ-CQSZACIVSA-N 1 2 344.463 2.227 20 70 EEIDLO Cn1cc([C@H]2CCC[N@H+]2CC(=O)Nc2cc(C(C)(C)C)nn2C)cn1 ZINC000160521073 463345695 /nfs/dbraw/zinc/34/56/95/463345695.db2.gz QPWMSQMOKPQOJZ-CQSZACIVSA-N 1 2 344.463 2.227 20 70 EEIDLO CC[N@H+](Cc1ccc(OC(C)C)c(OC)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160539895 463348473 /nfs/dbraw/zinc/34/84/73/463348473.db2.gz MNCRWSPCZCCBKI-HNNXBMFYSA-N 1 2 341.473 2.491 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC(C)C)c(OC)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160539895 463348475 /nfs/dbraw/zinc/34/84/75/463348475.db2.gz MNCRWSPCZCCBKI-HNNXBMFYSA-N 1 2 341.473 2.491 20 70 EEIDLO CCC(CC)NC(=O)[C@H]1CN(Cc2[nH+]ccn2C)c2ccccc2O1 ZINC000160894690 311359518 /nfs/dbraw/zinc/35/95/18/311359518.db2.gz DUUHBWOCHSHPJK-QGZVFWFLSA-N 1 2 342.443 2.493 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161115604 311362459 /nfs/dbraw/zinc/36/24/59/311362459.db2.gz KENIGSVWFLSUEJ-MRXNPFEDSA-N 1 2 344.459 2.134 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161115604 311362460 /nfs/dbraw/zinc/36/24/60/311362460.db2.gz KENIGSVWFLSUEJ-MRXNPFEDSA-N 1 2 344.459 2.134 20 70 EEIDLO Cc1cccc(CNC(=O)C[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)c1 ZINC000161454846 311366141 /nfs/dbraw/zinc/36/61/41/311366141.db2.gz KHPLZXIVLYBGKO-MRXNPFEDSA-N 1 2 344.377 2.246 20 70 EEIDLO O=C(Nc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000159791736 463305578 /nfs/dbraw/zinc/30/55/78/463305578.db2.gz ASSRXUCQPLRYBN-CQSZACIVSA-N 1 2 340.427 2.045 20 70 EEIDLO O=C(Nc1ccc(CN2CCCC2=O)cc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000160087126 463318961 /nfs/dbraw/zinc/31/89/61/463318961.db2.gz WXFCEHVFPGDEBG-OAHLLOKOSA-N 1 2 338.411 2.207 20 70 EEIDLO CCOC(=O)C[C@H](C)NC(=O)CSCc1cn2cc(C)ccc2[nH+]1 ZINC000160220613 463323475 /nfs/dbraw/zinc/32/34/75/463323475.db2.gz KBRIPLDMNQHBPY-ZDUSSCGKSA-N 1 2 349.456 2.334 20 70 EEIDLO C[C@@H](NC(=O)N1C[C@H]2OCC[N@H+](C)[C@H]2C1)c1cc2ccccc2o1 ZINC000160664008 463360636 /nfs/dbraw/zinc/36/06/36/463360636.db2.gz LUDFZUKODIGROO-HACGYAERSA-N 1 2 329.400 2.218 20 70 EEIDLO C[C@@H](NC(=O)N1C[C@H]2OCC[N@@H+](C)[C@H]2C1)c1cc2ccccc2o1 ZINC000160664008 463360639 /nfs/dbraw/zinc/36/06/39/463360639.db2.gz LUDFZUKODIGROO-HACGYAERSA-N 1 2 329.400 2.218 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@@H+]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)n1 ZINC000160971618 463387400 /nfs/dbraw/zinc/38/74/00/463387400.db2.gz RYMYKQMAJYCUOJ-CYBMUJFWSA-N 1 2 336.436 2.234 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@H+]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)n1 ZINC000160971618 463387404 /nfs/dbraw/zinc/38/74/04/463387404.db2.gz RYMYKQMAJYCUOJ-CYBMUJFWSA-N 1 2 336.436 2.234 20 70 EEIDLO O=C([C@H]1CCCO1)N1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000160993197 463389556 /nfs/dbraw/zinc/38/95/56/463389556.db2.gz STGNFMFGJDYADS-GOSISDBHSA-N 1 2 325.412 2.058 20 70 EEIDLO COc1ccc([C@H]2CCN(C(=O)[C@H]3CCn4cc[nH+]c4C3)C2)cc1 ZINC000161098028 463400209 /nfs/dbraw/zinc/40/02/09/463400209.db2.gz UHFMNFSSYURIAW-HOTGVXAUSA-N 1 2 325.412 2.470 20 70 EEIDLO CCCCC[C@H](C)NC(=O)CN1CC[NH+](Cc2ccncc2)CC1 ZINC000161230604 463411687 /nfs/dbraw/zinc/41/16/87/463411687.db2.gz CWHYCIJBPXCMKN-KRWDZBQOSA-N 1 2 332.492 2.284 20 70 EEIDLO CC[N@H+](CCn1c(C)csc1=O)CC(=O)Nc1ccccc1OC ZINC000161348440 463424597 /nfs/dbraw/zinc/42/45/97/463424597.db2.gz SEDRUHQKEXFIEJ-UHFFFAOYSA-N 1 2 349.456 2.187 20 70 EEIDLO CC[N@@H+](CCn1c(C)csc1=O)CC(=O)Nc1ccccc1OC ZINC000161348440 463424600 /nfs/dbraw/zinc/42/46/00/463424600.db2.gz SEDRUHQKEXFIEJ-UHFFFAOYSA-N 1 2 349.456 2.187 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)Nc1cccnc1Cl ZINC000159872258 533992247 /nfs/dbraw/zinc/99/22/47/533992247.db2.gz ZXPVTXRGVTTXJJ-LLVKDONJSA-N 1 2 329.853 2.127 20 70 EEIDLO CC[N@H+](CCOc1ccc(Br)cc1)[C@@H]1CCOC1=O ZINC000159657026 206257351 /nfs/dbraw/zinc/25/73/51/206257351.db2.gz WVUIIYZVBLMPKM-CYBMUJFWSA-N 1 2 328.206 2.465 20 70 EEIDLO CC[N@@H+](CCOc1ccc(Br)cc1)[C@@H]1CCOC1=O ZINC000159657026 206257352 /nfs/dbraw/zinc/25/73/52/206257352.db2.gz WVUIIYZVBLMPKM-CYBMUJFWSA-N 1 2 328.206 2.465 20 70 EEIDLO CCOC(=O)C[N@@H+]1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000160270281 206288740 /nfs/dbraw/zinc/28/87/40/206288740.db2.gz DXNNVAUOVDGMHM-OAHLLOKOSA-N 1 2 333.432 2.392 20 70 EEIDLO CCOC(=O)C[N@H+]1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000160270281 206288745 /nfs/dbraw/zinc/28/87/45/206288745.db2.gz DXNNVAUOVDGMHM-OAHLLOKOSA-N 1 2 333.432 2.392 20 70 EEIDLO CC1=C(C(=O)NC[C@H](c2cccs2)[NH+]2CCOCC2)CCCO1 ZINC000160391906 206294411 /nfs/dbraw/zinc/29/44/11/206294411.db2.gz GAJLFPHXBNJNAW-OAHLLOKOSA-N 1 2 336.457 2.322 20 70 EEIDLO Cc1c([C@H](C)[NH2+]CC(=O)NC(C)C)nnn1-c1ccc(Cl)cc1 ZINC000160964133 206320587 /nfs/dbraw/zinc/32/05/87/206320587.db2.gz ZCXKYLORVBZVTP-NSHDSACASA-N 1 2 335.839 2.404 20 70 EEIDLO COc1ccc(OCCN2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000161176213 206332716 /nfs/dbraw/zinc/33/27/16/206332716.db2.gz AJJKBSZBORAOJD-UHFFFAOYSA-N 1 2 327.428 2.287 20 70 EEIDLO CC[C@H]1CCCCN1C(=O)[C@@H](C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161177850 311363095 /nfs/dbraw/zinc/36/30/95/311363095.db2.gz TVBUQRUMXUVILM-MJGOQNOKSA-N 1 2 344.503 2.379 20 70 EEIDLO CC[C@H]1CCCCN1C(=O)[C@@H](C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161177850 311363096 /nfs/dbraw/zinc/36/30/96/311363096.db2.gz TVBUQRUMXUVILM-MJGOQNOKSA-N 1 2 344.503 2.379 20 70 EEIDLO C[C@H](C(=O)N1C[C@H](C)C[C@H](C)C1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161239192 311363656 /nfs/dbraw/zinc/36/36/56/311363656.db2.gz NAEOYIPHARFRPF-FGTMMUONSA-N 1 2 344.503 2.092 20 70 EEIDLO C[C@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161239192 311363660 /nfs/dbraw/zinc/36/36/60/311363660.db2.gz NAEOYIPHARFRPF-FGTMMUONSA-N 1 2 344.503 2.092 20 70 EEIDLO COc1ccc([C@@H](NC(=O)[C@@H]2CCCCO2)c2[nH+]ccn2C)cc1 ZINC000160336118 463328970 /nfs/dbraw/zinc/32/89/70/463328970.db2.gz NWFORKACKWHFAC-JKSUJKDBSA-N 1 2 329.400 2.203 20 70 EEIDLO CC(=O)N1CCCc2cc(NC(=O)NCCCn3cc[nH+]c3)ccc21 ZINC000160847445 463375871 /nfs/dbraw/zinc/37/58/71/463375871.db2.gz WEBMFPZFINKRJM-UHFFFAOYSA-N 1 2 341.415 2.394 20 70 EEIDLO C[C@@]1(O)CCCN(C(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000160951628 463384962 /nfs/dbraw/zinc/38/49/62/463384962.db2.gz YLFCQAHQENVCGY-QGZVFWFLSA-N 1 2 332.379 2.068 20 70 EEIDLO O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccnc(-n2cc[nH+]c2)c1 ZINC000159871566 206268174 /nfs/dbraw/zinc/26/81/74/206268174.db2.gz LZONXINDKZWIRW-HNNXBMFYSA-N 1 2 326.400 2.489 20 70 EEIDLO CC1CCN(c2ccc(CNC(=O)N3CCC[C@](C)(O)C3)c[nH+]2)CC1 ZINC000160218918 206284379 /nfs/dbraw/zinc/28/43/79/206284379.db2.gz DATBCOCHFVBVGT-IBGZPJMESA-N 1 2 346.475 2.374 20 70 EEIDLO O=C1[C@H]([N@@H+]2CCOC3(CCOCC3)C2)CCCN1c1ccccc1F ZINC000161438144 206348697 /nfs/dbraw/zinc/34/86/97/206348697.db2.gz GOIZIMDMBZCUIO-QGZVFWFLSA-N 1 2 348.418 2.203 20 70 EEIDLO O=C1[C@H]([N@H+]2CCOC3(CCOCC3)C2)CCCN1c1ccccc1F ZINC000161438144 206348702 /nfs/dbraw/zinc/34/87/02/206348702.db2.gz GOIZIMDMBZCUIO-QGZVFWFLSA-N 1 2 348.418 2.203 20 70 EEIDLO Cn1ncc2c1nc[nH+]c2S[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000159538842 311342485 /nfs/dbraw/zinc/34/24/85/311342485.db2.gz AJJMCWWGADTAPG-VIFPVBQESA-N 1 2 345.350 2.009 20 70 EEIDLO CCCc1nnc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)s1 ZINC000160305361 206289945 /nfs/dbraw/zinc/28/99/45/206289945.db2.gz KJVXCTJQCWYQKR-NSHDSACASA-N 1 2 332.433 2.286 20 70 EEIDLO CCOC[C@H]1CC[N@@H+]([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000160497910 206300009 /nfs/dbraw/zinc/30/00/09/206300009.db2.gz KVLZVKVOSGCGHO-FZMZJTMJSA-N 1 2 341.249 2.334 20 70 EEIDLO CCOC[C@H]1CC[N@H+]([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000160497910 206300013 /nfs/dbraw/zinc/30/00/13/206300013.db2.gz KVLZVKVOSGCGHO-FZMZJTMJSA-N 1 2 341.249 2.334 20 70 EEIDLO CN(CCCn1cc[nH+]c1)C(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160765887 206312783 /nfs/dbraw/zinc/31/27/83/206312783.db2.gz XOCSHMOQDOIJHY-UHFFFAOYSA-N 1 2 330.314 2.196 20 70 EEIDLO CC1=C(C(=O)N2CCN(Cc3cn4ccccc4[nH+]3)CC2)CCCO1 ZINC000160928000 206319150 /nfs/dbraw/zinc/31/91/50/206319150.db2.gz NBHNBLQKFJDFHW-UHFFFAOYSA-N 1 2 340.427 2.063 20 70 EEIDLO CCc1c(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)[nH]c(C)c1C(C)=O ZINC000161345588 206343817 /nfs/dbraw/zinc/34/38/17/206343817.db2.gz XMWIEFFUVSBFFS-CQSZACIVSA-N 1 2 340.427 2.492 20 70 EEIDLO CN(C[C@H]1CCC[C@@H]1O)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000159934671 206271044 /nfs/dbraw/zinc/27/10/44/206271044.db2.gz HKISLIHCTWGJNF-WBVHZDCISA-N 1 2 328.416 2.175 20 70 EEIDLO CC(C)S(=O)(=O)CCC[NH+]1CCN(c2ccc(F)cc2)CC1 ZINC000160486225 206300737 /nfs/dbraw/zinc/30/07/37/206300737.db2.gz XORMXWPWUPXTGQ-UHFFFAOYSA-N 1 2 328.453 2.161 20 70 EEIDLO CC(C)C[C@H](C)NC(=O)c1ccccc1S(=O)(=O)CC[NH+](C)C ZINC000160003573 311348705 /nfs/dbraw/zinc/34/87/05/311348705.db2.gz WOBGWBPDLNJLNR-AWEZNQCLSA-N 1 2 340.489 2.186 20 70 EEIDLO Cn1cc[nH+]c1CN1CCN(C(=O)c2cc(Cl)ccc2F)CC1 ZINC000160791476 311358939 /nfs/dbraw/zinc/35/89/39/311358939.db2.gz KCUOISNQAVXOOK-UHFFFAOYSA-N 1 2 336.798 2.171 20 70 EEIDLO CC(C)Cn1cc[nH+]c1CNC(=O)Nc1ccnn1C[C@H]1CCOC1 ZINC000159669162 463299017 /nfs/dbraw/zinc/29/90/17/463299017.db2.gz OYMRTAIYDIXOMC-CQSZACIVSA-N 1 2 346.435 2.094 20 70 EEIDLO C[C@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160389864 463333296 /nfs/dbraw/zinc/33/32/96/463333296.db2.gz XOQCGJDQWRAGAK-QFBILLFUSA-N 1 2 346.471 2.066 20 70 EEIDLO C[C@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160389864 463333304 /nfs/dbraw/zinc/33/33/04/463333304.db2.gz XOQCGJDQWRAGAK-QFBILLFUSA-N 1 2 346.471 2.066 20 70 EEIDLO O=C(NCCc1nc2c(s1)CCCC2)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161126318 463402412 /nfs/dbraw/zinc/40/24/12/463402412.db2.gz OGHGVCUKLLWACZ-GFCCVEGCSA-N 1 2 330.457 2.140 20 70 EEIDLO CCOC(=O)C1(C(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)CCC1 ZINC000161155186 463405289 /nfs/dbraw/zinc/40/52/89/463405289.db2.gz RRBGCBOHOWRPRZ-UHFFFAOYSA-N 1 2 345.374 2.361 20 70 EEIDLO COC(=O)c1[nH]c(C)c(C(=O)NCc2cn3c(cccc3C)[nH+]2)c1C ZINC000159386758 206242112 /nfs/dbraw/zinc/24/21/12/206242112.db2.gz YUDANQMATLLNRU-UHFFFAOYSA-N 1 2 340.383 2.304 20 70 EEIDLO CCN(Cc1cccc(F)c1)C(=O)CSCC[NH+]1CCOCC1 ZINC000159875511 206267960 /nfs/dbraw/zinc/26/79/60/206267960.db2.gz YGZXDSXZYVMHMM-UHFFFAOYSA-N 1 2 340.464 2.240 20 70 EEIDLO CC[C@H](COC)NC(=O)NC[C@H](c1c(F)cccc1F)[NH+](C)C ZINC000160118521 206281153 /nfs/dbraw/zinc/28/11/53/206281153.db2.gz BDSGHEJSWVZDAK-BXUZGUMPSA-N 1 2 329.391 2.292 20 70 EEIDLO CCCC(=O)N[C@H]1CCC[N@@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)C1 ZINC000160191148 206283751 /nfs/dbraw/zinc/28/37/51/206283751.db2.gz JYHSNDABHNQABR-FUHWJXTLSA-N 1 2 343.471 2.481 20 70 EEIDLO CCCC(=O)N[C@H]1CCC[N@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)C1 ZINC000160191148 206283753 /nfs/dbraw/zinc/28/37/53/206283753.db2.gz JYHSNDABHNQABR-FUHWJXTLSA-N 1 2 343.471 2.481 20 70 EEIDLO CC[C@@H](O)CCNC(=O)N[C@@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000160838260 206315407 /nfs/dbraw/zinc/31/54/07/206315407.db2.gz JZQPDEPPVUQMHF-HUUCEWRRSA-N 1 2 334.395 2.109 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)CSc1nccc2ccccc21 ZINC000161249032 206338151 /nfs/dbraw/zinc/33/81/51/206338151.db2.gz FVMVEYQHKQSFAP-UHFFFAOYSA-N 1 2 345.468 2.118 20 70 EEIDLO CN1CC[C@@H]([NH2+][C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1=O ZINC000161271404 206339580 /nfs/dbraw/zinc/33/95/80/206339580.db2.gz RILHNQDCFPADNE-SJORKVTESA-N 1 2 341.386 2.326 20 70 EEIDLO CC(=O)c1c(C)[nH]c(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1C ZINC000161409038 206345698 /nfs/dbraw/zinc/34/56/98/206345698.db2.gz XHRPOWCIGNTKMV-CQSZACIVSA-N 1 2 326.400 2.238 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)NC1(c2ccccc2)CCC1 ZINC000159775237 311346052 /nfs/dbraw/zinc/34/60/52/311346052.db2.gz JYSUGKHFWWVWNI-UHFFFAOYSA-N 1 2 334.485 2.247 20 70 EEIDLO COc1c(C)c[nH+]c(Cn2ccc(C(=O)OC(C)C)cc2=O)c1C ZINC000161037362 311361382 /nfs/dbraw/zinc/36/13/82/311361382.db2.gz IRYDJXGQCHRVJN-UHFFFAOYSA-N 1 2 330.384 2.482 20 70 EEIDLO CCc1ncsc1C(=O)N[C@@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000161003649 463389683 /nfs/dbraw/zinc/38/96/83/463389683.db2.gz NSRZQIDUYOGUJA-ZDUSSCGKSA-N 1 2 337.489 2.469 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)CCC(=O)Nc1cccc(Cl)c1 ZINC000161188053 463409102 /nfs/dbraw/zinc/40/91/02/463409102.db2.gz VDAVJOAQSCHTDV-UHFFFAOYSA-N 1 2 341.820 2.017 20 70 EEIDLO CCc1nn(C)c(OC)c1C[NH2+][C@@H](C(=O)NC1CC1)c1ccccc1 ZINC000159771310 206262310 /nfs/dbraw/zinc/26/23/10/206262310.db2.gz ASGJRBCCGNIUPL-QGZVFWFLSA-N 1 2 342.443 2.101 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)Nc1ccc(F)c(F)c1 ZINC000161145845 206331360 /nfs/dbraw/zinc/33/13/60/206331360.db2.gz RTRVRMUWSCHISH-UHFFFAOYSA-N 1 2 346.381 2.116 20 70 EEIDLO CCCOc1cccc(C[NH+]2CCN(C(=O)[C@@H]3CCCO3)CC2)c1 ZINC000161016510 206323518 /nfs/dbraw/zinc/32/35/18/206323518.db2.gz OHCOFXXGBXGTQW-SFHVURJKSA-N 1 2 332.444 2.299 20 70 EEIDLO C[C@@H](NC(=O)CN1CC[NH+](Cc2ccncc2)CC1)c1cccs1 ZINC000161240692 206337910 /nfs/dbraw/zinc/33/79/10/206337910.db2.gz ZTOJRTJDZXSYJC-OAHLLOKOSA-N 1 2 344.484 2.138 20 70 EEIDLO CCc1noc([C@@H](C)N2CCN(Cc3c[nH+]c4ccccn34)CC2)n1 ZINC000160016166 225320100 /nfs/dbraw/zinc/32/01/00/225320100.db2.gz QSMPDMUWRPUFFD-CQSZACIVSA-N 1 2 340.431 2.159 20 70 EEIDLO Cn1cc([C@@H]2CCC[N@@H+]2CC(=O)Nc2cc(C(C)(C)C)nn2C)cn1 ZINC000160521171 463345105 /nfs/dbraw/zinc/34/51/05/463345105.db2.gz QPWMSQMOKPQOJZ-AWEZNQCLSA-N 1 2 344.463 2.227 20 70 EEIDLO Cn1cc([C@@H]2CCC[N@H+]2CC(=O)Nc2cc(C(C)(C)C)nn2C)cn1 ZINC000160521171 463345113 /nfs/dbraw/zinc/34/51/13/463345113.db2.gz QPWMSQMOKPQOJZ-AWEZNQCLSA-N 1 2 344.463 2.227 20 70 EEIDLO CC[N@H+](CC(=O)NCc1ccc(Cl)s1)Cc1cnn(C)c1 ZINC000161127810 463401824 /nfs/dbraw/zinc/40/18/24/463401824.db2.gz OPZCBCLMRROVQJ-UHFFFAOYSA-N 1 2 326.853 2.273 20 70 EEIDLO CC[N@@H+](CC(=O)NCc1ccc(Cl)s1)Cc1cnn(C)c1 ZINC000161127810 463401827 /nfs/dbraw/zinc/40/18/27/463401827.db2.gz OPZCBCLMRROVQJ-UHFFFAOYSA-N 1 2 326.853 2.273 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N(C)Cc1cccc(F)c1 ZINC000159878461 206268943 /nfs/dbraw/zinc/26/89/43/206268943.db2.gz LZIMFPMTCPLYQH-AWEZNQCLSA-N 1 2 340.464 2.238 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(F)c(F)c1 ZINC000159919376 206269450 /nfs/dbraw/zinc/26/94/50/206269450.db2.gz YLMJNOHLVOLHLJ-LLVKDONJSA-N 1 2 330.400 2.357 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N1c2ccccc2C[C@H]1C ZINC000159965595 206273619 /nfs/dbraw/zinc/27/36/19/206273619.db2.gz MVLATZXQBCWBES-CABCVRRESA-N 1 2 334.485 2.418 20 70 EEIDLO CCc1nnc(C[NH2+][C@H](CC)c2ccccc2OCC(=O)N(C)C)[nH]1 ZINC000160322963 206290502 /nfs/dbraw/zinc/29/05/02/206290502.db2.gz HDYMTMRKYAYXCE-CQSZACIVSA-N 1 2 345.447 2.075 20 70 EEIDLO CCCCOC(=O)[C@H](C)[N@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000160350775 206291637 /nfs/dbraw/zinc/29/16/37/206291637.db2.gz DXCNOPFWIDRLCF-STQMWFEESA-N 1 2 342.461 2.059 20 70 EEIDLO CCCCOC(=O)[C@H](C)[N@@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000160350775 206291641 /nfs/dbraw/zinc/29/16/41/206291641.db2.gz DXCNOPFWIDRLCF-STQMWFEESA-N 1 2 342.461 2.059 20 70 EEIDLO C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161185989 206334537 /nfs/dbraw/zinc/33/45/37/206334537.db2.gz MMFXIWPLFSHLOD-LMMKCTJWSA-N 1 2 344.503 2.283 20 70 EEIDLO C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161185989 206334542 /nfs/dbraw/zinc/33/45/42/206334542.db2.gz MMFXIWPLFSHLOD-LMMKCTJWSA-N 1 2 344.503 2.283 20 70 EEIDLO O=C(N[C@H]1CCN(c2cccc[nH+]2)C1)c1cccnc1Br ZINC000161245602 206337285 /nfs/dbraw/zinc/33/72/85/206337285.db2.gz DUGSSSITIUNFJU-NSHDSACASA-N 1 2 347.216 2.248 20 70 EEIDLO CCCn1c(C)nnc1C[N@@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000160693203 311357947 /nfs/dbraw/zinc/35/79/47/311357947.db2.gz ZSIVKTKQFRUMRQ-CQSZACIVSA-N 1 2 337.468 2.438 20 70 EEIDLO CCCn1c(C)nnc1C[N@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000160693203 311357948 /nfs/dbraw/zinc/35/79/48/311357948.db2.gz ZSIVKTKQFRUMRQ-CQSZACIVSA-N 1 2 337.468 2.438 20 70 EEIDLO CCCC[N@H+](Cc1c(CC)nn(C)c1CC)[C@H]1CCS(=O)(=O)C1 ZINC000160796119 311358664 /nfs/dbraw/zinc/35/86/64/311358664.db2.gz JKQOBLFVDYOGMU-AWEZNQCLSA-N 1 2 341.521 2.334 20 70 EEIDLO CCCC[N@@H+](Cc1c(CC)nn(C)c1CC)[C@H]1CCS(=O)(=O)C1 ZINC000160796119 311358667 /nfs/dbraw/zinc/35/86/67/311358667.db2.gz JKQOBLFVDYOGMU-AWEZNQCLSA-N 1 2 341.521 2.334 20 70 EEIDLO Cn1ccnc1C[NH+]1CCC(NC(=O)Nc2ccc(F)cc2)CC1 ZINC000160790153 311358955 /nfs/dbraw/zinc/35/89/55/311358955.db2.gz LJIZLACCIOAWGW-UHFFFAOYSA-N 1 2 331.395 2.345 20 70 EEIDLO CCc1nn(C)c(Cl)c1C(=O)NCCc1cn2c([nH+]1)CCCC2 ZINC000159716737 463300915 /nfs/dbraw/zinc/30/09/15/463300915.db2.gz WAJGZDGKWJAUNS-UHFFFAOYSA-N 1 2 335.839 2.141 20 70 EEIDLO CC(C)Oc1cncc(C(=O)N2CC[NH+](Cc3ccccn3)CC2)c1 ZINC000160091080 311349550 /nfs/dbraw/zinc/34/95/50/311349550.db2.gz DILPRIAUUJAUND-UHFFFAOYSA-N 1 2 340.427 2.222 20 70 EEIDLO CC1(C)CCC(C(=O)Nc2cnn(CC[NH+]3CCOCC3)c2)CC1 ZINC000159976840 463313361 /nfs/dbraw/zinc/31/33/61/463313361.db2.gz DNIIMJKBWFTNIU-UHFFFAOYSA-N 1 2 334.464 2.370 20 70 EEIDLO O=C(NCc1nc(C[N@H+]2CCCC[C@@H]2CO)cs1)c1ccccc1 ZINC000159919333 225302081 /nfs/dbraw/zinc/30/20/81/225302081.db2.gz OYVGXFLZXWROBO-MRXNPFEDSA-N 1 2 345.468 2.420 20 70 EEIDLO O=C(NCc1nc(C[N@@H+]2CCCC[C@@H]2CO)cs1)c1ccccc1 ZINC000159919333 225302083 /nfs/dbraw/zinc/30/20/83/225302083.db2.gz OYVGXFLZXWROBO-MRXNPFEDSA-N 1 2 345.468 2.420 20 70 EEIDLO C[C@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)COCc1ccccc1 ZINC000160391105 463334817 /nfs/dbraw/zinc/33/48/17/463334817.db2.gz RQDSYWVDZGQJQX-NVXWUHKLSA-N 1 2 327.428 2.415 20 70 EEIDLO COc1ccc(OCCCNC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160435497 463338655 /nfs/dbraw/zinc/33/86/55/463338655.db2.gz PFTAGDBYAZDUJU-CQSZACIVSA-N 1 2 329.400 2.039 20 70 EEIDLO CO[C@@H](C)C(=O)Nc1cccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1 ZINC000160587797 463352721 /nfs/dbraw/zinc/35/27/21/463352721.db2.gz DUCXGCMULTXBMP-QWHCGFSZSA-N 1 2 342.399 2.058 20 70 EEIDLO CC(C)Sc1ccccc1NC(=O)C(=O)NCCn1cc[nH+]c1 ZINC000161133009 463403462 /nfs/dbraw/zinc/40/34/62/463403462.db2.gz YABIKCFAFJSZMR-UHFFFAOYSA-N 1 2 332.429 2.139 20 70 EEIDLO Cc1cccc(C(C)C)c1NC(=O)CS(=O)(=O)Cc1[nH+]ccn1C ZINC000161185553 463408490 /nfs/dbraw/zinc/40/84/90/463408490.db2.gz ZFMZJVBLIRGXJL-UHFFFAOYSA-N 1 2 349.456 2.405 20 70 EEIDLO CCC(=O)Nc1cccc(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000161301306 463417736 /nfs/dbraw/zinc/41/77/36/463417736.db2.gz WSJWJZMSWUIWLH-INIZCTEOSA-N 1 2 338.411 2.439 20 70 EEIDLO C[C@H](C(=O)N[C@@H]1CCN(c2cccc[nH+]2)C1)n1cnc2ccccc21 ZINC000161381803 463426809 /nfs/dbraw/zinc/42/68/09/463426809.db2.gz RBAVINROPILLJG-HUUCEWRRSA-N 1 2 335.411 2.387 20 70 EEIDLO Cc1ncccc1C[NH+]1CCN(C(=O)COc2ccc(F)cc2)CC1 ZINC000160622730 159713652 /nfs/dbraw/zinc/71/36/52/159713652.db2.gz ZGEBSAVVKMXWKT-UHFFFAOYSA-N 1 2 343.402 2.252 20 70 EEIDLO COc1cc(C[N@@H+]2CCNC(=O)C2)c(-c2ccccc2)cc1OC ZINC000160491576 311354807 /nfs/dbraw/zinc/35/48/07/311354807.db2.gz CDPCCCXSDKQUOD-UHFFFAOYSA-N 1 2 326.396 2.303 20 70 EEIDLO COc1cc(C[N@H+]2CCNC(=O)C2)c(-c2ccccc2)cc1OC ZINC000160491576 311354808 /nfs/dbraw/zinc/35/48/08/311354808.db2.gz CDPCCCXSDKQUOD-UHFFFAOYSA-N 1 2 326.396 2.303 20 70 EEIDLO COC[C@H](O)CCNC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000160864064 311359716 /nfs/dbraw/zinc/35/97/16/311359716.db2.gz LINREBMAWGAVFZ-OAHLLOKOSA-N 1 2 330.384 2.310 20 70 EEIDLO O=C(NCCNc1nc2ccccc2s1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000159607326 463294909 /nfs/dbraw/zinc/29/49/09/463294909.db2.gz VRSXZJCRNXDZHP-GFCCVEGCSA-N 1 2 341.440 2.284 20 70 EEIDLO COc1cc2c(cc1OC)C[N@H+](CCCS(=O)(=O)C(C)C)CC2 ZINC000160508782 463345809 /nfs/dbraw/zinc/34/58/09/463345809.db2.gz CQZIOKURAWUGLB-UHFFFAOYSA-N 1 2 341.473 2.275 20 70 EEIDLO COc1cc2c(cc1OC)C[N@@H+](CCCS(=O)(=O)C(C)C)CC2 ZINC000160508782 463345813 /nfs/dbraw/zinc/34/58/13/463345813.db2.gz CQZIOKURAWUGLB-UHFFFAOYSA-N 1 2 341.473 2.275 20 70 EEIDLO CCCn1c(C)nnc1CN1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000161404374 463428707 /nfs/dbraw/zinc/42/87/07/463428707.db2.gz VHQKAZZZVHNTPJ-UHFFFAOYSA-N 1 2 331.439 2.453 20 70 EEIDLO CC(=O)c1csc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160006624 527423330 /nfs/dbraw/zinc/42/33/30/527423330.db2.gz YDLDHAQDJPKMFL-UHFFFAOYSA-N 1 2 338.473 2.381 20 70 EEIDLO Cc1ccccc1C[N@H+](C)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 ZINC000160526025 311355353 /nfs/dbraw/zinc/35/53/53/311355353.db2.gz NHLPXPLWQLKGSI-GOSISDBHSA-N 1 2 347.484 2.357 20 70 EEIDLO Cc1ccccc1C[N@@H+](C)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 ZINC000160526025 311355355 /nfs/dbraw/zinc/35/53/55/311355355.db2.gz NHLPXPLWQLKGSI-GOSISDBHSA-N 1 2 347.484 2.357 20 70 EEIDLO O=C([C@H]1CCCO1)N1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1 ZINC000160966151 311360487 /nfs/dbraw/zinc/36/04/87/311360487.db2.gz PALGURQTOGDEGI-QGZVFWFLSA-N 1 2 332.375 2.395 20 70 EEIDLO C[C@H](C(=O)N1CCC[N@H+](CC(=O)N2CCCC2)CC1)c1ccsc1 ZINC000160064177 463316892 /nfs/dbraw/zinc/31/68/92/463316892.db2.gz PXCBHUQTSZHQDO-HNNXBMFYSA-N 1 2 349.500 2.008 20 70 EEIDLO C[C@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)c1ccsc1 ZINC000160064177 463316897 /nfs/dbraw/zinc/31/68/97/463316897.db2.gz PXCBHUQTSZHQDO-HNNXBMFYSA-N 1 2 349.500 2.008 20 70 EEIDLO Cc1ccc(-c2nc(NC(=O)C[N@@H+](C)Cc3ccccc3)n[nH]2)o1 ZINC000160162450 463320925 /nfs/dbraw/zinc/32/09/25/463320925.db2.gz UGOLJMZJDKJDLE-UHFFFAOYSA-N 1 2 325.372 2.444 20 70 EEIDLO Cc1ccc(-c2nc(NC(=O)C[N@H+](C)Cc3ccccc3)n[nH]2)o1 ZINC000160162450 463320928 /nfs/dbraw/zinc/32/09/28/463320928.db2.gz UGOLJMZJDKJDLE-UHFFFAOYSA-N 1 2 325.372 2.444 20 70 EEIDLO Cc1ccc(-c2n[nH]c(NC(=O)C[N@@H+](C)Cc3ccccc3)n2)o1 ZINC000160162450 463320932 /nfs/dbraw/zinc/32/09/32/463320932.db2.gz UGOLJMZJDKJDLE-UHFFFAOYSA-N 1 2 325.372 2.444 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCCc2ccccc21 ZINC000160007034 533993174 /nfs/dbraw/zinc/99/31/74/533993174.db2.gz ISVZFSIDJRZIPO-OAHLLOKOSA-N 1 2 334.485 2.420 20 70 EEIDLO O=C1[C@@H](SCC[NH+]2CCOCC2)CCCN1c1cccc(F)c1 ZINC000159998684 534833977 /nfs/dbraw/zinc/83/39/77/534833977.db2.gz UIWUDZMKXVSUFY-INIZCTEOSA-N 1 2 338.448 2.387 20 70 EEIDLO O=C(C1=NN(c2ccccc2)CC1=O)N1CCC([NH2+]CC2CC2)CC1 ZINC000159736337 225269359 /nfs/dbraw/zinc/26/93/59/225269359.db2.gz WWTNLYPXPPITHT-UHFFFAOYSA-N 1 2 340.427 2.182 20 70 EEIDLO O=C(NCCCn1cc[nH+]c1)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000160293619 225381726 /nfs/dbraw/zinc/38/17/26/225381726.db2.gz XBIXJDGNIYLQLJ-INIZCTEOSA-N 1 2 330.388 2.263 20 70 EEIDLO CN(C(=O)Nc1ccccc1C[NH+]1CCOCC1)[C@@H]1CCSC1 ZINC000161434053 276730751 /nfs/dbraw/zinc/73/07/51/276730751.db2.gz DZJZDDVAKQJPCR-OAHLLOKOSA-N 1 2 335.473 2.488 20 70 EEIDLO CC(=O)[C@H](NC(=O)C[N@H+](CCc1nccs1)C(C)C)C(C)C ZINC000159852876 311347196 /nfs/dbraw/zinc/34/71/96/311347196.db2.gz PYJRKKVQYSBTPB-MRXNPFEDSA-N 1 2 325.478 2.126 20 70 EEIDLO CC(=O)[C@H](NC(=O)C[N@@H+](CCc1nccs1)C(C)C)C(C)C ZINC000159852876 311347197 /nfs/dbraw/zinc/34/71/97/311347197.db2.gz PYJRKKVQYSBTPB-MRXNPFEDSA-N 1 2 325.478 2.126 20 70 EEIDLO CC(C)[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCCC[C@H]1C ZINC000160020537 311349329 /nfs/dbraw/zinc/34/93/29/311349329.db2.gz BHVDTDLJUNSOCK-HZPDHXFCSA-N 1 2 328.522 2.477 20 70 EEIDLO CN(CC[N@H+](C)CN1C[C@@H](C2CC2)CC1=O)C(=O)OC(C)(C)C ZINC000160532730 311355042 /nfs/dbraw/zinc/35/50/42/311355042.db2.gz PPSWWKQCQTUQHM-AWEZNQCLSA-N 1 2 325.453 2.001 20 70 EEIDLO CN(CC[N@@H+](C)CN1C[C@@H](C2CC2)CC1=O)C(=O)OC(C)(C)C ZINC000160532730 311355044 /nfs/dbraw/zinc/35/50/44/311355044.db2.gz PPSWWKQCQTUQHM-AWEZNQCLSA-N 1 2 325.453 2.001 20 70 EEIDLO CCOc1ccc(C[NH+]2CCN(C(=O)C(C)(C)COC)CC2)cc1 ZINC000161155097 463405770 /nfs/dbraw/zinc/40/57/70/463405770.db2.gz KHZJCXMFMKEAFP-UHFFFAOYSA-N 1 2 334.460 2.402 20 70 EEIDLO CCC(CC)[C@H](C(=O)Nc1ccc(OC)c(N)c1)[NH+]1CCOCC1 ZINC000161240473 463412737 /nfs/dbraw/zinc/41/27/37/463412737.db2.gz DQNFTWGGGUYFPN-QGZVFWFLSA-N 1 2 335.448 2.353 20 70 EEIDLO C[N@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1nnnn1C1CC1 ZINC000161233053 463413077 /nfs/dbraw/zinc/41/30/77/463413077.db2.gz IHMYIPHJLOOQMV-UHFFFAOYSA-N 1 2 337.431 2.463 20 70 EEIDLO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1nnnn1C1CC1 ZINC000161233053 463413083 /nfs/dbraw/zinc/41/30/83/463413083.db2.gz IHMYIPHJLOOQMV-UHFFFAOYSA-N 1 2 337.431 2.463 20 70 EEIDLO CCOCCC1(C(=O)NCc2ccc[nH+]c2N2CCOCC2)CCC1 ZINC000161491723 463434222 /nfs/dbraw/zinc/43/42/22/463434222.db2.gz XRUJNPQPQRHYCF-UHFFFAOYSA-N 1 2 347.459 2.131 20 70 EEIDLO CCn1cnnc1C[NH2+]Cc1cc2c(c(Br)c1)OCO2 ZINC000218224299 464108809 /nfs/dbraw/zinc/10/88/09/464108809.db2.gz CNCOIZBPSIKEGJ-UHFFFAOYSA-N 1 2 339.193 2.079 20 70 EEIDLO CCCc1ccc(S(=O)(=O)N2CC[NH+](CCSC)CC2)cc1 ZINC000216826820 160216072 /nfs/dbraw/zinc/21/60/72/160216072.db2.gz VDYKXEOLDVGADA-UHFFFAOYSA-N 1 2 342.530 2.308 20 70 EEIDLO Cc1ccc(S(=O)(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)s1 ZINC000159439045 225216976 /nfs/dbraw/zinc/21/69/76/225216976.db2.gz VQZIRMSRVQOAJV-UHFFFAOYSA-N 1 2 346.518 2.035 20 70 EEIDLO O=C(Nc1n[nH]c(-c2ccccc2F)n1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161333750 275001766 /nfs/dbraw/zinc/00/17/66/275001766.db2.gz TXIMIAOSHJYKPV-SNVBAGLBSA-N 1 2 326.335 2.008 20 70 EEIDLO O=C(NCCCn1cc[nH+]c1)C(=O)Nc1cccnc1-c1ccccc1 ZINC000159945599 311348348 /nfs/dbraw/zinc/34/83/48/311348348.db2.gz VAAFWXQKMOYUDQ-UHFFFAOYSA-N 1 2 349.394 2.090 20 70 EEIDLO C[C@@H]1CCCC[C@@H]1NC(=O)C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161303078 311364142 /nfs/dbraw/zinc/36/41/42/311364142.db2.gz GEVAGXNNOHKQTO-ZLDLUXBVSA-N 1 2 336.398 2.317 20 70 EEIDLO COc1ccc([C@H](NC(=O)c2cc(C)ncn2)c2[nH+]ccn2C)cc1 ZINC000161379216 311365147 /nfs/dbraw/zinc/36/51/47/311365147.db2.gz CLSPSJZGSNYKFW-INIZCTEOSA-N 1 2 337.383 2.047 20 70 EEIDLO CCCn1c(C)nnc1CN(CC[NH+]1CCOCC1)c1ccccc1 ZINC000160679140 463362335 /nfs/dbraw/zinc/36/23/35/463362335.db2.gz IEEWXYQWILFYHV-UHFFFAOYSA-N 1 2 343.475 2.335 20 70 EEIDLO CCC(CC)(CO)CNC(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161112875 463401178 /nfs/dbraw/zinc/40/11/78/463401178.db2.gz QGQHLJVKXCAWBP-UHFFFAOYSA-N 1 2 349.475 2.439 20 70 EEIDLO CC[N@@H+]1CCc2nc3ccccc3c(C(=O)N[C@H]3CCC[C@@H]3O)c2C1 ZINC000161278889 463415943 /nfs/dbraw/zinc/41/59/43/463415943.db2.gz AFIKSPBOVCIVCV-ROUUACIJSA-N 1 2 339.439 2.256 20 70 EEIDLO CC[N@H+]1CCc2nc3ccccc3c(C(=O)N[C@H]3CCC[C@@H]3O)c2C1 ZINC000161278889 463415947 /nfs/dbraw/zinc/41/59/47/463415947.db2.gz AFIKSPBOVCIVCV-ROUUACIJSA-N 1 2 339.439 2.256 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCN(c3cccc(OC)c3)CC2)n1 ZINC000160523697 255798581 /nfs/dbraw/zinc/79/85/81/255798581.db2.gz OIZQPRBSTUWTEU-UHFFFAOYSA-N 1 2 328.416 2.075 20 70 EEIDLO CC1(C)CCC[C@H](CC(=O)N2CC[NH+](CC(=O)N3CCCC3)CC2)C1 ZINC000159627333 311343964 /nfs/dbraw/zinc/34/39/64/311343964.db2.gz SNQFFAPPFPHDFU-QGZVFWFLSA-N 1 2 349.519 2.360 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000160483988 463343056 /nfs/dbraw/zinc/34/30/56/463343056.db2.gz FAQLUTJIPDAXND-RBUKOAKNSA-N 1 2 345.487 2.371 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCC(C(=O)N3CCC[C@H](C)C3)CC2)n1 ZINC000160838591 463374582 /nfs/dbraw/zinc/37/45/82/463374582.db2.gz UXELHCDYXHBEKK-AWEZNQCLSA-N 1 2 346.475 2.215 20 70 EEIDLO C[C@@H](C(=O)N(C)C1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161188160 463409495 /nfs/dbraw/zinc/40/94/95/463409495.db2.gz NQWPTWMLUOYBLR-KRWDZBQOSA-N 1 2 344.503 2.379 20 70 EEIDLO C[C@@H](C(=O)N(C)C1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161188160 463409503 /nfs/dbraw/zinc/40/95/03/463409503.db2.gz NQWPTWMLUOYBLR-KRWDZBQOSA-N 1 2 344.503 2.379 20 70 EEIDLO Cc1nnc(-c2ccc(C(=O)N[C@@H]3CCN(c4cccc[nH+]4)C3)cc2)o1 ZINC000161289236 463416825 /nfs/dbraw/zinc/41/68/25/463416825.db2.gz BOTRJEDVMGYQGM-MRXNPFEDSA-N 1 2 349.394 2.449 20 70 EEIDLO C[C@@H](C(=O)N[C@@H]1CCN(c2cccc[nH+]2)C1)n1cnc2ccccc21 ZINC000161381679 463426763 /nfs/dbraw/zinc/42/67/63/463426763.db2.gz RBAVINROPILLJG-LSDHHAIUSA-N 1 2 335.411 2.387 20 70 EEIDLO CC(C)c1nc(N(C)C)nc(NCc2nnc(C3CC3)n2C2CC2)[nH+]1 ZINC000160330005 528294188 /nfs/dbraw/zinc/29/41/88/528294188.db2.gz FPSCEKGZDGVGRT-UHFFFAOYSA-N 1 2 342.451 2.477 20 70 EEIDLO CC(C)c1nc(NCc2nnc(C3CC3)n2C2CC2)nc(N(C)C)[nH+]1 ZINC000160330005 528294192 /nfs/dbraw/zinc/29/41/92/528294192.db2.gz FPSCEKGZDGVGRT-UHFFFAOYSA-N 1 2 342.451 2.477 20 70 EEIDLO CCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000160232216 528579147 /nfs/dbraw/zinc/57/91/47/528579147.db2.gz BQSIDGOPCPECHF-WFASDCNBSA-N 1 2 337.395 2.363 20 70 EEIDLO CCCOC(=O)[C@H](C)[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000160232216 528579149 /nfs/dbraw/zinc/57/91/49/528579149.db2.gz BQSIDGOPCPECHF-WFASDCNBSA-N 1 2 337.395 2.363 20 70 EEIDLO CSCCCCC(=O)N1CC[NH+](Cc2c(C)noc2C)CC1 ZINC000159913903 533540929 /nfs/dbraw/zinc/54/09/29/533540929.db2.gz SOQMJPUMUGKXJL-UHFFFAOYSA-N 1 2 325.478 2.469 20 70 EEIDLO CC(C)[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCC[C@@H](C)C1 ZINC000159957351 311348386 /nfs/dbraw/zinc/34/83/86/311348386.db2.gz QKWJMMXSENJMPF-HZPDHXFCSA-N 1 2 328.522 2.335 20 70 EEIDLO Cc1ccccc1C[N@H+](C)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 ZINC000160526161 311354986 /nfs/dbraw/zinc/35/49/86/311354986.db2.gz NHLPXPLWQLKGSI-SFHVURJKSA-N 1 2 347.484 2.357 20 70 EEIDLO Cc1ccccc1C[N@@H+](C)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 ZINC000160526161 311354987 /nfs/dbraw/zinc/35/49/87/311354987.db2.gz NHLPXPLWQLKGSI-SFHVURJKSA-N 1 2 347.484 2.357 20 70 EEIDLO CCCn1nc(C)c(C[N@H+](CCC)[C@H]2CCS(=O)(=O)C2)c1C ZINC000161075640 311361946 /nfs/dbraw/zinc/36/19/46/311361946.db2.gz UATHREAWFWXSIY-HNNXBMFYSA-N 1 2 327.494 2.309 20 70 EEIDLO CCCn1nc(C)c(C[N@@H+](CCC)[C@H]2CCS(=O)(=O)C2)c1C ZINC000161075640 311361947 /nfs/dbraw/zinc/36/19/47/311361947.db2.gz UATHREAWFWXSIY-HNNXBMFYSA-N 1 2 327.494 2.309 20 70 EEIDLO C[C@H]1CCC[C@H](C(=O)N2CC[NH+](CC(=O)N3CCCC[C@@H]3C)CC2)C1 ZINC000159922307 463310793 /nfs/dbraw/zinc/31/07/93/463310793.db2.gz OEJWJERPQWBOFP-BZSNNMDCSA-N 1 2 349.519 2.358 20 70 EEIDLO Cc1c([C@H](C)[NH2+]CC(=O)NC(C)C)nnn1-c1cccc(Cl)c1 ZINC000160906344 463381403 /nfs/dbraw/zinc/38/14/03/463381403.db2.gz DKEMYQYXYPATFF-NSHDSACASA-N 1 2 335.839 2.404 20 70 EEIDLO COC(=O)c1csc(NC(=O)NCCc2cn3c([nH+]2)CCCC3)c1 ZINC000161050690 463395492 /nfs/dbraw/zinc/39/54/92/463395492.db2.gz KBQJZTQMEXFNIT-UHFFFAOYSA-N 1 2 348.428 2.432 20 70 EEIDLO CCc1ccccc1C(=O)NCc1ccc[nH+]c1N1CCOCC1 ZINC000161492265 463434327 /nfs/dbraw/zinc/43/43/27/463434327.db2.gz IZBONNVJYGZDPL-UHFFFAOYSA-N 1 2 325.412 2.411 20 70 EEIDLO CC(C)Oc1cccc(-c2nnc(SCCn3cc[nH+]c3)n2N)c1 ZINC000160196334 528212482 /nfs/dbraw/zinc/21/24/82/528212482.db2.gz JZGKRPYLMUPLDM-UHFFFAOYSA-N 1 2 344.444 2.435 20 70 EEIDLO CCC[C@H]1CN(C(=O)NCc2cc[nH+]c(N3CCCC3)c2)CCO1 ZINC000159496035 528394524 /nfs/dbraw/zinc/39/45/24/528394524.db2.gz ZNRUMJWJZKFGAX-INIZCTEOSA-N 1 2 332.448 2.392 20 70 EEIDLO CC(C)N(C[C@H](C)O)C(=O)NCc1cccc(Cn2cc[nH+]c2)c1 ZINC000160139784 311350607 /nfs/dbraw/zinc/35/06/07/311350607.db2.gz OQOSYSMMMNGMIB-HNNXBMFYSA-N 1 2 330.432 2.232 20 70 EEIDLO CCN(C(=O)CN1CC[NH+](Cc2ccncc2)CC1)C1CCCCC1 ZINC000161152824 311362795 /nfs/dbraw/zinc/36/27/95/311362795.db2.gz YWDXZVBCLWULNU-UHFFFAOYSA-N 1 2 344.503 2.380 20 70 EEIDLO CCN(C(=O)C[NH+]1CCN(Cc2ccncc2)CC1)C1CCCCC1 ZINC000161152824 311362796 /nfs/dbraw/zinc/36/27/96/311362796.db2.gz YWDXZVBCLWULNU-UHFFFAOYSA-N 1 2 344.503 2.380 20 70 EEIDLO CN(CC(=O)Nc1cccc(Cl)c1)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000159746486 463302710 /nfs/dbraw/zinc/30/27/10/463302710.db2.gz WOWUWESIOZFIIT-GFCCVEGCSA-N 1 2 346.818 2.196 20 70 EEIDLO Cc1ccc(C[NH+]2CCN(S(=O)(=O)c3cccnc3)CC2)cc1C ZINC000159896573 463310840 /nfs/dbraw/zinc/31/08/40/463310840.db2.gz BHLNYMZKKSSWKJ-UHFFFAOYSA-N 1 2 345.468 2.205 20 70 EEIDLO O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000161194835 463409067 /nfs/dbraw/zinc/40/90/67/463409067.db2.gz QVQABTPNCPYUPE-ZDUSSCGKSA-N 1 2 335.367 2.247 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)NCc1ccc(Cl)cc1 ZINC000159962719 533992819 /nfs/dbraw/zinc/99/28/19/533992819.db2.gz AYQHJBJJOONKNK-CYBMUJFWSA-N 1 2 342.892 2.410 20 70 EEIDLO COc1ccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c(OC)c1 ZINC000159988594 534138852 /nfs/dbraw/zinc/13/88/52/534138852.db2.gz DGGJTWQCBSSHOC-ZDUSSCGKSA-N 1 2 342.399 2.499 20 70 EEIDLO CC[N@H+](CC(=O)Nc1ccc(NC(C)=O)cc1)Cc1ccc(CO)o1 ZINC000160215475 527923166 /nfs/dbraw/zinc/92/31/66/527923166.db2.gz IIVJWTHTNBEVPR-UHFFFAOYSA-N 1 2 345.399 2.191 20 70 EEIDLO CC[N@@H+](CC(=O)Nc1ccc(NC(C)=O)cc1)Cc1ccc(CO)o1 ZINC000160215475 527923170 /nfs/dbraw/zinc/92/31/70/527923170.db2.gz IIVJWTHTNBEVPR-UHFFFAOYSA-N 1 2 345.399 2.191 20 70 EEIDLO CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000160135898 529767278 /nfs/dbraw/zinc/76/72/78/529767278.db2.gz CZIDLJSIUOSVIK-NSHDSACASA-N 1 2 333.823 2.040 20 70 EEIDLO COCc1nc2n(n1)C[C@@H](Nc1ccc3cc(OC)ccc3[nH+]1)CC2 ZINC000161338651 539527746 /nfs/dbraw/zinc/52/77/46/539527746.db2.gz ROHDAWZWBBSSCA-ZDUSSCGKSA-N 1 2 339.399 2.408 20 70 EEIDLO COC(=O)C[C@H]1C(=O)NCC[N@H+]1Cc1cccc(-c2ccccc2)c1 ZINC000159828196 463307047 /nfs/dbraw/zinc/30/70/47/463307047.db2.gz JICGJFONOLJCLD-SFHVURJKSA-N 1 2 338.407 2.217 20 70 EEIDLO COC(=O)C[C@H]1C(=O)NCC[N@@H+]1Cc1cccc(-c2ccccc2)c1 ZINC000159828196 463307052 /nfs/dbraw/zinc/30/70/52/463307052.db2.gz JICGJFONOLJCLD-SFHVURJKSA-N 1 2 338.407 2.217 20 70 EEIDLO C[N@@H+]1CCO[C@@H]2CN(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3)C[C@@H]21 ZINC000160269211 463325534 /nfs/dbraw/zinc/32/55/34/463325534.db2.gz NDVYRUAVVVGGAJ-ZJPYXAASSA-N 1 2 329.444 2.047 20 70 EEIDLO C[N@H+]1CCO[C@@H]2CN(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3)C[C@@H]21 ZINC000160269211 463325539 /nfs/dbraw/zinc/32/55/39/463325539.db2.gz NDVYRUAVVVGGAJ-ZJPYXAASSA-N 1 2 329.444 2.047 20 70 EEIDLO CCc1nnc(C[NH2+][C@@H](CC)c2ccccc2OCC(=O)N(C)C)[nH]1 ZINC000160322838 463329158 /nfs/dbraw/zinc/32/91/58/463329158.db2.gz HDYMTMRKYAYXCE-AWEZNQCLSA-N 1 2 345.447 2.075 20 70 EEIDLO CC1=C(C(=O)NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)CCCO1 ZINC000160388866 463333001 /nfs/dbraw/zinc/33/30/01/463333001.db2.gz BWSFYTXIUJYNNH-KRWDZBQOSA-N 1 2 330.428 2.088 20 70 EEIDLO CC1=C(C(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)CCCO1 ZINC000160388866 463333004 /nfs/dbraw/zinc/33/30/04/463333004.db2.gz BWSFYTXIUJYNNH-KRWDZBQOSA-N 1 2 330.428 2.088 20 70 EEIDLO CCc1nnc(C[NH+]2CCC(n3ccc(C(F)(F)F)n3)CC2)[nH]1 ZINC000160684688 463362973 /nfs/dbraw/zinc/36/29/73/463362973.db2.gz WFSXKBCJLXIRQI-UHFFFAOYSA-N 1 2 328.342 2.420 20 70 EEIDLO COc1ccc(COCCCNC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000161237399 463412649 /nfs/dbraw/zinc/41/26/49/463412649.db2.gz VHODKWGQKNMWSA-MRXNPFEDSA-N 1 2 343.427 2.177 20 70 EEIDLO CC1=C(C(=O)N2CC[NH+](CCOc3ccccc3)CC2)CCCO1 ZINC000159504027 528071067 /nfs/dbraw/zinc/07/10/67/528071067.db2.gz KKQCGHAHHCPNIJ-UHFFFAOYSA-N 1 2 330.428 2.294 20 70 EEIDLO CCCCn1ncc(NC(=O)N[C@@H](C)[C@@H](C)[NH+]2CCOCC2)c1C ZINC000159800446 311346434 /nfs/dbraw/zinc/34/64/34/311346434.db2.gz WMABXQOGZFTHRG-UONOGXRCSA-N 1 2 337.468 2.222 20 70 EEIDLO CCCCn1ncc(NC(=O)NCC(C)(C)[NH+]2CCOCC2)c1C ZINC000159996954 311348850 /nfs/dbraw/zinc/34/88/50/311348850.db2.gz FKUSJGUPCYEUMF-UHFFFAOYSA-N 1 2 337.468 2.224 20 70 EEIDLO COC(=O)[C@H](CC(C)C)NC(=O)C[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160188872 463322267 /nfs/dbraw/zinc/32/22/67/463322267.db2.gz SGTMVGWSOMXYHP-IRXDYDNUSA-N 1 2 347.459 2.231 20 70 EEIDLO COC(=O)[C@H](CC(C)C)NC(=O)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160188872 463322272 /nfs/dbraw/zinc/32/22/72/463322272.db2.gz SGTMVGWSOMXYHP-IRXDYDNUSA-N 1 2 347.459 2.231 20 70 EEIDLO CCc1cnc(CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)s1 ZINC000160456363 463340506 /nfs/dbraw/zinc/34/05/06/463340506.db2.gz XKHTXOHNWIRHEV-UHFFFAOYSA-N 1 2 345.472 2.128 20 70 EEIDLO CC[N@H+](Cc1cn(-c2ccccc2)nc1C)[C@@H]1CCS(=O)(=O)C1 ZINC000160539477 463347799 /nfs/dbraw/zinc/34/77/99/463347799.db2.gz HLPMGNDDUUKYCS-QGZVFWFLSA-N 1 2 333.457 2.190 20 70 EEIDLO CC[N@@H+](Cc1cn(-c2ccccc2)nc1C)[C@@H]1CCS(=O)(=O)C1 ZINC000160539477 463347806 /nfs/dbraw/zinc/34/78/06/463347806.db2.gz HLPMGNDDUUKYCS-QGZVFWFLSA-N 1 2 333.457 2.190 20 70 EEIDLO CN(Cc1[nH+]ccn1C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000160680147 463362902 /nfs/dbraw/zinc/36/29/02/463362902.db2.gz ITUXGDBJUIACRZ-HZPDHXFCSA-N 1 2 328.416 2.482 20 70 EEIDLO O=C(NCCCNc1cccc[nH+]1)NCCOc1ncccc1Cl ZINC000161036581 463393930 /nfs/dbraw/zinc/39/39/30/463393930.db2.gz BMHKSAQZDBXHBW-UHFFFAOYSA-N 1 2 349.822 2.310 20 70 EEIDLO O=C(Nc1cc(F)cc(N2CCOCC2)c1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161060826 463396086 /nfs/dbraw/zinc/39/60/86/463396086.db2.gz ZUJIBGFPYLQSQL-CYBMUJFWSA-N 1 2 344.390 2.060 20 70 EEIDLO COc1ccc([NH2+][C@@H](C)CCn2cccn2)cc1-n1nnnc1C ZINC000159445913 534189292 /nfs/dbraw/zinc/18/92/92/534189292.db2.gz OCSVBTRSBGKBDX-LBPRGKRZSA-N 1 2 327.392 2.067 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)NCc1cnn(C)c1C ZINC000160077630 534681868 /nfs/dbraw/zinc/68/18/68/534681868.db2.gz IAQAPBATQMYPDV-UHFFFAOYSA-N 1 2 340.431 2.276 20 70 EEIDLO Cc1cccn2cc(CCNC(=O)NC3C[C@@H](C)O[C@H](C)C3)[nH+]c12 ZINC000159630791 539516913 /nfs/dbraw/zinc/51/69/13/539516913.db2.gz XENMQEHNYRMSLM-ZIAGYGMSSA-N 1 2 330.432 2.440 20 70 EEIDLO CC[N@H+](Cc1ccc(Oc2cnccn2)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160581699 255799367 /nfs/dbraw/zinc/79/93/67/255799367.db2.gz YFAMZMFWXVIQKA-OAHLLOKOSA-N 1 2 347.440 2.278 20 70 EEIDLO CC[N@@H+](Cc1ccc(Oc2cnccn2)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160581699 255799368 /nfs/dbraw/zinc/79/93/68/255799368.db2.gz YFAMZMFWXVIQKA-OAHLLOKOSA-N 1 2 347.440 2.278 20 70 EEIDLO C[C@H]1C[NH+](CCCCNC(=O)c2cccc3nc[nH]c32)C[C@H](C)O1 ZINC000159829067 533930370 /nfs/dbraw/zinc/93/03/70/533930370.db2.gz WQICATUOSGFUSV-KBPBESRZSA-N 1 2 330.432 2.182 20 70 EEIDLO CC(C)OC(=O)CCCNC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000160170782 527774969 /nfs/dbraw/zinc/77/49/69/527774969.db2.gz HHQDRASJKIBZNX-HUUCEWRRSA-N 1 2 336.436 2.207 20 70 EEIDLO Cn1cc[nH+]c1-c1cccc(NC(=O)N2CCC[C@@H](CC(N)=O)C2)c1 ZINC000159559291 225240492 /nfs/dbraw/zinc/24/04/92/225240492.db2.gz ZKVXADNLESZALE-ZDUSSCGKSA-N 1 2 341.415 2.206 20 70 EEIDLO CCCn1c(C)nnc1C[N@@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000160693078 311357694 /nfs/dbraw/zinc/35/76/94/311357694.db2.gz ZSIVKTKQFRUMRQ-AWEZNQCLSA-N 1 2 337.468 2.438 20 70 EEIDLO CCCn1c(C)nnc1C[N@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000160693078 311357697 /nfs/dbraw/zinc/35/76/97/311357697.db2.gz ZSIVKTKQFRUMRQ-AWEZNQCLSA-N 1 2 337.468 2.438 20 70 EEIDLO CCO[C@@H](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)C(C)C ZINC000160528151 463347259 /nfs/dbraw/zinc/34/72/59/463347259.db2.gz UIGFGGYMRDRODF-SFHVURJKSA-N 1 2 348.491 2.360 20 70 EEIDLO CCCCN(Cc1c[nH+]c2ccc(C)cn12)[C@H]1CCS(=O)(=O)C1 ZINC000160795282 463371808 /nfs/dbraw/zinc/37/18/08/463371808.db2.gz SNCPRDHUNDRXBS-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@H+](Cc1cnc2ccc(C)cn12)[C@H]1CCS(=O)(=O)C1 ZINC000160795282 463371814 /nfs/dbraw/zinc/37/18/14/463371814.db2.gz SNCPRDHUNDRXBS-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@@H+](Cc1cnc2ccc(C)cn12)[C@H]1CCS(=O)(=O)C1 ZINC000160795282 463371818 /nfs/dbraw/zinc/37/18/18/463371818.db2.gz SNCPRDHUNDRXBS-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO NC(=O)[C@H](c1cccc(Br)c1)[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000161026939 463393479 /nfs/dbraw/zinc/39/34/79/463393479.db2.gz HDMRQXRVCRQYNO-ZFWWWQNUSA-N 1 2 339.233 2.088 20 70 EEIDLO NC(=O)[C@H](c1cccc(Br)c1)[N@H+]1CC[C@]2(CCOC2)C1 ZINC000161026939 463393484 /nfs/dbraw/zinc/39/34/84/463393484.db2.gz HDMRQXRVCRQYNO-ZFWWWQNUSA-N 1 2 339.233 2.088 20 70 EEIDLO COC(=O)c1[nH]c(C)c(C(=O)NCCCNc2cccc[nH+]2)c1C ZINC000161164780 463405657 /nfs/dbraw/zinc/40/56/57/463405657.db2.gz RZDQZOVKYLEWBQ-UHFFFAOYSA-N 1 2 330.388 2.045 20 70 EEIDLO CC1(NC(=O)N[C@@H](Cc2ccccc2)C[NH+]2CCOCC2)CCC1 ZINC000161170721 463406316 /nfs/dbraw/zinc/40/63/16/463406316.db2.gz WGXXVVKFEAUIKJ-KRWDZBQOSA-N 1 2 331.460 2.172 20 70 EEIDLO CCc1ccc([C@@H](C)CC(=O)NC[C@H](C)[NH+]2CCN(C)CC2)cc1 ZINC000160158182 529704176 /nfs/dbraw/zinc/70/41/76/529704176.db2.gz UKJOPOUCHLKCSW-IRXDYDNUSA-N 1 2 331.504 2.495 20 70 EEIDLO CN(C[C@@H]1CCC[C@H]1O)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000159934803 529953159 /nfs/dbraw/zinc/95/31/59/529953159.db2.gz HKISLIHCTWGJNF-DOTOQJQBSA-N 1 2 328.416 2.175 20 70 EEIDLO NC(=O)[C@@H]1C[N@H+](CCOc2ccc(Oc3ccccc3)cc2)CCO1 ZINC000159898283 225298125 /nfs/dbraw/zinc/29/81/25/225298125.db2.gz PIPSWMIMMHPNNG-SFHVURJKSA-N 1 2 342.395 2.044 20 70 EEIDLO NC(=O)[C@@H]1C[N@@H+](CCOc2ccc(Oc3ccccc3)cc2)CCO1 ZINC000159898283 225298129 /nfs/dbraw/zinc/29/81/29/225298129.db2.gz PIPSWMIMMHPNNG-SFHVURJKSA-N 1 2 342.395 2.044 20 70 EEIDLO CCCOC(=O)[C@H](C)[NH+]1CCC(NC(=O)c2cc(C)oc2C)CC1 ZINC000160385575 463333524 /nfs/dbraw/zinc/33/35/24/463333524.db2.gz NAKVDRDNQIEQBF-ZDUSSCGKSA-N 1 2 336.432 2.432 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N[C@H](C)[C@H](C)[NH+]2CCOCC2)n1 ZINC000160486255 463343112 /nfs/dbraw/zinc/34/31/12/463343112.db2.gz PYPWTVBGEJCTCS-CABCVRRESA-N 1 2 337.468 2.160 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)Nc1cccc(Cl)c1 ZINC000161141902 463403610 /nfs/dbraw/zinc/40/36/10/463403610.db2.gz BLWUVLFPCNUAHZ-UHFFFAOYSA-N 1 2 344.846 2.491 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)NC1CCCCCCC1 ZINC000161149095 463404688 /nfs/dbraw/zinc/40/46/88/463404688.db2.gz SRRQLPVQUQGIKU-UHFFFAOYSA-N 1 2 344.503 2.428 20 70 EEIDLO CCc1nn(C)c(OC)c1C[NH2+][C@H](C(=O)NC1CC1)c1ccccc1 ZINC000159771196 529768090 /nfs/dbraw/zinc/76/80/90/529768090.db2.gz ASGJRBCCGNIUPL-KRWDZBQOSA-N 1 2 342.443 2.101 20 70 EEIDLO C[C@@H](c1cccnc1)[NH+]1CCN(C(=O)c2cccc3nc[nH]c32)CC1 ZINC000159553885 225237733 /nfs/dbraw/zinc/23/77/33/225237733.db2.gz RQNBEAPDGKASFJ-AWEZNQCLSA-N 1 2 335.411 2.477 20 70 EEIDLO Cc1[nH]nc(C(C)C)c1C(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000159579377 311343242 /nfs/dbraw/zinc/34/32/42/311343242.db2.gz KAMNCHSVUIKGQD-HNNXBMFYSA-N 1 2 336.480 2.318 20 70 EEIDLO Cc1n[nH]c(C(C)C)c1C(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000159579377 311343243 /nfs/dbraw/zinc/34/32/43/311343243.db2.gz KAMNCHSVUIKGQD-HNNXBMFYSA-N 1 2 336.480 2.318 20 70 EEIDLO CN(Cc1ccc(Cl)s1)C(=O)CSCC[NH+]1CCOCC1 ZINC000159759163 311345789 /nfs/dbraw/zinc/34/57/89/311345789.db2.gz IGVSDEQWGHGFOP-UHFFFAOYSA-N 1 2 348.921 2.425 20 70 EEIDLO Cc1ccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)cc1F ZINC000161165019 311362720 /nfs/dbraw/zinc/36/27/20/311362720.db2.gz PHQPPBLILBPKAK-UHFFFAOYSA-N 1 2 342.418 2.285 20 70 EEIDLO COc1ccc([C@H](NC(=O)[C@@H]2CCCCO2)c2[nH+]ccn2C)cc1 ZINC000160336254 463329360 /nfs/dbraw/zinc/32/93/60/463329360.db2.gz NWFORKACKWHFAC-HOTGVXAUSA-N 1 2 329.400 2.203 20 70 EEIDLO CC1=C(C(=O)NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)CCCO1 ZINC000160388742 463332934 /nfs/dbraw/zinc/33/29/34/463332934.db2.gz BWSFYTXIUJYNNH-QGZVFWFLSA-N 1 2 330.428 2.088 20 70 EEIDLO CC1=C(C(=O)NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)CCCO1 ZINC000160388742 463332939 /nfs/dbraw/zinc/33/29/39/463332939.db2.gz BWSFYTXIUJYNNH-QGZVFWFLSA-N 1 2 330.428 2.088 20 70 EEIDLO CC(C)c1ccc(N2CC(=O)C(C(=O)N3CCC[C@@H]3C[NH3+])=N2)cc1 ZINC000160394517 463335181 /nfs/dbraw/zinc/33/51/81/463335181.db2.gz VFFOFTWHDPZCPQ-OAHLLOKOSA-N 1 2 328.416 2.265 20 70 EEIDLO Cc1cccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)c1C ZINC000161143477 463404638 /nfs/dbraw/zinc/40/46/38/463404638.db2.gz UDYAOHMPUWWXNS-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO CCCCc1nc(CS(=O)(=O)Cc2[nH+]ccn2C(C)C)no1 ZINC000161221529 463411534 /nfs/dbraw/zinc/41/15/34/463411534.db2.gz BSGGPDZWPGLHFO-UHFFFAOYSA-N 1 2 326.422 2.305 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000159965472 533993669 /nfs/dbraw/zinc/99/36/69/533993669.db2.gz MVLATZXQBCWBES-LSDHHAIUSA-N 1 2 334.485 2.418 20 70 EEIDLO CCCC[N@H+](Cc1cccc(OC)c1OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160775649 528441046 /nfs/dbraw/zinc/44/10/46/528441046.db2.gz AGNNEMYIQYPCNZ-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCC[N@@H+](Cc1cccc(OC)c1OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160775649 528441053 /nfs/dbraw/zinc/44/10/53/528441053.db2.gz AGNNEMYIQYPCNZ-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CC[N@H+](CCCCS(C)(=O)=O)CC(=O)Nc1c(F)cccc1F ZINC000161123124 539524755 /nfs/dbraw/zinc/52/47/55/539524755.db2.gz FPUJXXREXLEPHI-UHFFFAOYSA-N 1 2 348.415 2.050 20 70 EEIDLO CC[N@@H+](CCCCS(C)(=O)=O)CC(=O)Nc1c(F)cccc1F ZINC000161123124 539524758 /nfs/dbraw/zinc/52/47/58/539524758.db2.gz FPUJXXREXLEPHI-UHFFFAOYSA-N 1 2 348.415 2.050 20 70 EEIDLO C[C@@H](C(=O)NC1CC1)[NH+]1CCN(C(=O)C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000161222621 539526157 /nfs/dbraw/zinc/52/61/57/539526157.db2.gz WDZQHPYHUQXLFX-HOTGVXAUSA-N 1 2 349.519 2.404 20 70 EEIDLO CC[N@H+](Cc1cc(OC)cc2c1O[C@H](C)C2)[C@@H]1CCS(=O)(=O)C1 ZINC000160534975 311355119 /nfs/dbraw/zinc/35/51/19/311355119.db2.gz VCMTVAXNYZPVER-IUODEOHRSA-N 1 2 339.457 2.028 20 70 EEIDLO CC[N@@H+](Cc1cc(OC)cc2c1O[C@H](C)C2)[C@@H]1CCS(=O)(=O)C1 ZINC000160534975 311355120 /nfs/dbraw/zinc/35/51/20/311355120.db2.gz VCMTVAXNYZPVER-IUODEOHRSA-N 1 2 339.457 2.028 20 70 EEIDLO C[C@@H](C(=O)N1CCCC1)[NH+]1CCN(C(=O)C2CCC(C)(C)CC2)CC1 ZINC000161142967 311362922 /nfs/dbraw/zinc/36/29/22/311362922.db2.gz HWLQMOQDIKLCKL-INIZCTEOSA-N 1 2 349.519 2.358 20 70 EEIDLO O=C(CCCNC(=O)c1cccnc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000160659030 463360342 /nfs/dbraw/zinc/36/03/42/463360342.db2.gz YVMOZYTYYMKCLE-UHFFFAOYSA-N 1 2 349.394 2.416 20 70 EEIDLO CCn1ccnc1CN1CCN(c2cc(C)[nH+]c(C(C)C)n2)CC1 ZINC000160723854 463366149 /nfs/dbraw/zinc/36/61/49/463366149.db2.gz FZLNXKOLTBXLEY-UHFFFAOYSA-N 1 2 328.464 2.447 20 70 EEIDLO CCOCCC1(C(=O)N2CC[NH+](Cc3cccnc3)CC2)CCC1 ZINC000160762003 463367948 /nfs/dbraw/zinc/36/79/48/463367948.db2.gz FVRYOLFYURBFOJ-UHFFFAOYSA-N 1 2 331.460 2.323 20 70 EEIDLO CCc1ccccc1C(=O)N1CCC[N@@H+](CC(=O)N(CC)CC)CC1 ZINC000160824862 463374233 /nfs/dbraw/zinc/37/42/33/463374233.db2.gz SPCLJPSRSKKEHJ-UHFFFAOYSA-N 1 2 345.487 2.265 20 70 EEIDLO CCc1ccccc1C(=O)N1CCC[N@H+](CC(=O)N(CC)CC)CC1 ZINC000160824862 463374237 /nfs/dbraw/zinc/37/42/37/463374237.db2.gz SPCLJPSRSKKEHJ-UHFFFAOYSA-N 1 2 345.487 2.265 20 70 EEIDLO C[C@H](NC(=O)CN1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000161149381 463404530 /nfs/dbraw/zinc/40/45/30/463404530.db2.gz TUJCTTOQVYVKEN-KRWDZBQOSA-N 1 2 338.455 2.077 20 70 EEIDLO O=C([C@@H]1CCn2cc[nH+]c2C1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000161242014 463412691 /nfs/dbraw/zinc/41/26/91/463412691.db2.gz WMRALINOPZXONA-CZUORRHYSA-N 1 2 347.365 2.324 20 70 EEIDLO CCc1nc(-c2ccccc2NC(=O)[C@H](C)[NH+]2CCSCC2)n[nH]1 ZINC000161251050 463413795 /nfs/dbraw/zinc/41/37/95/463413795.db2.gz ZSNWCZLXYAMHDJ-LBPRGKRZSA-N 1 2 345.472 2.410 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@H+](C)Cc2ccccc2N2CCOCC2)n1 ZINC000160588724 463352275 /nfs/dbraw/zinc/35/22/75/463352275.db2.gz DDPSMASFACVAIO-UHFFFAOYSA-N 1 2 342.443 2.213 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@@H+](C)Cc2ccccc2N2CCOCC2)n1 ZINC000160588724 463352281 /nfs/dbraw/zinc/35/22/81/463352281.db2.gz DDPSMASFACVAIO-UHFFFAOYSA-N 1 2 342.443 2.213 20 70 EEIDLO CCn1cc[nH+]c1CN1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000160756925 463368659 /nfs/dbraw/zinc/36/86/59/463368659.db2.gz ISDUXQAXQGCREA-UHFFFAOYSA-N 1 2 330.407 2.390 20 70 EEIDLO Cc1cc(N2CCN(C(=O)c3cccc(F)n3)CC2)nc(C(C)C)[nH+]1 ZINC000161163506 463405503 /nfs/dbraw/zinc/40/55/03/463405503.db2.gz BVMHHFPBYUWNST-UHFFFAOYSA-N 1 2 343.406 2.405 20 70 EEIDLO CCc1ccc(-c2noc(CS(=O)(=O)Cc3[nH+]ccn3C)n2)cc1 ZINC000161187273 463408448 /nfs/dbraw/zinc/40/84/48/463408448.db2.gz ZWXKXBXBBABQGC-UHFFFAOYSA-N 1 2 346.412 2.148 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)Cc1ccc(Br)s1 ZINC000161205873 463410576 /nfs/dbraw/zinc/41/05/76/463410576.db2.gz NBASVLSZGZIESE-UHFFFAOYSA-N 1 2 335.248 2.359 20 70 EEIDLO CC(C)([NH2+]Cc1nc(N)nc(N)n1)c1ccc(Cl)c(Cl)c1 ZINC000161450873 463430618 /nfs/dbraw/zinc/43/06/18/463430618.db2.gz XXMIFVCIEZVPDZ-UHFFFAOYSA-N 1 2 327.219 2.368 20 70 EEIDLO COc1cc2nc(N[C@H](CO)CC(C)(C)C)[nH+]c(N)c2cc1OC ZINC000161468371 463431866 /nfs/dbraw/zinc/43/18/66/463431866.db2.gz REVRZZSFQYSZIC-JTQLQIEISA-N 1 2 334.420 2.438 20 70 EEIDLO CC(=O)c1cccc(NC(=O)[C@@H](C)SCC[NH+]2CCOCC2)c1 ZINC000159974151 527368424 /nfs/dbraw/zinc/36/84/24/527368424.db2.gz ZLRJMWSXTLMWMT-CQSZACIVSA-N 1 2 336.457 2.282 20 70 EEIDLO O=C(CCC(=O)N1CC[NH+](Cc2cccs2)CC1)NC1CCCC1 ZINC000159637867 539516666 /nfs/dbraw/zinc/51/66/66/539516666.db2.gz ACAKAGKGSLZCCY-UHFFFAOYSA-N 1 2 349.500 2.231 20 70 EEIDLO COc1ccc([C@@H]2CCN(C(=O)[C@H]3CCn4cc[nH+]c4C3)C2)cc1 ZINC000161097893 255801838 /nfs/dbraw/zinc/80/18/38/255801838.db2.gz UHFMNFSSYURIAW-JKSUJKDBSA-N 1 2 325.412 2.470 20 70 EEIDLO O=C(/C=C/c1cnc2ccccc2n1)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000161267411 159722557 /nfs/dbraw/zinc/72/25/57/159722557.db2.gz TURAUUHBUHNPEH-ROJDOSBLSA-N 1 2 345.406 2.433 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCc2ccccc2C1 ZINC000159965051 225312017 /nfs/dbraw/zinc/31/20/17/225312017.db2.gz LLEHLYPLDQWXQM-HNNXBMFYSA-N 1 2 334.485 2.025 20 70 EEIDLO C[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000159995397 225316892 /nfs/dbraw/zinc/31/68/92/225316892.db2.gz GPUHJZLLHMYYGD-GOEBONIOSA-N 1 2 336.399 2.187 20 70 EEIDLO Cc1cc(C)c(C(=O)NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)[nH]1 ZINC000159673382 311344267 /nfs/dbraw/zinc/34/42/67/311344267.db2.gz LVJMHUARRZBPJM-QGZVFWFLSA-N 1 2 327.428 2.262 20 70 EEIDLO Cc1cc(C)c(C(=O)NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)[nH]1 ZINC000159673382 311344268 /nfs/dbraw/zinc/34/42/68/311344268.db2.gz LVJMHUARRZBPJM-QGZVFWFLSA-N 1 2 327.428 2.262 20 70 EEIDLO CC(C)CO[C@@H](C)c1noc(CSCC[NH+]2CCOCC2)n1 ZINC000159934156 311348097 /nfs/dbraw/zinc/34/80/97/311348097.db2.gz BNKQYHQAIWOREL-ZDUSSCGKSA-N 1 2 329.466 2.369 20 70 EEIDLO CCc1c(NC(=O)[C@H]2CCn3cc[nH+]c3C2)n[nH]c1-c1ccncc1 ZINC000160604871 311356570 /nfs/dbraw/zinc/35/65/70/311356570.db2.gz RJRGJHXCRBGGKV-ZDUSSCGKSA-N 1 2 336.399 2.432 20 70 EEIDLO CC(=O)NC1CC[NH+]([C@H](C)c2nc(Cc3ccccc3)no2)CC1 ZINC000159872720 463309616 /nfs/dbraw/zinc/30/96/16/463309616.db2.gz FUDBPCZFRCAJFE-CYBMUJFWSA-N 1 2 328.416 2.322 20 70 EEIDLO CC[N@H+](CC(=O)NC(=O)Nc1ccc(C)cc1C)Cc1cnn(C)c1 ZINC000161088633 463399021 /nfs/dbraw/zinc/39/90/21/463399021.db2.gz QHXFZXQGWRMNPW-UHFFFAOYSA-N 1 2 343.431 2.207 20 70 EEIDLO CC[N@@H+](CC(=O)NC(=O)Nc1ccc(C)cc1C)Cc1cnn(C)c1 ZINC000161088633 463399030 /nfs/dbraw/zinc/39/90/30/463399030.db2.gz QHXFZXQGWRMNPW-UHFFFAOYSA-N 1 2 343.431 2.207 20 70 EEIDLO C[C@@H](C(=O)Nc1ccc(Cl)cc1)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161193633 463409672 /nfs/dbraw/zinc/40/96/72/463409672.db2.gz LYDKRZNZUNJLKZ-JTQLQIEISA-N 1 2 341.820 2.016 20 70 EEIDLO O=C(c1ccc[nH]c1=O)N1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000161287158 463417249 /nfs/dbraw/zinc/41/72/49/463417249.db2.gz MBUXYCDVRLFSFP-UHFFFAOYSA-N 1 2 331.803 2.399 20 70 EEIDLO Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NCCCn1cc[nH+]c1 ZINC000161358217 463424153 /nfs/dbraw/zinc/42/41/53/463424153.db2.gz XPTQCFABDPUWJH-UHFFFAOYSA-N 1 2 343.353 2.008 20 70 EEIDLO COc1cc(F)c(C(=O)NCc2cn3ccccc3[nH+]2)cc1OC ZINC000161454361 463430700 /nfs/dbraw/zinc/43/07/00/463430700.db2.gz IQWRIRCIWAAYPG-UHFFFAOYSA-N 1 2 329.331 2.421 20 70 EEIDLO CS(=O)(=O)CCCC[NH+]1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000161328890 539527163 /nfs/dbraw/zinc/52/71/63/539527163.db2.gz GRZJVGXGWIBGMY-UHFFFAOYSA-N 1 2 339.457 2.112 20 70 EEIDLO Cc1cccc(CNC(=O)C[NH+]2CCC([C@H](O)C(F)(F)F)CC2)c1 ZINC000161454737 311366072 /nfs/dbraw/zinc/36/60/72/311366072.db2.gz KHPLZXIVLYBGKO-INIZCTEOSA-N 1 2 344.377 2.246 20 70 EEIDLO O=C(Cc1c[nH]c2ccccc12)N1CC[NH+](CCOCC2CC2)CC1 ZINC000159372297 463283273 /nfs/dbraw/zinc/28/32/73/463283273.db2.gz XRUKUQSTOZABRC-UHFFFAOYSA-N 1 2 341.455 2.281 20 70 EEIDLO COCC[NH+]1CCN(C(=O)c2cncc(-c3cccc(C)c3)c2)CC1 ZINC000160451328 463340552 /nfs/dbraw/zinc/34/05/52/463340552.db2.gz DEQSPBNXALOGFM-UHFFFAOYSA-N 1 2 339.439 2.461 20 70 EEIDLO COc1ccccc1N1CC[NH+](CCCS(=O)(=O)C(C)C)CC1 ZINC000160463543 463340867 /nfs/dbraw/zinc/34/08/67/463340867.db2.gz SAKMBLWRCGNKMX-UHFFFAOYSA-N 1 2 340.489 2.031 20 70 EEIDLO CCCc1nnc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)s1 ZINC000160305222 528774168 /nfs/dbraw/zinc/77/41/68/528774168.db2.gz KJVXCTJQCWYQKR-LLVKDONJSA-N 1 2 332.433 2.286 20 70 EEIDLO Cc1nccc(NC(=O)N2CCC[C@H]2C[NH+]2CCOCC2)c1Cl ZINC000160030371 539519898 /nfs/dbraw/zinc/51/98/98/539519898.db2.gz LPMYJCGFXSUFAY-ZDUSSCGKSA-N 1 2 338.839 2.372 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1 ZINC000161168897 285120524 /nfs/dbraw/zinc/12/05/24/285120524.db2.gz XHEBNNMMBXWIKO-CQSZACIVSA-N 1 2 340.427 2.290 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1 ZINC000161168897 285120527 /nfs/dbraw/zinc/12/05/27/285120527.db2.gz XHEBNNMMBXWIKO-CQSZACIVSA-N 1 2 340.427 2.290 20 70 EEIDLO CCCOC(=O)[C@@H](C)[NH+]1CCC(NC(=O)c2cc(C)oc2C)CC1 ZINC000160385453 463332706 /nfs/dbraw/zinc/33/27/06/463332706.db2.gz NAKVDRDNQIEQBF-CYBMUJFWSA-N 1 2 336.432 2.432 20 70 EEIDLO CC1=C(C(=O)NC[C@@H](c2cccs2)[NH+]2CCOCC2)CCCO1 ZINC000160391784 463334794 /nfs/dbraw/zinc/33/47/94/463334794.db2.gz GAJLFPHXBNJNAW-HNNXBMFYSA-N 1 2 336.457 2.322 20 70 EEIDLO CCOCCC1(C(=O)N2CC[NH+](Cc3ccccn3)CC2)CCC1 ZINC000160733641 463365643 /nfs/dbraw/zinc/36/56/43/463365643.db2.gz UNXIYVRQJXPIOM-UHFFFAOYSA-N 1 2 331.460 2.323 20 70 EEIDLO CCCCN(Cc1c[nH+]c2ccc(C)cn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160795119 463372183 /nfs/dbraw/zinc/37/21/83/463372183.db2.gz SNCPRDHUNDRXBS-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@H+](Cc1cnc2ccc(C)cn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160795119 463372187 /nfs/dbraw/zinc/37/21/87/463372187.db2.gz SNCPRDHUNDRXBS-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@@H+](Cc1cnc2ccc(C)cn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160795119 463372194 /nfs/dbraw/zinc/37/21/94/463372194.db2.gz SNCPRDHUNDRXBS-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO C[C@H]1CCC[N@H+](Cc2csc(NC(=O)c3cccc(=O)n3C)n2)C1 ZINC000160820372 463374054 /nfs/dbraw/zinc/37/40/54/463374054.db2.gz CCWOZAHXCJGQJJ-LBPRGKRZSA-N 1 2 346.456 2.326 20 70 EEIDLO C[C@H]1CCC[N@@H+](Cc2csc(NC(=O)c3cccc(=O)n3C)n2)C1 ZINC000160820372 463374056 /nfs/dbraw/zinc/37/40/56/463374056.db2.gz CCWOZAHXCJGQJJ-LBPRGKRZSA-N 1 2 346.456 2.326 20 70 EEIDLO Cc1c(/C=C/C(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)cnn1C ZINC000161101944 463400277 /nfs/dbraw/zinc/40/02/77/463400277.db2.gz IHOWVIPPWBSMHC-GQCTYLIASA-N 1 2 339.374 2.383 20 70 EEIDLO Cc1cc(OCC(=O)N(C)CC[NH+]2CCOCC2)cc(C)c1Cl ZINC000161246356 463413202 /nfs/dbraw/zinc/41/32/02/463413202.db2.gz YMLXTRDIPABBIY-UHFFFAOYSA-N 1 2 340.851 2.126 20 70 EEIDLO COc1ccc(NC(=O)[C@H](C(C)C)[NH+]2C[C@H](C)O[C@@H](C)C2)cc1N ZINC000161278756 463415811 /nfs/dbraw/zinc/41/58/11/463415811.db2.gz DJUAJVQJMIRKKM-DCGLDWPTSA-N 1 2 335.448 2.350 20 70 EEIDLO CC(=O)Nc1cc(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)ccc1C ZINC000161301472 539526125 /nfs/dbraw/zinc/52/61/25/539526125.db2.gz YRKHCWPAJRRXGI-MRXNPFEDSA-N 1 2 338.411 2.357 20 70 EEIDLO C[C@@H](NC(=O)[C@H](C)SCC[NH+]1CCOCC1)c1ccc(F)cc1 ZINC000159760518 225273033 /nfs/dbraw/zinc/27/30/33/225273033.db2.gz BSEBUSGMAPPYLT-KGLIPLIRSA-N 1 2 340.464 2.457 20 70 EEIDLO COc1cc(C[NH+]2CCN(C(=O)[C@@H]3CC3(C)C)CC2)cc(OC)c1 ZINC000160205692 225361973 /nfs/dbraw/zinc/36/19/73/225361973.db2.gz QLHDKUWCHNYETP-KRWDZBQOSA-N 1 2 332.444 2.394 20 70 EEIDLO CC(C)[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCC[C@H](C)C1 ZINC000159957479 311348341 /nfs/dbraw/zinc/34/83/41/311348341.db2.gz QKWJMMXSENJMPF-JKSUJKDBSA-N 1 2 328.522 2.335 20 70 EEIDLO CC(C)S(=O)(=O)CCC[N@@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000160970988 311360392 /nfs/dbraw/zinc/36/03/92/311360392.db2.gz VWMJUAOKBWNCDA-CQSZACIVSA-N 1 2 348.509 2.189 20 70 EEIDLO CC(C)S(=O)(=O)CCC[N@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000160970988 311360394 /nfs/dbraw/zinc/36/03/94/311360394.db2.gz VWMJUAOKBWNCDA-CQSZACIVSA-N 1 2 348.509 2.189 20 70 EEIDLO Cc1nc(CN2CC[NH+](CCC(=O)c3ccc(C)cc3)CC2)no1 ZINC000160558799 463350605 /nfs/dbraw/zinc/35/06/05/463350605.db2.gz VDKQFZHUZSFSBY-UHFFFAOYSA-N 1 2 328.416 2.077 20 70 EEIDLO CC(C)(CO)[C@H](CNC(=O)NCCCn1cc[nH+]c1)c1ccccc1 ZINC000160968621 463386397 /nfs/dbraw/zinc/38/63/97/463386397.db2.gz DUBJSVGGVXECAC-QGZVFWFLSA-N 1 2 344.459 2.375 20 70 EEIDLO O=C(NCc1ccc(N2CCCC2)[nH+]c1)NOCc1cccnc1 ZINC000161061344 463396627 /nfs/dbraw/zinc/39/66/27/463396627.db2.gz SULBPFMJSWATMJ-UHFFFAOYSA-N 1 2 327.388 2.008 20 70 EEIDLO C[C@@H](O)C[C@H]1CCCN1C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161395950 463427632 /nfs/dbraw/zinc/42/76/32/463427632.db2.gz ULINGZDWNKVKJS-NVXWUHKLSA-N 1 2 347.459 2.286 20 70 EEIDLO CC(C)(CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccc2c(c1)OCO2 ZINC000161004556 539524251 /nfs/dbraw/zinc/52/42/51/539524251.db2.gz ZOQWGPJUHCTXCK-CYBMUJFWSA-N 1 2 341.411 2.268 20 70 EEIDLO COC(=O)CCCNC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000159485687 533387253 /nfs/dbraw/zinc/38/72/53/533387253.db2.gz FULDOKJXYUAYFR-ZDUSSCGKSA-N 1 2 339.461 2.090 20 70 EEIDLO O=C(c1cccc2nc[nH]c21)N1CC[NH+](Cc2cccc(O)c2)CC1 ZINC000159815943 225282634 /nfs/dbraw/zinc/28/26/34/225282634.db2.gz VSYJUQBBEQSSNR-UHFFFAOYSA-N 1 2 336.395 2.227 20 70 EEIDLO COCC(C)(C)C(=O)N1CC[NH+](Cc2ccc(OC)c(F)c2)CC1 ZINC000159640058 225254048 /nfs/dbraw/zinc/25/40/48/225254048.db2.gz MNBPSJPCCOIHRZ-UHFFFAOYSA-N 1 2 338.423 2.151 20 70 EEIDLO CC[N@H+](Cc1cnn(-c2ccc(F)cc2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160586130 311356172 /nfs/dbraw/zinc/35/61/72/311356172.db2.gz AJFWFFWHHUHLNH-MRXNPFEDSA-N 1 2 337.420 2.020 20 70 EEIDLO CC[N@@H+](Cc1cnn(-c2ccc(F)cc2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160586130 311356174 /nfs/dbraw/zinc/35/61/74/311356174.db2.gz AJFWFFWHHUHLNH-MRXNPFEDSA-N 1 2 337.420 2.020 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccccc1C(C)=O ZINC000161105824 311362241 /nfs/dbraw/zinc/36/22/41/311362241.db2.gz YDTOZTCBLXHKNU-ZDUSSCGKSA-N 1 2 328.416 2.472 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccccc1C(C)=O ZINC000161105824 311362243 /nfs/dbraw/zinc/36/22/43/311362243.db2.gz YDTOZTCBLXHKNU-ZDUSSCGKSA-N 1 2 328.416 2.472 20 70 EEIDLO CN(Cc1ccco1)C(=O)C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159591777 463293549 /nfs/dbraw/zinc/29/35/49/463293549.db2.gz NSIITTLIPCWRNM-HXUWFJFHSA-N 1 2 340.423 2.412 20 70 EEIDLO CN(Cc1ccco1)C(=O)C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159591777 463293552 /nfs/dbraw/zinc/29/35/52/463293552.db2.gz NSIITTLIPCWRNM-HXUWFJFHSA-N 1 2 340.423 2.412 20 70 EEIDLO O=C(NCCCNc1cccc[nH+]1)Nc1ccn(CC(F)(F)F)n1 ZINC000160647732 463359192 /nfs/dbraw/zinc/35/91/92/463359192.db2.gz DJGYBTGJRMNYQV-UHFFFAOYSA-N 1 2 342.325 2.464 20 70 EEIDLO CC[C@@H](O)CN(Cc1ccccc1)C(=O)NCCCn1cc[nH+]c1 ZINC000161086486 463398933 /nfs/dbraw/zinc/39/89/33/463398933.db2.gz CIXRFBQNQSUEPF-QGZVFWFLSA-N 1 2 330.432 2.256 20 70 EEIDLO C[C@H](C(=O)NCC1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161180930 463407461 /nfs/dbraw/zinc/40/74/61/463407461.db2.gz GYHIUWOXQLPFOV-QGZVFWFLSA-N 1 2 344.503 2.284 20 70 EEIDLO C[C@H](C(=O)NCC1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161180930 463407463 /nfs/dbraw/zinc/40/74/63/463407463.db2.gz GYHIUWOXQLPFOV-QGZVFWFLSA-N 1 2 344.503 2.284 20 70 EEIDLO COC(=O)c1cc(C[N@@H+]2CCc3cc(OC)c(OC)cc3C2)c[nH]1 ZINC000159780143 533802970 /nfs/dbraw/zinc/80/29/70/533802970.db2.gz KVDULSHHBNTLRO-UHFFFAOYSA-N 1 2 330.384 2.377 20 70 EEIDLO COC(=O)c1cc(C[N@H+]2CCc3cc(OC)c(OC)cc3C2)c[nH]1 ZINC000159780143 533802981 /nfs/dbraw/zinc/80/29/81/533802981.db2.gz KVDULSHHBNTLRO-UHFFFAOYSA-N 1 2 330.384 2.377 20 70 EEIDLO CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)[nH+]c2)CCO1 ZINC000159536236 527777735 /nfs/dbraw/zinc/77/77/35/527777735.db2.gz DVNXOFAALRXRBV-MRXNPFEDSA-N 1 2 332.448 2.392 20 70 EEIDLO CCN(CC)c1ccc(CNC(=O)/C=C/c2cnn(C)c2C)c[nH+]1 ZINC000159777366 528298726 /nfs/dbraw/zinc/29/87/26/528298726.db2.gz DGSAVZFOFRISFT-CSKARUKUSA-N 1 2 327.432 2.299 20 70 EEIDLO Cc1c(CNC(=O)NCc2cc[nH+]c(N3CCCCC3)c2)cnn1C ZINC000159890665 225297233 /nfs/dbraw/zinc/29/72/33/225297233.db2.gz JJGYYMXFDQBIDC-UHFFFAOYSA-N 1 2 342.447 2.113 20 70 EEIDLO CO[C@@H]1CCC[C@H]1NC(=O)NCCc1[nH+]ccn1Cc1ccccc1 ZINC000159901382 311348046 /nfs/dbraw/zinc/34/80/46/311348046.db2.gz NNAMDVIXDKYNCV-IAGOWNOFSA-N 1 2 342.443 2.341 20 70 EEIDLO Cc1ccc(C[N@H+](C)Cc2cnn([C@@]3(C)CCS(=O)(=O)C3)c2)cc1 ZINC000160639458 311356842 /nfs/dbraw/zinc/35/68/42/311356842.db2.gz VINHNORRMBERBE-SFHVURJKSA-N 1 2 347.484 2.357 20 70 EEIDLO Cc1ccc(C[N@@H+](C)Cc2cnn([C@@]3(C)CCS(=O)(=O)C3)c2)cc1 ZINC000160639458 311356846 /nfs/dbraw/zinc/35/68/46/311356846.db2.gz VINHNORRMBERBE-SFHVURJKSA-N 1 2 347.484 2.357 20 70 EEIDLO CC[N@H+](CC(=O)N1CCSc2ccccc21)Cc1cnn(C)c1 ZINC000161093481 311362197 /nfs/dbraw/zinc/36/21/97/311362197.db2.gz UEBYGCABOFTOCG-UHFFFAOYSA-N 1 2 330.457 2.381 20 70 EEIDLO CC[N@@H+](CC(=O)N1CCSc2ccccc21)Cc1cnn(C)c1 ZINC000161093481 311362199 /nfs/dbraw/zinc/36/21/99/311362199.db2.gz UEBYGCABOFTOCG-UHFFFAOYSA-N 1 2 330.457 2.381 20 70 EEIDLO CCOCCCNC(=O)[C@@H](C)[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159407331 463284702 /nfs/dbraw/zinc/28/47/02/463284702.db2.gz SISWDBRDTJWPIR-OXQOHEQNSA-N 1 2 346.471 2.092 20 70 EEIDLO CCOCCCNC(=O)[C@@H](C)[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159407331 463284707 /nfs/dbraw/zinc/28/47/07/463284707.db2.gz SISWDBRDTJWPIR-OXQOHEQNSA-N 1 2 346.471 2.092 20 70 EEIDLO COCCOc1cc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)ccc1OC ZINC000159719310 463301364 /nfs/dbraw/zinc/30/13/64/463301364.db2.gz ZUHXJHVDRBRCDR-ZDUSSCGKSA-N 1 2 345.399 2.118 20 70 EEIDLO COc1ccccc1-c1nnc(CSCC[NH+]2CCOCC2)o1 ZINC000159809417 463306166 /nfs/dbraw/zinc/30/61/66/463306166.db2.gz YDNZMPBJZZKPQF-UHFFFAOYSA-N 1 2 335.429 2.311 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000160483738 463342541 /nfs/dbraw/zinc/34/25/41/463342541.db2.gz FAQLUTJIPDAXND-RTBURBONSA-N 1 2 345.487 2.371 20 70 EEIDLO O=C(CNC(=O)[C@H]1CCn2cc[nH+]c2C1)Nc1cccc2ccccc21 ZINC000161120084 463401106 /nfs/dbraw/zinc/40/11/06/463401106.db2.gz PLRJIBJOWJTZSF-HNNXBMFYSA-N 1 2 348.406 2.354 20 70 EEIDLO C[C@@H](NC(=O)CN1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000161149503 463404480 /nfs/dbraw/zinc/40/44/80/463404480.db2.gz TUJCTTOQVYVKEN-QGZVFWFLSA-N 1 2 338.455 2.077 20 70 EEIDLO COC(=O)N(C)c1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160437749 159711668 /nfs/dbraw/zinc/71/16/68/159711668.db2.gz ZFOLRWDWUGGXQD-LBPRGKRZSA-N 1 2 328.372 2.287 20 70 EEIDLO COc1ccc(-c2cc(C(=O)N(C)[C@H]3CCC[N@H+](C)C3)n[nH]2)cc1 ZINC000159919911 225301668 /nfs/dbraw/zinc/30/16/68/225301668.db2.gz BCHJEVRRVCINNV-AWEZNQCLSA-N 1 2 328.416 2.252 20 70 EEIDLO COc1ccc(-c2cc(C(=O)N(C)[C@H]3CCC[N@@H+](C)C3)n[nH]2)cc1 ZINC000159919911 225301674 /nfs/dbraw/zinc/30/16/74/225301674.db2.gz BCHJEVRRVCINNV-AWEZNQCLSA-N 1 2 328.416 2.252 20 70 EEIDLO O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000159682844 225259974 /nfs/dbraw/zinc/25/99/74/225259974.db2.gz FUPSFEDHWSPOQK-CYBMUJFWSA-N 1 2 326.356 2.211 20 70 EEIDLO COCCC1(CNC(=O)N2CCc3c([nH+]c(C(C)C)n3C)C2)CC1 ZINC000161075344 463397369 /nfs/dbraw/zinc/39/73/69/463397369.db2.gz GQFWOVVKSQCZPJ-UHFFFAOYSA-N 1 2 334.464 2.428 20 70 EEIDLO Cc1ccc(C(=O)N[C@@H](C)C[NH+]2CCOCC2)c(Br)c1 ZINC000161105837 463399894 /nfs/dbraw/zinc/39/98/94/463399894.db2.gz PSDUCYYPWRORII-LBPRGKRZSA-N 1 2 341.249 2.208 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCNC(=O)N[C@@H](CCO)C(C)(C)C ZINC000161450444 463430866 /nfs/dbraw/zinc/43/08/66/463430866.db2.gz LQOWNQDSSXUCBY-INIZCTEOSA-N 1 2 332.448 2.441 20 70 EEIDLO COc1ccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc1OC ZINC000159916935 534139761 /nfs/dbraw/zinc/13/97/61/534139761.db2.gz DMNJQBJUXIFVFF-AWEZNQCLSA-N 1 2 342.399 2.499 20 70 EEIDLO CCOc1ccccc1NC(=O)[C@@H](C)SCC[NH+]1CCOCC1 ZINC000159832462 225286114 /nfs/dbraw/zinc/28/61/14/225286114.db2.gz OIGBOWAHXQZSEP-CQSZACIVSA-N 1 2 338.473 2.478 20 70 EEIDLO O=C(NCCCn1cc[nH+]c1)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000160293486 225381013 /nfs/dbraw/zinc/38/10/13/225381013.db2.gz XBIXJDGNIYLQLJ-MRXNPFEDSA-N 1 2 330.388 2.263 20 70 EEIDLO CCc1c(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)n[nH]c1-c1ccncc1 ZINC000160604762 311356694 /nfs/dbraw/zinc/35/66/94/311356694.db2.gz RJRGJHXCRBGGKV-CYBMUJFWSA-N 1 2 336.399 2.432 20 70 EEIDLO O=C([C@@H]1CCCO1)N1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1 ZINC000160966015 311360411 /nfs/dbraw/zinc/36/04/11/311360411.db2.gz PALGURQTOGDEGI-KRWDZBQOSA-N 1 2 332.375 2.395 20 70 EEIDLO CCC(=O)N1CCC[N@@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)CC1 ZINC000159469006 463288350 /nfs/dbraw/zinc/28/83/50/463288350.db2.gz GTWKNFQBRKCSLP-QGZVFWFLSA-N 1 2 329.444 2.045 20 70 EEIDLO CCC(=O)N1CCC[N@H+]([C@@H]2CCN(c3ccc(C)cc3)C2=O)CC1 ZINC000159469006 463288354 /nfs/dbraw/zinc/28/83/54/463288354.db2.gz GTWKNFQBRKCSLP-QGZVFWFLSA-N 1 2 329.444 2.045 20 70 EEIDLO CN(CCCCNC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000160358898 463331196 /nfs/dbraw/zinc/33/11/96/463331196.db2.gz SEIQBPNFMCSJLH-MRXNPFEDSA-N 1 2 326.444 2.478 20 70 EEIDLO CC(C)c1ccc(S(=O)(=O)NC[C@@H](C)C[NH+]2CCOCC2)cc1 ZINC000160382252 463332781 /nfs/dbraw/zinc/33/27/81/463332781.db2.gz CNFUJWBCUKOGQU-OAHLLOKOSA-N 1 2 340.489 2.057 20 70 EEIDLO CN(CCC(=O)OC(C)(C)C)C(=O)NCCCNc1cccc[nH+]1 ZINC000160680540 463362285 /nfs/dbraw/zinc/36/22/85/463362285.db2.gz YHRUVPCDUCNWDP-UHFFFAOYSA-N 1 2 336.436 2.257 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N2C[C@H](C)[C@H]([NH+]3CCOCC3)C2)n1 ZINC000160979178 463386935 /nfs/dbraw/zinc/38/69/35/463386935.db2.gz DVTJUDVDKHBTGI-JKSUJKDBSA-N 1 2 349.479 2.114 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@@H+]2CCC[C@H](NC(=O)OC(C)(C)C)C2)n1 ZINC000160971486 463387688 /nfs/dbraw/zinc/38/76/88/463387688.db2.gz RYMYKQMAJYCUOJ-ZDUSSCGKSA-N 1 2 336.436 2.234 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@H+]2CCC[C@H](NC(=O)OC(C)(C)C)C2)n1 ZINC000160971486 463387694 /nfs/dbraw/zinc/38/76/94/463387694.db2.gz RYMYKQMAJYCUOJ-ZDUSSCGKSA-N 1 2 336.436 2.234 20 70 EEIDLO CCCCC[C@@H](C)NC(=O)CN1CC[NH+](Cc2ccncc2)CC1 ZINC000161230487 463412024 /nfs/dbraw/zinc/41/20/24/463412024.db2.gz CWHYCIJBPXCMKN-QGZVFWFLSA-N 1 2 332.492 2.284 20 70 EEIDLO COc1cc(F)c(C(=O)N2CCN(c3cccc[nH+]3)CC2)cc1OC ZINC000161253498 463413424 /nfs/dbraw/zinc/41/34/24/463413424.db2.gz HHIZKPAJWIQESA-UHFFFAOYSA-N 1 2 345.374 2.200 20 70 EEIDLO C[C@H](C(=O)NC1CC1)[NH+]1CCN(C(=O)C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000161222746 539525645 /nfs/dbraw/zinc/52/56/45/539525645.db2.gz WDZQHPYHUQXLFX-CVEARBPZSA-N 1 2 349.519 2.404 20 70 EEIDLO Cc1cc(S(=O)(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc(C)c1F ZINC000159380288 206242767 /nfs/dbraw/zinc/24/27/67/206242767.db2.gz QDKZWWCVTXGOIU-CQSZACIVSA-N 1 2 349.431 2.395 20 70 EEIDLO Cc1ccccc1CN(C)C(=O)[C@@H](C)SCC[NH+]1CCOCC1 ZINC000159980367 206273421 /nfs/dbraw/zinc/27/34/21/206273421.db2.gz GDTYNURCVRSISD-MRXNPFEDSA-N 1 2 336.501 2.407 20 70 EEIDLO O=C(NCc1cc[nH+]c(N2CCCC2)c1)NOCc1cccnc1 ZINC000161046218 206325067 /nfs/dbraw/zinc/32/50/67/206325067.db2.gz NIWUBFWXUPPTLD-UHFFFAOYSA-N 1 2 327.388 2.008 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@@H]1CCC(=O)C[C@H]1C ZINC000160587122 206305098 /nfs/dbraw/zinc/30/50/98/206305098.db2.gz IIQIRPRQOQCOTO-IUODEOHRSA-N 1 2 331.416 2.170 20 70 EEIDLO Cn1nc(Br)c2c1nc[nH+]c2N[C@@H](CO)CC(C)(C)C ZINC000161411873 206346558 /nfs/dbraw/zinc/34/65/58/206346558.db2.gz CCYROGLDDXMCTA-MRVPVSSYSA-N 1 2 342.241 2.335 20 70 EEIDLO O=C1[C@@H]([N@@H+]2CCOC3(CCOCC3)C2)CCCN1c1ccccc1F ZINC000161438011 206347859 /nfs/dbraw/zinc/34/78/59/206347859.db2.gz GOIZIMDMBZCUIO-KRWDZBQOSA-N 1 2 348.418 2.203 20 70 EEIDLO O=C1[C@@H]([N@H+]2CCOC3(CCOCC3)C2)CCCN1c1ccccc1F ZINC000161438011 206347865 /nfs/dbraw/zinc/34/78/65/206347865.db2.gz GOIZIMDMBZCUIO-KRWDZBQOSA-N 1 2 348.418 2.203 20 70 EEIDLO Cc1ccccc1CNC(=O)C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161480510 311366477 /nfs/dbraw/zinc/36/64/77/311366477.db2.gz KHPACTYYDLGKQL-INIZCTEOSA-N 1 2 344.377 2.246 20 70 EEIDLO O=C(NCC1(C2CC2)CCC1)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160899991 463380259 /nfs/dbraw/zinc/38/02/59/463380259.db2.gz ZGMDXGDPEAPMRQ-UHFFFAOYSA-N 1 2 328.460 2.489 20 70 EEIDLO COc1cc(CCC(=O)NC[C@@H](C)[NH+]2CCOCC2)ccc1Cl ZINC000161199145 463409373 /nfs/dbraw/zinc/40/93/73/463409373.db2.gz YIRQVUDJVVNIKA-CYBMUJFWSA-N 1 2 340.851 2.118 20 70 EEIDLO COCc1nc2n(n1)C[C@H](Nc1ccc3cc(OC)ccc3[nH+]1)CC2 ZINC000161338527 539527254 /nfs/dbraw/zinc/52/72/54/539527254.db2.gz ROHDAWZWBBSSCA-CYBMUJFWSA-N 1 2 339.399 2.408 20 70 EEIDLO COCCC[N@H+](C)[C@@H](C(N)=O)c1ccc(Br)cc1F ZINC000159688015 206258736 /nfs/dbraw/zinc/25/87/36/206258736.db2.gz DYRKHJVXILGJEG-GFCCVEGCSA-N 1 2 333.201 2.083 20 70 EEIDLO COCCC[N@@H+](C)[C@@H](C(N)=O)c1ccc(Br)cc1F ZINC000159688015 206258740 /nfs/dbraw/zinc/25/87/40/206258740.db2.gz DYRKHJVXILGJEG-GFCCVEGCSA-N 1 2 333.201 2.083 20 70 EEIDLO CO[C@@]1(C)C[C@@H](NC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1(C)C ZINC000160518172 206302322 /nfs/dbraw/zinc/30/23/22/206302322.db2.gz SVGKPVKNNPOOEO-APWZRJJASA-N 1 2 346.475 2.112 20 70 EEIDLO C[C@@H]1OCCN(C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)[C@H]1C ZINC000161047430 206325047 /nfs/dbraw/zinc/32/50/47/206325047.db2.gz FGEBRAQPYFZZRF-GJZGRUSLSA-N 1 2 332.448 2.391 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)Nc1ccc(F)cc1F ZINC000161146761 206330653 /nfs/dbraw/zinc/33/06/53/206330653.db2.gz XSUPGJWYGIVTOT-UHFFFAOYSA-N 1 2 346.381 2.116 20 70 EEIDLO O=C(c1cc(Cl)cc(C(F)(F)F)c1)N1CC[NH+](CCO)CC1 ZINC000160616262 206305604 /nfs/dbraw/zinc/30/56/04/206305604.db2.gz WNFXUYKHNKPISD-UHFFFAOYSA-N 1 2 336.741 2.109 20 70 EEIDLO CCCn1c(C)nnc1C[N@@H+]1CCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000159836014 311347128 /nfs/dbraw/zinc/34/71/28/311347128.db2.gz SDAKGCGRMNKUJL-CQSZACIVSA-N 1 2 337.468 2.486 20 70 EEIDLO CCCn1c(C)nnc1C[N@H+]1CCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000159836014 311347130 /nfs/dbraw/zinc/34/71/30/311347130.db2.gz SDAKGCGRMNKUJL-CQSZACIVSA-N 1 2 337.468 2.486 20 70 EEIDLO CCOC(=O)C[C@@H](C)NC(=O)/C=C/c1ccc(-n2cc[nH+]c2)cc1 ZINC000160091372 311350201 /nfs/dbraw/zinc/35/02/01/311350201.db2.gz MYUWFDSVGQPQKW-VIIAAUOXSA-N 1 2 327.384 2.343 20 70 EEIDLO Cn1cnnc1CN1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1 ZINC000160701613 311357880 /nfs/dbraw/zinc/35/78/80/311357880.db2.gz OWGBGDCJPWMOMD-UHFFFAOYSA-N 1 2 339.365 2.152 20 70 EEIDLO CCCCn1ncc(C(=O)N2CC[NH+](Cc3ccccn3)CC2)c1C ZINC000161113435 311362442 /nfs/dbraw/zinc/36/24/42/311362442.db2.gz ITMIXPPOBKQEHD-UHFFFAOYSA-N 1 2 341.459 2.345 20 70 EEIDLO CCOCc1ccc(CNC(=O)C[N@H+](CC)Cc2cnn(C)c2)cc1 ZINC000161127947 463402041 /nfs/dbraw/zinc/40/20/41/463402041.db2.gz HFSFEOKASQWTBQ-UHFFFAOYSA-N 1 2 344.459 2.095 20 70 EEIDLO CCOCc1ccc(CNC(=O)C[N@@H+](CC)Cc2cnn(C)c2)cc1 ZINC000161127947 463402043 /nfs/dbraw/zinc/40/20/43/463402043.db2.gz HFSFEOKASQWTBQ-UHFFFAOYSA-N 1 2 344.459 2.095 20 70 EEIDLO C[N@H+](CCCCS(C)(=O)=O)CC(=O)Nc1cccc(Cl)c1 ZINC000161429020 539528446 /nfs/dbraw/zinc/52/84/46/539528446.db2.gz SIHUIKZBDQHVQJ-UHFFFAOYSA-N 1 2 332.853 2.035 20 70 EEIDLO C[N@@H+](CCCCS(C)(=O)=O)CC(=O)Nc1cccc(Cl)c1 ZINC000161429020 539528451 /nfs/dbraw/zinc/52/84/51/539528451.db2.gz SIHUIKZBDQHVQJ-UHFFFAOYSA-N 1 2 332.853 2.035 20 70 EEIDLO CC(C)c1[nH+]c2c(n1C)CCN(c1nc(C(C)C)nc(N(C)C)n1)C2 ZINC000159565511 206250756 /nfs/dbraw/zinc/25/07/56/206250756.db2.gz VPFQBOHHHXNVQU-UHFFFAOYSA-N 1 2 343.479 2.481 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000159760140 206261778 /nfs/dbraw/zinc/26/17/78/206261778.db2.gz BSEBUSGMAPPYLT-UONOGXRCSA-N 1 2 340.464 2.457 20 70 EEIDLO C[C@@H](NC(=O)c1cccc2nc[nH]c21)C1([NH+]2CCOCC2)CCCC1 ZINC000159703261 287001487 /nfs/dbraw/zinc/00/14/87/287001487.db2.gz XXBVBWJHQOHECX-CQSZACIVSA-N 1 2 342.443 2.326 20 70 EEIDLO C[C@]1(O)CCCN(C(=O)NCCc2[nH+]ccn2Cc2ccccc2)C1 ZINC000160131229 311350475 /nfs/dbraw/zinc/35/04/75/311350475.db2.gz PAZARABQYQPLJU-IBGZPJMESA-N 1 2 342.443 2.030 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000161114354 311362289 /nfs/dbraw/zinc/36/22/89/311362289.db2.gz CNTSDLRVTRKMPB-ZDUSSCGKSA-N 1 2 346.431 2.286 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000161114354 311362290 /nfs/dbraw/zinc/36/22/90/311362290.db2.gz CNTSDLRVTRKMPB-ZDUSSCGKSA-N 1 2 346.431 2.286 20 70 EEIDLO CCOC(=O)CCCNC(=O)NCCNc1ccc2ccccc2[nH+]1 ZINC000161156341 311362853 /nfs/dbraw/zinc/36/28/53/311362853.db2.gz XAGWSAZTCCVILP-UHFFFAOYSA-N 1 2 344.415 2.289 20 70 EEIDLO CCOCCC1(CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1 ZINC000160895312 463380238 /nfs/dbraw/zinc/38/02/38/463380238.db2.gz YLIAEXIVKWIRGC-UHFFFAOYSA-N 1 2 346.475 2.116 20 70 EEIDLO Cc1nccc(NC(=O)N[C@@H](C)[C@H](C)[NH+]2CCOCC2)c1Cl ZINC000159726477 539517730 /nfs/dbraw/zinc/51/77/30/539517730.db2.gz HIOQUWQGDBWFRA-JQWIXIFHSA-N 1 2 326.828 2.274 20 70 EEIDLO CC[C@H](C)OCC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCOCC1 ZINC000159756660 206262400 /nfs/dbraw/zinc/26/24/00/206262400.db2.gz PDZDWKINKGTZBW-FUHWJXTLSA-N 1 2 334.460 2.300 20 70 EEIDLO Cc1cccc(C)c1NC(=O)C[N@@H+](C)Cc1cnc(N(C)C)nc1 ZINC000160931146 206319251 /nfs/dbraw/zinc/31/92/51/206319251.db2.gz YLRKQNRJEFTQGM-UHFFFAOYSA-N 1 2 327.432 2.230 20 70 EEIDLO Cc1cccc(C)c1NC(=O)C[N@H+](C)Cc1cnc(N(C)C)nc1 ZINC000160931146 206319256 /nfs/dbraw/zinc/31/92/56/206319256.db2.gz YLRKQNRJEFTQGM-UHFFFAOYSA-N 1 2 327.432 2.230 20 70 EEIDLO C[C@@H](O)C[C@@H]1CCCN1C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161395659 206346466 /nfs/dbraw/zinc/34/64/66/206346466.db2.gz ULINGZDWNKVKJS-WBVHZDCISA-N 1 2 347.459 2.286 20 70 EEIDLO CC(=O)NC1CC[NH+]([C@@H]2CCCN(c3ccccc3Cl)C2=O)CC1 ZINC000159871380 278090069 /nfs/dbraw/zinc/09/00/69/278090069.db2.gz LHKLAQQKESMNNJ-QGZVFWFLSA-N 1 2 349.862 2.436 20 70 EEIDLO Cn1cnnc1C[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000160802738 311358869 /nfs/dbraw/zinc/35/88/69/311358869.db2.gz VGNXQRVSDVKOJK-UHFFFAOYSA-N 1 2 349.822 2.025 20 70 EEIDLO CN(Cc1ccccc1)C(=O)C[NH+]1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000161313347 311364627 /nfs/dbraw/zinc/36/46/27/311364627.db2.gz LWBQQZKPQWYZAO-MRXNPFEDSA-N 1 2 344.377 2.280 20 70 EEIDLO CN(Cc1ccccc1)C(=O)C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161313223 311364707 /nfs/dbraw/zinc/36/47/07/311364707.db2.gz LWBQQZKPQWYZAO-INIZCTEOSA-N 1 2 344.377 2.280 20 70 EEIDLO CCc1ccc(S(=O)(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000159381741 463282721 /nfs/dbraw/zinc/28/27/21/463282721.db2.gz KQESWBXXDHKZLP-OAHLLOKOSA-N 1 2 331.441 2.201 20 70 EEIDLO CN(CC(C)(C)C[NH+]1CCOCC1)S(=O)(=O)CCC(C)(C)C ZINC000159432782 463286475 /nfs/dbraw/zinc/28/64/75/463286475.db2.gz AXAWCZMTFAKJBI-UHFFFAOYSA-N 1 2 334.526 2.043 20 70 EEIDLO COc1ccc2nc(C)cc(C(=O)NC[C@H](C)[NH+]3CCOCC3)c2c1 ZINC000160209581 463323373 /nfs/dbraw/zinc/32/33/73/463323373.db2.gz PEAMBKBEQOXYMY-AWEZNQCLSA-N 1 2 343.427 2.002 20 70 EEIDLO COc1ccc([C@@H](NC(=O)[C@H]2CCCCO2)c2[nH+]ccn2C)cc1 ZINC000160336381 463329997 /nfs/dbraw/zinc/32/99/97/463329997.db2.gz NWFORKACKWHFAC-HZPDHXFCSA-N 1 2 329.400 2.203 20 70 EEIDLO COC(=O)N(C)c1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160437611 463338471 /nfs/dbraw/zinc/33/84/71/463338471.db2.gz ZFOLRWDWUGGXQD-GFCCVEGCSA-N 1 2 328.372 2.287 20 70 EEIDLO O=C(Nc1ccc(-n2cccn2)nc1)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000160777147 463370793 /nfs/dbraw/zinc/37/07/93/463370793.db2.gz QYWJLFCQXUINNP-OAHLLOKOSA-N 1 2 349.398 2.063 20 70 EEIDLO Cc1ccc(C[NH+]2CCN(CC(=O)NC3CCC(C)CC3)CC2)nc1 ZINC000161070418 463397400 /nfs/dbraw/zinc/39/74/00/463397400.db2.gz FBNQBEOWJBCPIA-UHFFFAOYSA-N 1 2 344.503 2.203 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(F)cc1F ZINC000159973217 206273752 /nfs/dbraw/zinc/27/37/52/206273752.db2.gz ASDFSFSWEMJNAE-NSHDSACASA-N 1 2 330.400 2.357 20 70 EEIDLO CCc1ccccc1C(=O)N1CCC[N@H+](CC(=O)N2CCCC2)CC1 ZINC000160818839 206314399 /nfs/dbraw/zinc/31/43/99/206314399.db2.gz CAGPKSDDHKQMTQ-UHFFFAOYSA-N 1 2 343.471 2.019 20 70 EEIDLO CCc1ccccc1C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1 ZINC000160818839 206314402 /nfs/dbraw/zinc/31/44/02/206314402.db2.gz CAGPKSDDHKQMTQ-UHFFFAOYSA-N 1 2 343.471 2.019 20 70 EEIDLO Cn1cc[nH+]c1CN1CCN(C(=O)CCCc2ccccc2)CC1 ZINC000160888040 311359434 /nfs/dbraw/zinc/35/94/34/311359434.db2.gz VUGLGGRUDRSRQI-UHFFFAOYSA-N 1 2 326.444 2.087 20 70 EEIDLO O=C(Nc1ccc(N2CCCCC2)cn1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000160021884 463315576 /nfs/dbraw/zinc/31/55/76/463315576.db2.gz HDCYLFMMZPIQSY-CQSZACIVSA-N 1 2 325.416 2.470 20 70 EEIDLO COc1ccc2nc(C)cc(C(=O)NC[C@@H](C)[NH+]3CCOCC3)c2c1 ZINC000160209453 463324038 /nfs/dbraw/zinc/32/40/38/463324038.db2.gz PEAMBKBEQOXYMY-CQSZACIVSA-N 1 2 343.427 2.002 20 70 EEIDLO COc1ccccc1[C@H](NC(=O)[C@H]1CCCCO1)c1[nH+]ccn1C ZINC000160320833 463328335 /nfs/dbraw/zinc/32/83/35/463328335.db2.gz AIBCDIBCTRTVPX-CVEARBPZSA-N 1 2 329.400 2.203 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)NCC(C)(C)[NH+]2CCOCC2)n1 ZINC000161409189 463428593 /nfs/dbraw/zinc/42/85/93/463428593.db2.gz IDXKYOSUJVCRNV-UHFFFAOYSA-N 1 2 337.468 2.162 20 70 EEIDLO Cn1cc[nH+]c1[C@@H](NC(=O)N1CCC[C@](C)(O)C1)c1cccc(F)c1 ZINC000160033763 206276309 /nfs/dbraw/zinc/27/63/09/206276309.db2.gz BOBLNJHUJCOGHF-YJBOKZPZSA-N 1 2 346.406 2.205 20 70 EEIDLO CCOC(=O)C[N@@H+]1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000160270452 206288335 /nfs/dbraw/zinc/28/83/35/206288335.db2.gz DXNNVAUOVDGMHM-HNNXBMFYSA-N 1 2 333.432 2.392 20 70 EEIDLO CCOC(=O)C[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000160270452 206288339 /nfs/dbraw/zinc/28/83/39/206288339.db2.gz DXNNVAUOVDGMHM-HNNXBMFYSA-N 1 2 333.432 2.392 20 70 EEIDLO CCc1nnc(C[NH2+][C@@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)[nH]1 ZINC000160474167 206299101 /nfs/dbraw/zinc/29/91/01/206299101.db2.gz YOTZBWBNTQOGAS-GWCFXTLKSA-N 1 2 329.404 2.327 20 70 EEIDLO CCSCC[C@H](C)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160499942 206300485 /nfs/dbraw/zinc/30/04/85/206300485.db2.gz LZMCIRKBXPJQFR-HNNXBMFYSA-N 1 2 336.505 2.441 20 70 EEIDLO O=C(NCc1ccc[nH+]c1N1CCOCC1)N1CCC2(CCC2)C1 ZINC000160127958 279868586 /nfs/dbraw/zinc/86/85/86/279868586.db2.gz IRAWPCUROUWSEG-UHFFFAOYSA-N 1 2 330.432 2.004 20 70 EEIDLO CC(C)N(C[C@H](C)O)C(=O)NCCc1[nH+]ccn1Cc1ccccc1 ZINC000159897529 311348063 /nfs/dbraw/zinc/34/80/63/311348063.db2.gz CZJYAHJAEXXFSY-INIZCTEOSA-N 1 2 344.459 2.275 20 70 EEIDLO Cc1[nH+]c2ccccn2c1CN1CCn2c(nnc2C(F)(F)F)C1 ZINC000160562599 463350320 /nfs/dbraw/zinc/35/03/20/463350320.db2.gz KUKXUFMXSLUHRP-UHFFFAOYSA-N 1 2 336.321 2.269 20 70 EEIDLO CC[N@H+](CC(=O)Nc1ccnn1C1CCCC1)Cc1cnn(C)c1 ZINC000161100469 463399734 /nfs/dbraw/zinc/39/97/34/463399734.db2.gz WZUSAVFBOTVPGM-UHFFFAOYSA-N 1 2 330.436 2.192 20 70 EEIDLO CC[N@@H+](CC(=O)Nc1ccnn1C1CCCC1)Cc1cnn(C)c1 ZINC000161100469 463399740 /nfs/dbraw/zinc/39/97/40/463399740.db2.gz WZUSAVFBOTVPGM-UHFFFAOYSA-N 1 2 330.436 2.192 20 70 EEIDLO C[C@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161190605 463408769 /nfs/dbraw/zinc/40/87/69/463408769.db2.gz NDUFRRMKDCDXDG-SNVBAGLBSA-N 1 2 341.820 2.016 20 70 EEIDLO Cc1cc(C)c(NC(=O)[C@H](C)S(=O)(=O)Cc2[nH+]ccn2C)c(C)c1 ZINC000161205205 463410277 /nfs/dbraw/zinc/41/02/77/463410277.db2.gz GJVUUSDIPJSCKB-AWEZNQCLSA-N 1 2 349.456 2.287 20 70 EEIDLO CC1(C)CCC(C(=O)NCC[NH+]2CCN(C(=O)C3CCC3)CC2)CC1 ZINC000160340742 539521431 /nfs/dbraw/zinc/52/14/31/539521431.db2.gz SOTKCUOIWREXHS-UHFFFAOYSA-N 1 2 349.519 2.263 20 70 EEIDLO CCCC[N@H+](Cc1ccc(OC)c(O)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160769528 206311995 /nfs/dbraw/zinc/31/19/95/206311995.db2.gz LZDGJRHTCKVXFZ-CQSZACIVSA-N 1 2 327.446 2.190 20 70 EEIDLO CCCC[N@@H+](Cc1ccc(OC)c(O)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160769528 206312000 /nfs/dbraw/zinc/31/20/00/206312000.db2.gz LZDGJRHTCKVXFZ-CQSZACIVSA-N 1 2 327.446 2.190 20 70 EEIDLO COc1ccc(C[N@H+](C)Cc2ccc(C(=O)N(C)C)[nH]2)c(OC)c1 ZINC000160830590 206315451 /nfs/dbraw/zinc/31/54/51/206315451.db2.gz BCVRCJFTHIVNOZ-UHFFFAOYSA-N 1 2 331.416 2.366 20 70 EEIDLO COc1ccc(C[N@@H+](C)Cc2ccc(C(=O)N(C)C)[nH]2)c(OC)c1 ZINC000160830590 206315456 /nfs/dbraw/zinc/31/54/56/206315456.db2.gz BCVRCJFTHIVNOZ-UHFFFAOYSA-N 1 2 331.416 2.366 20 70 EEIDLO Cc1c([C@@H](C)[NH2+]CC(=O)NC(C)C)nnn1-c1ccc(Cl)cc1 ZINC000160964018 206320898 /nfs/dbraw/zinc/32/08/98/206320898.db2.gz ZCXKYLORVBZVTP-LLVKDONJSA-N 1 2 335.839 2.404 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161185368 206334207 /nfs/dbraw/zinc/33/42/07/206334207.db2.gz ODOLZAKKUKKVBJ-KZNAEPCWSA-N 1 2 344.503 2.377 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161185368 206334212 /nfs/dbraw/zinc/33/42/12/206334212.db2.gz ODOLZAKKUKKVBJ-KZNAEPCWSA-N 1 2 344.503 2.377 20 70 EEIDLO C[C@@H]1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)C[C@H]1n1cc[nH+]c1 ZINC000160971421 296520638 /nfs/dbraw/zinc/52/06/38/296520638.db2.gz ZIIFUTKBKYLIMC-JJTUDDRGSA-N 1 2 344.459 2.433 20 70 EEIDLO C[C@@H]1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)C[C@@H]1n1cc[nH+]c1 ZINC000160971172 296520671 /nfs/dbraw/zinc/52/06/71/296520671.db2.gz ZIIFUTKBKYLIMC-HMDCTGQHSA-N 1 2 344.459 2.433 20 70 EEIDLO CCCCn1ncc(NC(=O)N[C@H](C)[C@@H](C)[NH+]2CCOCC2)c1C ZINC000159800583 311346485 /nfs/dbraw/zinc/34/64/85/311346485.db2.gz WMABXQOGZFTHRG-ZIAGYGMSSA-N 1 2 337.468 2.222 20 70 EEIDLO CC(C)CO[C@H](C)c1noc(CSCC[NH+]2CCOCC2)n1 ZINC000159934293 311348085 /nfs/dbraw/zinc/34/80/85/311348085.db2.gz BNKQYHQAIWOREL-CYBMUJFWSA-N 1 2 329.466 2.369 20 70 EEIDLO C[C@@H]1CCO[C@@H]1C(=O)N[C@@H]1CCC[N@H+](Cc2c(F)cccc2F)C1 ZINC000160245587 463324325 /nfs/dbraw/zinc/32/43/25/463324325.db2.gz ISYWIFDQBCYLIZ-XNJGSVPQSA-N 1 2 338.398 2.470 20 70 EEIDLO C[C@@H]1CCO[C@@H]1C(=O)N[C@@H]1CCC[N@@H+](Cc2c(F)cccc2F)C1 ZINC000160245587 463324332 /nfs/dbraw/zinc/32/43/32/463324332.db2.gz ISYWIFDQBCYLIZ-XNJGSVPQSA-N 1 2 338.398 2.470 20 70 EEIDLO O=C(CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)Nc1cccc2ccccc21 ZINC000161119962 463400656 /nfs/dbraw/zinc/40/06/56/463400656.db2.gz PLRJIBJOWJTZSF-OAHLLOKOSA-N 1 2 348.406 2.354 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)CC(=O)Nc1ccccc1C(C)(C)C ZINC000161182698 463407845 /nfs/dbraw/zinc/40/78/45/463407845.db2.gz JRPJJGWHVOHYIL-UHFFFAOYSA-N 1 2 349.456 2.271 20 70 EEIDLO CC(C)n1cc[nH+]c1CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1C ZINC000161215247 463410503 /nfs/dbraw/zinc/41/05/03/463410503.db2.gz QZKCIZBPRQBFNK-ZIAGYGMSSA-N 1 2 341.477 2.074 20 70 EEIDLO Cc1nc(NC(=O)[C@@H](C)SCC[NH+]2CCOCC2)sc1C ZINC000160055637 206277968 /nfs/dbraw/zinc/27/79/68/206277968.db2.gz KIHKPMMRXLTEJS-GFCCVEGCSA-N 1 2 329.491 2.152 20 70 EEIDLO CO[C@]1(C)C[C@H](NC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1(C)C ZINC000160518062 206302029 /nfs/dbraw/zinc/30/20/29/206302029.db2.gz SVGKPVKNNPOOEO-QFBILLFUSA-N 1 2 346.475 2.112 20 70 EEIDLO C[N@H+](CCOCC1CC1)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000161015886 206324206 /nfs/dbraw/zinc/32/42/06/206324206.db2.gz SSDPBQLIVJRATB-AWEZNQCLSA-N 1 2 341.249 2.334 20 70 EEIDLO C[N@@H+](CCOCC1CC1)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000161015886 206324211 /nfs/dbraw/zinc/32/42/11/206324211.db2.gz SSDPBQLIVJRATB-AWEZNQCLSA-N 1 2 341.249 2.334 20 70 EEIDLO OC[C@@H]1CCCN(c2cc(N[C@@H]3CCO[C@H](C4CC4)C3)[nH+]cn2)C1 ZINC000160466488 463341131 /nfs/dbraw/zinc/34/11/31/463341131.db2.gz PDXDAPGLOQCAGJ-BMFZPTHFSA-N 1 2 332.448 2.055 20 70 EEIDLO OC[C@@H]1CCCN(c2cc(N[C@@H]3CCO[C@H](C4CC4)C3)nc[nH+]2)C1 ZINC000160466488 463341137 /nfs/dbraw/zinc/34/11/37/463341137.db2.gz PDXDAPGLOQCAGJ-BMFZPTHFSA-N 1 2 332.448 2.055 20 70 EEIDLO CO[C@H](C)C(=O)Nc1cccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1 ZINC000160587935 463352336 /nfs/dbraw/zinc/35/23/36/463352336.db2.gz DUCXGCMULTXBMP-CHWSQXEVSA-N 1 2 342.399 2.058 20 70 EEIDLO COc1cccc(N2CC[NH+](Cc3ccc(C(=O)N(C)C)[nH]3)CC2)c1 ZINC000160684861 311357295 /nfs/dbraw/zinc/35/72/95/311357295.db2.gz HLEDQOATQJLSQX-UHFFFAOYSA-N 1 2 342.443 2.047 20 70 EEIDLO COCCCNC(=O)C[N@H+](C)Cc1ccccc1Oc1cccnc1 ZINC000159473054 463288618 /nfs/dbraw/zinc/28/86/18/463288618.db2.gz RCVFKPMEHQAIRQ-UHFFFAOYSA-N 1 2 343.427 2.458 20 70 EEIDLO COCCCNC(=O)C[N@@H+](C)Cc1ccccc1Oc1cccnc1 ZINC000159473054 463288620 /nfs/dbraw/zinc/28/86/20/463288620.db2.gz RCVFKPMEHQAIRQ-UHFFFAOYSA-N 1 2 343.427 2.458 20 70 EEIDLO O=C(Cc1ccccc1Cl)N1CC[NH+](CCOCC2CC2)CC1 ZINC000159659338 463297127 /nfs/dbraw/zinc/29/71/27/463297127.db2.gz POJIRGZRQDINCT-UHFFFAOYSA-N 1 2 336.863 2.453 20 70 EEIDLO C[C@H]1CCC[C@@H](C(=O)N2CC[NH+](CC(=O)N3CCCC[C@@H]3C)CC2)C1 ZINC000159922564 463309863 /nfs/dbraw/zinc/30/98/63/463309863.db2.gz OEJWJERPQWBOFP-OKZBNKHCSA-N 1 2 349.519 2.358 20 70 EEIDLO COC(C[NH+]1CCN(C(=O)c2cccc(Cl)c2Cl)CC1)OC ZINC000160591647 463353073 /nfs/dbraw/zinc/35/30/73/463353073.db2.gz CPJVNJFZYUVDSI-UHFFFAOYSA-N 1 2 347.242 2.370 20 70 EEIDLO COc1cc(CCC(=O)NC[C@H](C)[NH+]2CCOCC2)ccc1Cl ZINC000161199032 463408996 /nfs/dbraw/zinc/40/89/96/463408996.db2.gz YIRQVUDJVVNIKA-ZDUSSCGKSA-N 1 2 340.851 2.118 20 70 EEIDLO CCCCOC(=O)[C@@H](C)[N@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000160350636 528563713 /nfs/dbraw/zinc/56/37/13/528563713.db2.gz DXCNOPFWIDRLCF-QWHCGFSZSA-N 1 2 342.461 2.059 20 70 EEIDLO CCCCOC(=O)[C@@H](C)[N@@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000160350636 528563716 /nfs/dbraw/zinc/56/37/16/528563716.db2.gz DXCNOPFWIDRLCF-QWHCGFSZSA-N 1 2 342.461 2.059 20 70 EEIDLO COc1ccc(-c2noc(CSCC[NH+]3CCOCC3)n2)cc1 ZINC000160048187 533204629 /nfs/dbraw/zinc/20/46/29/533204629.db2.gz WGSUOHFLTGEXDT-UHFFFAOYSA-N 1 2 335.429 2.311 20 70 EEIDLO Cc1cccc([C@H](CNC(=O)c2cccc(F)n2)[NH+]2CCOCC2)c1 ZINC000160027873 225323141 /nfs/dbraw/zinc/32/31/41/225323141.db2.gz YBSXNQQXUFLOSL-KRWDZBQOSA-N 1 2 343.402 2.332 20 70 EEIDLO CC[C@@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC2(C1)OCCO2 ZINC000160602300 287374292 /nfs/dbraw/zinc/37/42/92/287374292.db2.gz OOUBYUPVCVJINZ-CQSZACIVSA-N 1 2 336.457 2.033 20 70 EEIDLO CC[C@@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC2(C1)OCCO2 ZINC000160602300 287374294 /nfs/dbraw/zinc/37/42/94/287374294.db2.gz OOUBYUPVCVJINZ-CQSZACIVSA-N 1 2 336.457 2.033 20 70 EEIDLO Cc1ccccc1C[C@H](C)NC(=O)CSCC[NH+]1CCOCC1 ZINC000159775634 311346202 /nfs/dbraw/zinc/34/62/02/311346202.db2.gz OOCJTIKPHJMADV-INIZCTEOSA-N 1 2 336.501 2.108 20 70 EEIDLO CC(=O)[C@@H](NC(=O)C[N@H+](CCc1nccs1)C(C)C)C(C)C ZINC000159852739 311347094 /nfs/dbraw/zinc/34/70/94/311347094.db2.gz PYJRKKVQYSBTPB-INIZCTEOSA-N 1 2 325.478 2.126 20 70 EEIDLO CC(=O)[C@@H](NC(=O)C[N@@H+](CCc1nccs1)C(C)C)C(C)C ZINC000159852739 311347095 /nfs/dbraw/zinc/34/70/95/311347095.db2.gz PYJRKKVQYSBTPB-INIZCTEOSA-N 1 2 325.478 2.126 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)[N@@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159402083 463284559 /nfs/dbraw/zinc/28/45/59/463284559.db2.gz ULBCTIRDOSXBFU-YKTARERQSA-N 1 2 348.491 2.146 20 70 EEIDLO C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)[N@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159402083 463284564 /nfs/dbraw/zinc/28/45/64/463284564.db2.gz ULBCTIRDOSXBFU-YKTARERQSA-N 1 2 348.491 2.146 20 70 EEIDLO Cc1c(CNC(=O)NCc2ccc(-n3cc[nH+]c3)c(F)c2)cnn1C ZINC000160568180 463350770 /nfs/dbraw/zinc/35/07/70/463350770.db2.gz LUQLENHMHCHXRP-UHFFFAOYSA-N 1 2 342.378 2.053 20 70 EEIDLO CCOC(=O)NCCCC(=O)NCc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000161153173 463404086 /nfs/dbraw/zinc/40/40/86/463404086.db2.gz MJBYSJATBQPFAD-UHFFFAOYSA-N 1 2 348.378 2.154 20 70 EEIDLO COC(=O)c1cc(CN2CC[NH+](Cc3ccncc3)CC2)oc1C ZINC000161165698 463407098 /nfs/dbraw/zinc/40/70/98/463407098.db2.gz NUQLQQYIKHVVKB-UHFFFAOYSA-N 1 2 329.400 2.087 20 70 EEIDLO COC(=O)c1cc(C[NH+]2CCN(Cc3ccncc3)CC2)oc1C ZINC000161165698 463407100 /nfs/dbraw/zinc/40/71/00/463407100.db2.gz NUQLQQYIKHVVKB-UHFFFAOYSA-N 1 2 329.400 2.087 20 70 EEIDLO C[C@H](C(=O)Nc1ccc(Cl)cc1)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161193745 463409168 /nfs/dbraw/zinc/40/91/68/463409168.db2.gz LYDKRZNZUNJLKZ-SNVBAGLBSA-N 1 2 341.820 2.016 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)Cc1ccc(OCC(F)(F)F)cc1 ZINC000161203321 463410372 /nfs/dbraw/zinc/41/03/72/463410372.db2.gz LDVSJFJYNSVBGJ-UHFFFAOYSA-N 1 2 348.346 2.476 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)N1CCC[C@@](C)(O)C1 ZINC000159886736 534680818 /nfs/dbraw/zinc/68/08/18/534680818.db2.gz LTLFBWLGWZLVQV-GOSISDBHSA-N 1 2 330.432 2.291 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)Nc1cc(F)ccc1F ZINC000161164893 225562147 /nfs/dbraw/zinc/56/21/47/225562147.db2.gz CIKLEUXBPSBGEU-UHFFFAOYSA-N 1 2 346.381 2.116 20 70 EEIDLO CCC(CC)NC(=O)[C@@H]1CN(Cc2[nH+]ccn2C)c2ccccc2O1 ZINC000160894564 311359444 /nfs/dbraw/zinc/35/94/44/311359444.db2.gz DUUHBWOCHSHPJK-KRWDZBQOSA-N 1 2 342.443 2.493 20 70 EEIDLO COC(C)(C)C[C@@H](C)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160403435 463334527 /nfs/dbraw/zinc/33/45/27/463334527.db2.gz VSHKZNGWYMSYIO-OAHLLOKOSA-N 1 2 334.464 2.112 20 70 EEIDLO COc1ccc(OCCCNC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160435576 463338566 /nfs/dbraw/zinc/33/85/66/463338566.db2.gz PFTAGDBYAZDUJU-AWEZNQCLSA-N 1 2 329.400 2.039 20 70 EEIDLO COCCNc1nc(N2CC[C@@H](C)[C@H]2C)nc(N2CC[C@H](C)[C@@H]2C)[nH+]1 ZINC000160768359 463369364 /nfs/dbraw/zinc/36/93/64/463369364.db2.gz SPHSAFAFKWYWTI-NMWPEEMBSA-N 1 2 348.495 2.399 20 70 EEIDLO COCCNc1nc(N2CC[C@H](C)[C@@H]2C)nc(N2CC[C@@H](C)[C@H]2C)[nH+]1 ZINC000160768359 463369368 /nfs/dbraw/zinc/36/93/68/463369368.db2.gz SPHSAFAFKWYWTI-NMWPEEMBSA-N 1 2 348.495 2.399 20 70 EEIDLO COCCNc1nc(N2CC[C@H](C)[C@H]2C)nc(N2CC[C@H](C)[C@@H]2C)[nH+]1 ZINC000160768447 463369916 /nfs/dbraw/zinc/36/99/16/463369916.db2.gz SPHSAFAFKWYWTI-ZQDZILKHSA-N 1 2 348.495 2.399 20 70 EEIDLO COCCNc1nc(N2CC[C@H](C)[C@@H]2C)nc(N2CC[C@H](C)[C@H]2C)[nH+]1 ZINC000160768447 463369922 /nfs/dbraw/zinc/36/99/22/463369922.db2.gz SPHSAFAFKWYWTI-ZQDZILKHSA-N 1 2 348.495 2.399 20 70 EEIDLO COc1ccc(OC)c(CN2CC[NH+](Cc3cncs3)CC2)c1 ZINC000161042432 463394457 /nfs/dbraw/zinc/39/44/57/463394457.db2.gz LWDKKIWIZUBZOR-UHFFFAOYSA-N 1 2 333.457 2.478 20 70 EEIDLO COc1ccc(OC)c(C[NH+]2CCN(Cc3cncs3)CC2)c1 ZINC000161042432 463394463 /nfs/dbraw/zinc/39/44/63/463394463.db2.gz LWDKKIWIZUBZOR-UHFFFAOYSA-N 1 2 333.457 2.478 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000161167495 463406196 /nfs/dbraw/zinc/40/61/96/463406196.db2.gz DLNQCVUUYBCQDW-GFCCVEGCSA-N 1 2 339.399 2.100 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000161167495 463406201 /nfs/dbraw/zinc/40/62/01/463406201.db2.gz DLNQCVUUYBCQDW-GFCCVEGCSA-N 1 2 339.399 2.100 20 70 EEIDLO CC1(O)CC[NH+](Cc2nnc(-c3ccc(Br)o3)o2)CC1 ZINC000161210913 463410983 /nfs/dbraw/zinc/41/09/83/463410983.db2.gz CEMKAAPHZYYQGA-UHFFFAOYSA-N 1 2 342.193 2.439 20 70 EEIDLO CCN(Cc1ccccc1)C(=O)[C@@H](C)SCC[NH+]1CCOCC1 ZINC000160009067 528827687 /nfs/dbraw/zinc/82/76/87/528827687.db2.gz NUNGMFDPOKUJQG-MRXNPFEDSA-N 1 2 336.501 2.489 20 70 EEIDLO CCc1ccc([C@H](C)CC(=O)NC[C@@H](C)[NH+]2CCN(C)CC2)cc1 ZINC000160158048 529719492 /nfs/dbraw/zinc/71/94/92/529719492.db2.gz UKJOPOUCHLKCSW-IAGOWNOFSA-N 1 2 331.504 2.495 20 70 EEIDLO Cc1nccc(NC(=O)N2CCC[C@@H]2C[NH+]2CCOCC2)c1Cl ZINC000160030236 539519238 /nfs/dbraw/zinc/51/92/38/539519238.db2.gz LPMYJCGFXSUFAY-CYBMUJFWSA-N 1 2 338.839 2.372 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCc2sccc2C1 ZINC000159871466 225294571 /nfs/dbraw/zinc/29/45/71/225294571.db2.gz PTHZQPUBVGNADK-ZDUSSCGKSA-N 1 2 340.514 2.087 20 70 EEIDLO CC1(C)CCC[C@@H](CC(=O)N2CC[NH+](CC(=O)N3CCCC3)CC2)C1 ZINC000159627447 311343977 /nfs/dbraw/zinc/34/39/77/311343977.db2.gz SNQFFAPPFPHDFU-KRWDZBQOSA-N 1 2 349.519 2.360 20 70 EEIDLO COc1cc2c(cc1OC)C[N@H+](Cc1ccc(C(=O)N(C)C)[nH]1)CC2 ZINC000159775445 311346177 /nfs/dbraw/zinc/34/61/77/311346177.db2.gz GQNTXQZDRRZKDB-UHFFFAOYSA-N 1 2 343.427 2.292 20 70 EEIDLO COc1cc2c(cc1OC)C[N@@H+](Cc1ccc(C(=O)N(C)C)[nH]1)CC2 ZINC000159775445 311346179 /nfs/dbraw/zinc/34/61/79/311346179.db2.gz GQNTXQZDRRZKDB-UHFFFAOYSA-N 1 2 343.427 2.292 20 70 EEIDLO CN(CC[N@H+](C)Cn1cc(Br)cn1)C(=O)OC(C)(C)C ZINC000160563064 311355723 /nfs/dbraw/zinc/35/57/23/311355723.db2.gz QYDHTHMOESBZOY-UHFFFAOYSA-N 1 2 347.257 2.402 20 70 EEIDLO CN(CC[N@@H+](C)Cn1cc(Br)cn1)C(=O)OC(C)(C)C ZINC000160563064 311355725 /nfs/dbraw/zinc/35/57/25/311355725.db2.gz QYDHTHMOESBZOY-UHFFFAOYSA-N 1 2 347.257 2.402 20 70 EEIDLO C[C@]([NH2+]Cc1cnc2ccccn12)(C(N)=O)c1cccc(Cl)c1 ZINC000160976922 311360659 /nfs/dbraw/zinc/36/06/59/311360659.db2.gz FFDWXWXHEDYFSW-QGZVFWFLSA-N 1 2 328.803 2.478 20 70 EEIDLO Cc1ccc(NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)cc1C ZINC000161143767 311362869 /nfs/dbraw/zinc/36/28/69/311362869.db2.gz KPQLKBYCPFEYTQ-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO CO[C@]1(C)C[C@@H](NC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1(C)C ZINC000160517929 463345064 /nfs/dbraw/zinc/34/50/64/463345064.db2.gz SVGKPVKNNPOOEO-VQIMIIECSA-N 1 2 346.475 2.112 20 70 EEIDLO CCCC[N@H+](Cc1ccccc1C(=O)OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160752402 463367754 /nfs/dbraw/zinc/36/77/54/463367754.db2.gz PITBGDBQKADWOC-OAHLLOKOSA-N 1 2 339.457 2.262 20 70 EEIDLO CCCC[N@@H+](Cc1ccccc1C(=O)OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160752402 463367758 /nfs/dbraw/zinc/36/77/58/463367758.db2.gz PITBGDBQKADWOC-OAHLLOKOSA-N 1 2 339.457 2.262 20 70 EEIDLO CCCn1nc(C)c(C(=O)N2CCN(c3cccc[nH+]3)CC2)c1C ZINC000161253918 463413785 /nfs/dbraw/zinc/41/37/85/463413785.db2.gz CWGIAEIEMPBNKR-UHFFFAOYSA-N 1 2 327.432 2.267 20 70 EEIDLO CC1(C)C[C@H]1C(=O)NCc1cccc(OCC[NH+]2CCOCC2)c1 ZINC000161450460 463431184 /nfs/dbraw/zinc/43/11/84/463431184.db2.gz NEOLSQZIFUCLJR-KRWDZBQOSA-N 1 2 332.444 2.060 20 70 EEIDLO COc1ccc(NC(=O)[C@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1N ZINC000161278618 534156740 /nfs/dbraw/zinc/15/67/40/534156740.db2.gz DJUAJVQJMIRKKM-AHIWAGSCSA-N 1 2 335.448 2.350 20 70 EEIDLO COc1ccc(NC(=O)[C@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1N ZINC000161278618 534156747 /nfs/dbraw/zinc/15/67/47/534156747.db2.gz DJUAJVQJMIRKKM-AHIWAGSCSA-N 1 2 335.448 2.350 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000159833180 533617061 /nfs/dbraw/zinc/61/70/61/533617061.db2.gz MZAQWTAOJZTTPE-MRXNPFEDSA-N 1 2 344.436 2.279 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000159833180 533617066 /nfs/dbraw/zinc/61/70/66/533617066.db2.gz MZAQWTAOJZTTPE-MRXNPFEDSA-N 1 2 344.436 2.279 20 70 EEIDLO CS(=O)(=O)c1ccc(NC(=O)C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159597827 311343319 /nfs/dbraw/zinc/34/33/19/311343319.db2.gz BCOILIIOZJOKOM-BBRMVZONSA-N 1 2 336.457 2.293 20 70 EEIDLO CS(=O)(=O)c1ccc(NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159597827 311343321 /nfs/dbraw/zinc/34/33/21/311343321.db2.gz BCOILIIOZJOKOM-BBRMVZONSA-N 1 2 336.457 2.293 20 70 EEIDLO CCOC(=O)CCc1ccc(NC(=O)NCCn2cc[nH+]c2)cc1 ZINC000159595893 463294386 /nfs/dbraw/zinc/29/43/86/463294386.db2.gz NSRJTTXGWWHDDH-UHFFFAOYSA-N 1 2 330.388 2.201 20 70 EEIDLO COCCOc1cc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)ccc1OC ZINC000159719199 463301716 /nfs/dbraw/zinc/30/17/16/463301716.db2.gz ZUHXJHVDRBRCDR-CYBMUJFWSA-N 1 2 345.399 2.118 20 70 EEIDLO CN(Cc1[nH+]ccn1Cc1ccccc1)c1cn[nH]c(=O)c1Cl ZINC000159725414 463301826 /nfs/dbraw/zinc/30/18/26/463301826.db2.gz AYBXQXJIOGZKRR-UHFFFAOYSA-N 1 2 329.791 2.305 20 70 EEIDLO CCN1CC[NH+]([C@@H]2CCN(Cc3noc(C4CCCCC4)n3)C2)CC1 ZINC000160050546 463317596 /nfs/dbraw/zinc/31/75/96/463317596.db2.gz NCFDUUPJHUYORJ-QGZVFWFLSA-N 1 2 347.507 2.329 20 70 EEIDLO CC[C@H](COC)NC(=O)NC[C@@H](c1c(F)cccc1F)[NH+](C)C ZINC000160118323 463320419 /nfs/dbraw/zinc/32/04/19/463320419.db2.gz BDSGHEJSWVZDAK-RISCZKNCSA-N 1 2 329.391 2.292 20 70 EEIDLO CN(CCCCNC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000160359029 463331884 /nfs/dbraw/zinc/33/18/84/463331884.db2.gz SEIQBPNFMCSJLH-INIZCTEOSA-N 1 2 326.444 2.478 20 70 EEIDLO COCCCOc1ccccc1NC(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000160361415 463332215 /nfs/dbraw/zinc/33/22/15/463332215.db2.gz DASDJDNQCQMZAW-AWEZNQCLSA-N 1 2 329.400 2.500 20 70 EEIDLO CN(C)C(=O)Nc1ccc(C(=O)NCCCn2cc[nH+]c2)c(Cl)c1 ZINC000160940447 463383740 /nfs/dbraw/zinc/38/37/40/463383740.db2.gz RQQYCZHVZCNETM-UHFFFAOYSA-N 1 2 349.822 2.450 20 70 EEIDLO C[C@@H](C(=O)NC1CC1)[NH+]1CCN(C(=O)C[C@H]2CCCC(C)(C)C2)CC1 ZINC000161222849 539526367 /nfs/dbraw/zinc/52/63/67/539526367.db2.gz WDZQHPYHUQXLFX-JKSUJKDBSA-N 1 2 349.519 2.404 20 70 EEIDLO COc1ccc(OC)c(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000159945980 532973939 /nfs/dbraw/zinc/97/39/39/532973939.db2.gz AACQBDPSENSOGY-CYBMUJFWSA-N 1 2 342.399 2.499 20 70 EEIDLO Clc1cnc(N2CC[NH+](CCn3ccnc3)CC2)c(Cl)c1 ZINC000159759107 225272992 /nfs/dbraw/zinc/27/29/92/225272992.db2.gz VGTXKFKUHBQRMR-UHFFFAOYSA-N 1 2 326.231 2.407 20 70 EEIDLO Cc1ccccc1CCNC(=O)[C@H](C)SCC[NH+]1CCOCC1 ZINC000159979534 225313180 /nfs/dbraw/zinc/31/31/80/225313180.db2.gz DAHGZSSSCMRTAL-INIZCTEOSA-N 1 2 336.501 2.108 20 70 EEIDLO CC[N@H+](Cc1ccc(OC(C)C)c(OC)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160539773 463347732 /nfs/dbraw/zinc/34/77/32/463347732.db2.gz MNCRWSPCZCCBKI-OAHLLOKOSA-N 1 2 341.473 2.491 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC(C)C)c(OC)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160539773 463347741 /nfs/dbraw/zinc/34/77/41/463347741.db2.gz MNCRWSPCZCCBKI-OAHLLOKOSA-N 1 2 341.473 2.491 20 70 EEIDLO CC(=O)N1CCCc2cc(NC(=O)[C@@H]3CCn4cc[nH+]c4C3)ccc21 ZINC000161085511 463398306 /nfs/dbraw/zinc/39/83/06/463398306.db2.gz POTNEDTUVIQHEO-OAHLLOKOSA-N 1 2 338.411 2.383 20 70 EEIDLO CC1CCC(N(C)C(=O)CN2CC[NH+](Cc3ccncc3)CC2)CC1 ZINC000161210790 463410850 /nfs/dbraw/zinc/41/08/50/463410850.db2.gz DANPQGCAURFTQC-UHFFFAOYSA-N 1 2 344.503 2.236 20 70 EEIDLO CC1CCC(N(C)C(=O)C[NH+]2CCN(Cc3ccncc3)CC2)CC1 ZINC000161210790 463410855 /nfs/dbraw/zinc/41/08/55/463410855.db2.gz DANPQGCAURFTQC-UHFFFAOYSA-N 1 2 344.503 2.236 20 70 EEIDLO C[N@H+](CCOCC1CC1)CC(=O)Nc1ccc(Br)cn1 ZINC000160343338 529922068 /nfs/dbraw/zinc/92/20/68/529922068.db2.gz SUFBTJCZGRLCCW-UHFFFAOYSA-N 1 2 342.237 2.141 20 70 EEIDLO C[N@@H+](CCOCC1CC1)CC(=O)Nc1ccc(Br)cn1 ZINC000160343338 529922070 /nfs/dbraw/zinc/92/20/70/529922070.db2.gz SUFBTJCZGRLCCW-UHFFFAOYSA-N 1 2 342.237 2.141 20 70 EEIDLO CCn1cnnc1C[NH2+]Cc1ccc(OC)c(Br)c1 ZINC000218225924 241309086 /nfs/dbraw/zinc/30/90/86/241309086.db2.gz ZRXMRJHGZYSKMR-UHFFFAOYSA-N 1 2 325.210 2.359 20 70 EEIDLO CCCC[N@H+](Cc1ccc([S@@](C)=O)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160789296 311358892 /nfs/dbraw/zinc/35/88/92/311358892.db2.gz LXXZSWPMMWLEKM-VFNWGFHPSA-N 1 2 343.514 2.213 20 70 EEIDLO CCCC[N@@H+](Cc1ccc([S@@](C)=O)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160789296 311358894 /nfs/dbraw/zinc/35/88/94/311358894.db2.gz LXXZSWPMMWLEKM-VFNWGFHPSA-N 1 2 343.514 2.213 20 70 EEIDLO COc1c(C)cc(C[NH+]2CCN(C(=O)[C@H]3CCCO3)CC2)cc1C ZINC000160985824 311360899 /nfs/dbraw/zinc/36/08/99/311360899.db2.gz SLZGVMYVSXSOHG-QGZVFWFLSA-N 1 2 332.444 2.135 20 70 EEIDLO Cc1cccc2c(CCC(=O)N[C@H](C)C[NH+]3CCOCC3)c[nH]c21 ZINC000160597423 463354017 /nfs/dbraw/zinc/35/40/17/463354017.db2.gz XBBIDPKYSNIFSI-OAHLLOKOSA-N 1 2 329.444 2.246 20 70 EEIDLO Cc1cc(C)c(NC(=O)C[N@H+](C)CCCCS(C)(=O)=O)c(C)c1 ZINC000161374189 539526841 /nfs/dbraw/zinc/52/68/41/539526841.db2.gz PBSZTXYEPNXDNO-UHFFFAOYSA-N 1 2 340.489 2.307 20 70 EEIDLO Cc1cc(C)c(NC(=O)C[N@@H+](C)CCCCS(C)(=O)=O)c(C)c1 ZINC000161374189 539526847 /nfs/dbraw/zinc/52/68/47/539526847.db2.gz PBSZTXYEPNXDNO-UHFFFAOYSA-N 1 2 340.489 2.307 20 70 EEIDLO CN(CC[N@H+](C)Cn1c2ccccc2oc1=O)C(=O)OC(C)(C)C ZINC000160545561 311355577 /nfs/dbraw/zinc/35/55/77/311355577.db2.gz ADJSRPUHZDHLKJ-UHFFFAOYSA-N 1 2 335.404 2.351 20 70 EEIDLO CN(CC[N@@H+](C)Cn1c2ccccc2oc1=O)C(=O)OC(C)(C)C ZINC000160545561 311355578 /nfs/dbraw/zinc/35/55/78/311355578.db2.gz ADJSRPUHZDHLKJ-UHFFFAOYSA-N 1 2 335.404 2.351 20 70 EEIDLO Cc1cccc(C)c1NC(=O)CN1CC[NH+](Cc2ccncc2)CC1 ZINC000161144719 311362745 /nfs/dbraw/zinc/36/27/45/311362745.db2.gz RYJICFVLBPMQDG-UHFFFAOYSA-N 1 2 338.455 2.455 20 70 EEIDLO O=C(Nc1ccc(CN2CCOC2=O)cc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000160144623 463321302 /nfs/dbraw/zinc/32/13/02/463321302.db2.gz MMMHYRFLWZKVPU-AWEZNQCLSA-N 1 2 340.383 2.036 20 70 EEIDLO COC(=O)c1ccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000160734551 463366087 /nfs/dbraw/zinc/36/60/87/463366087.db2.gz DINZYOYETATQPV-OAHLLOKOSA-N 1 2 340.383 2.269 20 70 EEIDLO CCCC[N@H+](Cc1ccc(OC)c(O)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160769662 463369463 /nfs/dbraw/zinc/36/94/63/463369463.db2.gz LZDGJRHTCKVXFZ-AWEZNQCLSA-N 1 2 327.446 2.190 20 70 EEIDLO CCCC[N@@H+](Cc1ccc(OC)c(O)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160769662 463369468 /nfs/dbraw/zinc/36/94/68/463369468.db2.gz LZDGJRHTCKVXFZ-AWEZNQCLSA-N 1 2 327.446 2.190 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000161063964 463396726 /nfs/dbraw/zinc/39/67/26/463396726.db2.gz ZGROOJNBGQRJIZ-ZDUSSCGKSA-N 1 2 326.400 2.030 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000161063964 463396733 /nfs/dbraw/zinc/39/67/33/463396733.db2.gz ZGROOJNBGQRJIZ-ZDUSSCGKSA-N 1 2 326.400 2.030 20 70 EEIDLO Cn1cc[nH+]c1-c1cccc(NC(=O)CS(=O)(=O)C(C)(C)C)c1 ZINC000161107225 463399460 /nfs/dbraw/zinc/39/94/60/463399460.db2.gz NNDLBYYZIXDXKV-UHFFFAOYSA-N 1 2 335.429 2.239 20 70 EEIDLO Cc1n[nH]cc1C[NH+]1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 ZINC000160358431 534853452 /nfs/dbraw/zinc/85/34/52/534853452.db2.gz ZZADNXYNSKTDDA-UHFFFAOYSA-N 1 2 337.427 2.086 20 70 EEIDLO Cc1cc(F)c(C(=O)NCc2ccc[nH+]c2N2CCOCC2)cc1F ZINC000160999796 539523983 /nfs/dbraw/zinc/52/39/83/539523983.db2.gz CIIAXKSDKZWPCJ-UHFFFAOYSA-N 1 2 347.365 2.435 20 70 EEIDLO CCOC(=O)C[C@H](C)NC(=O)/C=C/c1ccc(-n2cc[nH+]c2)cc1 ZINC000160091489 311350233 /nfs/dbraw/zinc/35/02/33/311350233.db2.gz MYUWFDSVGQPQKW-MRZGDXHCSA-N 1 2 327.384 2.343 20 70 EEIDLO CCCC[N@H+](Cc1cnc2c(C)cccn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160778386 311358479 /nfs/dbraw/zinc/35/84/79/311358479.db2.gz JOGMODKNDLTNNY-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@@H+](Cc1cnc2c(C)cccn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160778386 311358482 /nfs/dbraw/zinc/35/84/82/311358482.db2.gz JOGMODKNDLTNNY-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCCN(Cc1c[nH+]c2c(C)cccn12)[C@@H]1CCS(=O)(=O)C1 ZINC000160778386 311358483 /nfs/dbraw/zinc/35/84/83/311358483.db2.gz JOGMODKNDLTNNY-OAHLLOKOSA-N 1 2 335.473 2.432 20 70 EEIDLO C[C@@H]1CCC[C@@H](NC(=O)CN2CC[NH+](Cc3ccncc3)CC2)[C@@H]1C ZINC000161142437 311362804 /nfs/dbraw/zinc/36/28/04/311362804.db2.gz IZHPSVBXFDHNCH-ZHALLVOQSA-N 1 2 344.503 2.140 20 70 EEIDLO Cc1[nH+]c2cc(NC(=O)C(=O)N3CCC4(CCC4)C3)ccc2n1C ZINC000159401737 463284464 /nfs/dbraw/zinc/28/44/64/463284464.db2.gz ZJLFQRVYANLVPV-UHFFFAOYSA-N 1 2 326.400 2.223 20 70 EEIDLO COc1ccc2nc(C)cc(C(=O)N[C@@H](C)C[NH+]3CCOCC3)c2c1 ZINC000160597058 463353566 /nfs/dbraw/zinc/35/35/66/463353566.db2.gz BCQQXILBZODLLW-AWEZNQCLSA-N 1 2 343.427 2.002 20 70 EEIDLO CCSc1cc(Cl)ccc1C(=O)NC[C@@H]1C[NH+]2CCN1CC2 ZINC000161316114 463419938 /nfs/dbraw/zinc/41/99/38/463419938.db2.gz XARPWJMNLOSESN-CYBMUJFWSA-N 1 2 339.892 2.182 20 70 EEIDLO CCC[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)[nH+]c2)CCO1 ZINC000159536338 528394695 /nfs/dbraw/zinc/39/46/95/528394695.db2.gz DVNXOFAALRXRBV-INIZCTEOSA-N 1 2 332.448 2.392 20 70 EEIDLO CCCC[N@H+](Cc1cccc2c1OCO2)[C@@H]1CCS(=O)(=O)C1 ZINC000160764458 528444401 /nfs/dbraw/zinc/44/44/01/528444401.db2.gz OAARAHUYZGEBQU-CQSZACIVSA-N 1 2 325.430 2.205 20 70 EEIDLO CCCC[N@@H+](Cc1cccc2c1OCO2)[C@@H]1CCS(=O)(=O)C1 ZINC000160764458 528444406 /nfs/dbraw/zinc/44/44/06/528444406.db2.gz OAARAHUYZGEBQU-CQSZACIVSA-N 1 2 325.430 2.205 20 70 EEIDLO Cc1nccc(NC(=O)N[C@H](C)[C@@H](C)[NH+]2CCOCC2)c1Cl ZINC000159726340 539518020 /nfs/dbraw/zinc/51/80/20/539518020.db2.gz HIOQUWQGDBWFRA-ZYHUDNBSSA-N 1 2 326.828 2.274 20 70 EEIDLO CC(C)NC(=O)Cc1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000159649721 255796835 /nfs/dbraw/zinc/79/68/35/255796835.db2.gz GYRVBSQHJRYWLK-HNNXBMFYSA-N 1 2 340.427 2.151 20 70 EEIDLO Cc1ccc(C[N@H+](C)Cc2cnn([C@]3(C)CCS(=O)(=O)C3)c2)cc1 ZINC000160639316 311357037 /nfs/dbraw/zinc/35/70/37/311357037.db2.gz VINHNORRMBERBE-GOSISDBHSA-N 1 2 347.484 2.357 20 70 EEIDLO Cc1ccc(C[N@@H+](C)Cc2cnn([C@]3(C)CCS(=O)(=O)C3)c2)cc1 ZINC000160639316 311357039 /nfs/dbraw/zinc/35/70/39/311357039.db2.gz VINHNORRMBERBE-GOSISDBHSA-N 1 2 347.484 2.357 20 70 EEIDLO CCCC[N@H+](Cc1cnc2c(C)cccn12)[C@H]1CCS(=O)(=O)C1 ZINC000160778501 311358233 /nfs/dbraw/zinc/35/82/33/311358233.db2.gz JOGMODKNDLTNNY-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCC[N@@H+](Cc1cnc2c(C)cccn12)[C@H]1CCS(=O)(=O)C1 ZINC000160778501 311358234 /nfs/dbraw/zinc/35/82/34/311358234.db2.gz JOGMODKNDLTNNY-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO CCCCN(Cc1c[nH+]c2c(C)cccn12)[C@H]1CCS(=O)(=O)C1 ZINC000160778501 311358235 /nfs/dbraw/zinc/35/82/35/311358235.db2.gz JOGMODKNDLTNNY-HNNXBMFYSA-N 1 2 335.473 2.432 20 70 EEIDLO CCC[N@H+](Cc1cnc(N(CC)CC)s1)[C@H]1CCS(=O)(=O)C1 ZINC000161073240 311361719 /nfs/dbraw/zinc/36/17/19/311361719.db2.gz OFBXHNQUUPRYCU-ZDUSSCGKSA-N 1 2 345.534 2.388 20 70 EEIDLO CCC[N@@H+](Cc1cnc(N(CC)CC)s1)[C@H]1CCS(=O)(=O)C1 ZINC000161073240 311361722 /nfs/dbraw/zinc/36/17/22/311361722.db2.gz OFBXHNQUUPRYCU-ZDUSSCGKSA-N 1 2 345.534 2.388 20 70 EEIDLO CCc1ccc(CNC(=O)C[N@H+](C)C2(C(=O)OC)CCCC2)s1 ZINC000159418756 463286199 /nfs/dbraw/zinc/28/61/99/463286199.db2.gz RYPHUQACZWNDBN-UHFFFAOYSA-N 1 2 338.473 2.344 20 70 EEIDLO CCc1ccc(CNC(=O)C[N@@H+](C)C2(C(=O)OC)CCCC2)s1 ZINC000159418756 463286205 /nfs/dbraw/zinc/28/62/05/463286205.db2.gz RYPHUQACZWNDBN-UHFFFAOYSA-N 1 2 338.473 2.344 20 70 EEIDLO O=C(Nc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000159791866 463305347 /nfs/dbraw/zinc/30/53/47/463305347.db2.gz ASSRXUCQPLRYBN-AWEZNQCLSA-N 1 2 340.427 2.045 20 70 EEIDLO C[C@@H](c1ccc(F)cc1)N(C)C(=O)CSCC[NH+]1CCOCC1 ZINC000159786591 463305486 /nfs/dbraw/zinc/30/54/86/463305486.db2.gz KJMJMVOCAXWMES-AWEZNQCLSA-N 1 2 340.464 2.411 20 70 EEIDLO Cc1ccc(C(=O)CC[NH+]2CCN(C(=O)c3ccccn3)CC2)cc1 ZINC000160346038 463330613 /nfs/dbraw/zinc/33/06/13/463330613.db2.gz GDJKXKPFSNVKQM-UHFFFAOYSA-N 1 2 337.423 2.421 20 70 EEIDLO C[C@@H](CNC(=O)[C@H](C)SCC[NH+]1CCOCC1)c1ccccc1 ZINC000159833620 534020315 /nfs/dbraw/zinc/02/03/15/534020315.db2.gz ZVDREGRKUUJJMC-HOTGVXAUSA-N 1 2 336.501 2.360 20 70 EEIDLO COc1cc[nH+]cc1NC(=O)C(=O)NCC(C)(C)c1ccccc1F ZINC000159569167 143800113 /nfs/dbraw/zinc/80/01/13/143800113.db2.gz XIHBMUYFKGIIOU-UHFFFAOYSA-N 1 2 345.374 2.262 20 70 EEIDLO CO[C@@H]1CCC[C@H]1NC(=O)NCc1cc[nH+]c(N2CCCCC2)c1 ZINC000159853432 311347152 /nfs/dbraw/zinc/34/71/52/311347152.db2.gz HTOYOUSNRDATGL-HZPDHXFCSA-N 1 2 332.448 2.439 20 70 EEIDLO CCCOC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000159525351 463291829 /nfs/dbraw/zinc/29/18/29/463291829.db2.gz LBOFDFCEFLANBO-AWEZNQCLSA-N 1 2 333.432 2.382 20 70 EEIDLO Cc1ccc(C[NH+]2CCN(C(=O)COc3ccc(F)cc3)CC2)o1 ZINC000160601910 463353913 /nfs/dbraw/zinc/35/39/13/463353913.db2.gz NFTFIJRDIBGNDA-UHFFFAOYSA-N 1 2 332.375 2.450 20 70 EEIDLO O=C1[C@H]([NH+]2CCN(c3ccccc3)CC2)CCCN1CC(F)(F)F ZINC000160641563 463358032 /nfs/dbraw/zinc/35/80/32/463358032.db2.gz SXNOKLXILNAROI-OAHLLOKOSA-N 1 2 341.377 2.362 20 70 EEIDLO CC[C@H](O)CCNC(=O)N[C@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000160837904 463375157 /nfs/dbraw/zinc/37/51/57/463375157.db2.gz JZQPDEPPVUQMHF-GJZGRUSLSA-N 1 2 334.395 2.109 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)Nc1ccc(Cl)cc1 ZINC000161150461 463404713 /nfs/dbraw/zinc/40/47/13/463404713.db2.gz UOMUCUCDERPLHL-UHFFFAOYSA-N 1 2 344.846 2.491 20 70 EEIDLO CC(C)OCC[NH+]1CCN(C(=O)c2ccc(N(C)C)cc2F)CC1 ZINC000159688336 311344837 /nfs/dbraw/zinc/34/48/37/311344837.db2.gz SKHUERPNLRRXCE-UHFFFAOYSA-N 1 2 337.439 2.075 20 70 EEIDLO CC[C@H]1CCN(c2nc(NCCOC)nc(N3CC[C@H](CC)C3)[nH+]2)C1 ZINC000160801840 311358729 /nfs/dbraw/zinc/35/87/29/311358729.db2.gz CJRUMSJXHTVTPW-GJZGRUSLSA-N 1 2 348.495 2.403 20 70 EEIDLO CC[C@@H]1CCCCN1C(=O)[C@H](C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161177966 311363164 /nfs/dbraw/zinc/36/31/64/311363164.db2.gz TVBUQRUMXUVILM-PKOBYXMFSA-N 1 2 344.503 2.379 20 70 EEIDLO CC[C@@H]1CCCCN1C(=O)[C@H](C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161177966 311363165 /nfs/dbraw/zinc/36/31/65/311363165.db2.gz TVBUQRUMXUVILM-PKOBYXMFSA-N 1 2 344.503 2.379 20 70 EEIDLO COc1ccc([C@@H](NC(=O)c2cc(C)ncn2)c2[nH+]ccn2C)cc1 ZINC000161379323 311365234 /nfs/dbraw/zinc/36/52/34/311365234.db2.gz CLSPSJZGSNYKFW-MRXNPFEDSA-N 1 2 337.383 2.047 20 70 EEIDLO CCCNC(=O)c1cccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1 ZINC000159950125 463311109 /nfs/dbraw/zinc/31/11/09/463311109.db2.gz WTBXGLGEXULYNM-CQSZACIVSA-N 1 2 326.400 2.224 20 70 EEIDLO Cc1c(/C=C/C(=O)Nc2ccccc2C[NH+]2CCOCC2)cnn1C ZINC000160524080 463347032 /nfs/dbraw/zinc/34/70/32/463347032.db2.gz OTSAROZKCBEOJE-BQYQJAHWSA-N 1 2 340.427 2.213 20 70 EEIDLO COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000160741454 463366792 /nfs/dbraw/zinc/36/67/92/463366792.db2.gz FFOYZDRXPCEGCL-OAHLLOKOSA-N 1 2 340.383 2.269 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000161064092 463396477 /nfs/dbraw/zinc/39/64/77/463396477.db2.gz ZGROOJNBGQRJIZ-CYBMUJFWSA-N 1 2 326.400 2.030 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000161064092 463396479 /nfs/dbraw/zinc/39/64/79/463396479.db2.gz ZGROOJNBGQRJIZ-CYBMUJFWSA-N 1 2 326.400 2.030 20 70 EEIDLO CC[N@H+](CC(=O)N[C@H](C)Cc1ccccc1C)Cc1cnn(C)c1 ZINC000161130883 463401732 /nfs/dbraw/zinc/40/17/32/463401732.db2.gz CUBJAJGCPFWHKK-MRXNPFEDSA-N 1 2 328.460 2.298 20 70 EEIDLO CC[N@@H+](CC(=O)N[C@H](C)Cc1ccccc1C)Cc1cnn(C)c1 ZINC000161130883 463401736 /nfs/dbraw/zinc/40/17/36/463401736.db2.gz CUBJAJGCPFWHKK-MRXNPFEDSA-N 1 2 328.460 2.298 20 70 EEIDLO CC(C)c1ncc(C(=O)NC(C)(C)c2noc(C[NH+](C)C)n2)s1 ZINC000161365745 463425844 /nfs/dbraw/zinc/42/58/44/463425844.db2.gz FVNGTJAAOOGEAY-UHFFFAOYSA-N 1 2 337.449 2.376 20 70 EEIDLO Cc1c(CCC(=O)Nc2cccc(C[NH+]3CCOCC3)c2)cnn1C ZINC000159515476 539516992 /nfs/dbraw/zinc/51/69/92/539516992.db2.gz JRENHLKRUHFOJK-UHFFFAOYSA-N 1 2 342.443 2.132 20 70 EEIDLO COc1ccc(OC)c(CN2CC[NH+](Cc3c[nH]nc3C)CC2)c1 ZINC000161047213 532960215 /nfs/dbraw/zinc/96/02/15/532960215.db2.gz BGORGXCEQXFTOJ-UHFFFAOYSA-N 1 2 330.432 2.053 20 70 EEIDLO COc1ccc(OC)c(C[NH+]2CCN(Cc3c[nH]nc3C)CC2)c1 ZINC000161047213 532960224 /nfs/dbraw/zinc/96/02/24/532960224.db2.gz BGORGXCEQXFTOJ-UHFFFAOYSA-N 1 2 330.432 2.053 20 70 EEIDLO Cn1c(SCCn2cc[nH+]c2)nnc1[C@H]1COc2ccccc2O1 ZINC000159568870 311342968 /nfs/dbraw/zinc/34/29/68/311342968.db2.gz GJBMAWYMEPJOOA-CQSZACIVSA-N 1 2 343.412 2.316 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccc(C(C)=O)cc1 ZINC000161079388 311361760 /nfs/dbraw/zinc/36/17/60/311361760.db2.gz VAXWRCLLQJZSEH-CYBMUJFWSA-N 1 2 328.416 2.472 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccc(C(C)=O)cc1 ZINC000161079388 311361761 /nfs/dbraw/zinc/36/17/61/311361761.db2.gz VAXWRCLLQJZSEH-CYBMUJFWSA-N 1 2 328.416 2.472 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N[C@H](C)Cc2ccccc2C)CCCC1 ZINC000159482337 463288250 /nfs/dbraw/zinc/28/82/50/463288250.db2.gz KQVRZUFIHFUUHN-MRXNPFEDSA-N 1 2 346.471 2.460 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N[C@H](C)Cc2ccccc2C)CCCC1 ZINC000159482337 463288255 /nfs/dbraw/zinc/28/82/55/463288255.db2.gz KQVRZUFIHFUUHN-MRXNPFEDSA-N 1 2 346.471 2.460 20 70 EEIDLO CCCNC(=O)c1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160161198 463321019 /nfs/dbraw/zinc/32/10/19/463321019.db2.gz VJAXBVOOZSOTJR-AWEZNQCLSA-N 1 2 326.400 2.224 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000160483874 463342246 /nfs/dbraw/zinc/34/22/46/463342246.db2.gz FAQLUTJIPDAXND-MOPGFXCFSA-N 1 2 345.487 2.371 20 70 EEIDLO COC(=O)[C@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CCO1 ZINC000160513645 463345903 /nfs/dbraw/zinc/34/59/03/463345903.db2.gz NZPXUFIBNQXHBG-CYBMUJFWSA-N 1 2 334.199 2.246 20 70 EEIDLO COC(=O)[C@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CCO1 ZINC000160513645 463345905 /nfs/dbraw/zinc/34/59/05/463345905.db2.gz NZPXUFIBNQXHBG-CYBMUJFWSA-N 1 2 334.199 2.246 20 70 EEIDLO CC[N@H+](Cc1ccc(OC)c(OC(F)F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160562634 463350451 /nfs/dbraw/zinc/35/04/51/463350451.db2.gz SGOXIXXJAYQNJQ-LBPRGKRZSA-N 1 2 349.399 2.306 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC)c(OC(F)F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160562634 463350453 /nfs/dbraw/zinc/35/04/53/463350453.db2.gz SGOXIXXJAYQNJQ-LBPRGKRZSA-N 1 2 349.399 2.306 20 70 EEIDLO CCc1ncsc1C(=O)N[C@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000161003799 463389316 /nfs/dbraw/zinc/38/93/16/463389316.db2.gz NSRZQIDUYOGUJA-CYBMUJFWSA-N 1 2 337.489 2.469 20 70 EEIDLO O=C1[C@@H](SCC[NH+]2CCOCC2)CCN1c1c(F)cccc1F ZINC000159766209 534833812 /nfs/dbraw/zinc/83/38/12/534833812.db2.gz JATPNETVNWFAQE-AWEZNQCLSA-N 1 2 342.411 2.136 20 70 EEIDLO O=C(NCc1ccc(N2CCCC2)[nH+]c1)c1ccnc(-n2cccn2)c1 ZINC000159500537 225230210 /nfs/dbraw/zinc/23/02/10/225230210.db2.gz GJFMWIWFWQNJBE-UHFFFAOYSA-N 1 2 348.410 2.193 20 70 EEIDLO O=C(NCc1ccc(Cl)nc1)N1CC[NH+](Cc2ccccn2)CC1 ZINC000159405441 225211940 /nfs/dbraw/zinc/21/19/40/225211940.db2.gz QLQVPAWIUBYHIC-UHFFFAOYSA-N 1 2 345.834 2.157 20 70 EEIDLO COCCC1(C(=O)N2CC[NH+](Cc3ccccn3)CC2)CCCC1 ZINC000160188491 225357400 /nfs/dbraw/zinc/35/74/00/225357400.db2.gz LKLNAUKRCQTOIB-UHFFFAOYSA-N 1 2 331.460 2.323 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N1CCC[C@H]2CCCC[C@H]21 ZINC000159792468 311346034 /nfs/dbraw/zinc/34/60/34/311346034.db2.gz IJCQHFPDHXVQCZ-HZPDHXFCSA-N 1 2 326.506 2.233 20 70 EEIDLO O=C(NC1CC1)[C@@H](SCC[NH+]1CCOCC1)c1ccc(F)cc1 ZINC000159786834 311346130 /nfs/dbraw/zinc/34/61/30/311346130.db2.gz FWCYZCRVZOLFPS-INIZCTEOSA-N 1 2 338.448 2.211 20 70 EEIDLO CCOC(=O)NCCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000159875496 311347369 /nfs/dbraw/zinc/34/73/69/311347369.db2.gz OGKRIKRGXNSQQA-UHFFFAOYSA-N 1 2 334.351 2.476 20 70 EEIDLO Cc1nc2ccccn2c1C[N@@H+](C)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000160593697 463352777 /nfs/dbraw/zinc/35/27/77/463352777.db2.gz WIXLHHIOJLRQRR-HOCLYGCPSA-N 1 2 335.473 2.430 20 70 EEIDLO Cc1nc2ccccn2c1C[N@H+](C)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000160593697 463352781 /nfs/dbraw/zinc/35/27/81/463352781.db2.gz WIXLHHIOJLRQRR-HOCLYGCPSA-N 1 2 335.473 2.430 20 70 EEIDLO CC[N@H+](CC(=O)NCCCOc1cccc(C)c1)Cc1cnn(C)c1 ZINC000161128918 463402607 /nfs/dbraw/zinc/40/26/07/463402607.db2.gz YHMWITDSIOHMQS-UHFFFAOYSA-N 1 2 344.459 2.136 20 70 EEIDLO CC[N@@H+](CC(=O)NCCCOc1cccc(C)c1)Cc1cnn(C)c1 ZINC000161128918 463402613 /nfs/dbraw/zinc/40/26/13/463402613.db2.gz YHMWITDSIOHMQS-UHFFFAOYSA-N 1 2 344.459 2.136 20 70 EEIDLO CCCCn1ncc(C(=O)N2CC[NH+](Cc3ccncc3)CC2)c1C ZINC000161144565 463404809 /nfs/dbraw/zinc/40/48/09/463404809.db2.gz IWUPYTRILMFYBH-UHFFFAOYSA-N 1 2 341.459 2.345 20 70 EEIDLO O=C([C@H]1CCn2cc[nH+]c2C1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000161242189 463412911 /nfs/dbraw/zinc/41/29/11/463412911.db2.gz WMRALINOPZXONA-BBRMVZONSA-N 1 2 347.365 2.324 20 70 EEIDLO CCc1c(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)[nH]c(C)c1C(C)=O ZINC000161345701 463422999 /nfs/dbraw/zinc/42/29/99/463422999.db2.gz XMWIEFFUVSBFFS-AWEZNQCLSA-N 1 2 340.427 2.492 20 70 EEIDLO Cc1ccccc1CCNC(=O)[C@@H](C)SCC[NH+]1CCOCC1 ZINC000159979421 534809219 /nfs/dbraw/zinc/80/92/19/534809219.db2.gz DAHGZSSSCMRTAL-MRXNPFEDSA-N 1 2 336.501 2.108 20 70 EEIDLO C[C@@H](NC(=O)[C@@H](C)SCC[NH+]1CCOCC1)c1ccc(F)cc1 ZINC000159760267 533242111 /nfs/dbraw/zinc/24/21/11/533242111.db2.gz BSEBUSGMAPPYLT-ZIAGYGMSSA-N 1 2 340.464 2.457 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N(Cc1ccccc1)C1CC1 ZINC000159995642 225316673 /nfs/dbraw/zinc/31/66/73/225316673.db2.gz MIBDEZSODFOMCD-UHFFFAOYSA-N 1 2 334.485 2.243 20 70 EEIDLO CC(C)(CNC(=O)c1cc(F)c(Cl)cc1F)[NH+]1CCOCC1 ZINC000160330707 311352913 /nfs/dbraw/zinc/35/29/13/311352913.db2.gz IMZLKOOHQSRJGD-UHFFFAOYSA-N 1 2 332.778 2.459 20 70 EEIDLO CCCC[N@H+](Cc1c(CC)nn(C)c1CC)[C@@H]1CCS(=O)(=O)C1 ZINC000160795990 311358837 /nfs/dbraw/zinc/35/88/37/311358837.db2.gz JKQOBLFVDYOGMU-CQSZACIVSA-N 1 2 341.521 2.334 20 70 EEIDLO CCCC[N@@H+](Cc1c(CC)nn(C)c1CC)[C@@H]1CCS(=O)(=O)C1 ZINC000160795990 311358838 /nfs/dbraw/zinc/35/88/38/311358838.db2.gz JKQOBLFVDYOGMU-CQSZACIVSA-N 1 2 341.521 2.334 20 70 EEIDLO CCC[C@H](C)CS(=O)(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159476649 463289060 /nfs/dbraw/zinc/28/90/60/463289060.db2.gz NHFDTGXSAHBWMR-HNNXBMFYSA-N 1 2 334.526 2.043 20 70 EEIDLO CCCCn1ncc(C(=O)N2CCN(c3cccc[nH+]3)CC2)c1C ZINC000159586326 463294050 /nfs/dbraw/zinc/29/40/50/463294050.db2.gz OOHYJIPVAUESOM-UHFFFAOYSA-N 1 2 327.432 2.349 20 70 EEIDLO O=C(Nc1ccccc1C[NH+]1CCOCC1)N1CCOC2(CCC2)C1 ZINC000159624830 463296470 /nfs/dbraw/zinc/29/64/70/463296470.db2.gz JNCHAFJYHHNSQB-UHFFFAOYSA-N 1 2 345.443 2.306 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@H](C)C1CCOCC1 ZINC000160512527 463345933 /nfs/dbraw/zinc/34/59/33/463345933.db2.gz VNJPRDFEEXDSTC-CYBMUJFWSA-N 1 2 333.432 2.228 20 70 EEIDLO CC(=O)Nc1cc(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)ccc1C ZINC000161301563 539526180 /nfs/dbraw/zinc/52/61/80/539526180.db2.gz YRKHCWPAJRRXGI-INIZCTEOSA-N 1 2 338.411 2.357 20 70 EEIDLO C[C@@H]1C[NH+](CCCCNC(=O)c2cccc3nc[nH]c32)C[C@@H](C)O1 ZINC000159829183 225284753 /nfs/dbraw/zinc/28/47/53/225284753.db2.gz WQICATUOSGFUSV-ZIAGYGMSSA-N 1 2 330.432 2.182 20 70 EEIDLO Cc1cc(C)c(C(=O)N[C@H](C[NH+]2CCOCC2)c2ccccc2)[nH]1 ZINC000159721568 311344951 /nfs/dbraw/zinc/34/49/51/311344951.db2.gz VFIHAXJGICFSRG-QGZVFWFLSA-N 1 2 327.428 2.435 20 70 EEIDLO CC[C@@H]1CCN(c2nc(N3CC[C@H](CC)C3)nc(NCCOC)[nH+]2)C1 ZINC000160801717 311358622 /nfs/dbraw/zinc/35/86/22/311358622.db2.gz CJRUMSJXHTVTPW-GASCZTMLSA-N 1 2 348.495 2.403 20 70 EEIDLO CC[C@@H]1CCN(c2nc(NCCOC)[nH+]c(N3CC[C@H](CC)C3)n2)C1 ZINC000160801717 311358624 /nfs/dbraw/zinc/35/86/24/311358624.db2.gz CJRUMSJXHTVTPW-GASCZTMLSA-N 1 2 348.495 2.403 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000161114474 311362482 /nfs/dbraw/zinc/36/24/82/311362482.db2.gz CNTSDLRVTRKMPB-CYBMUJFWSA-N 1 2 346.431 2.286 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000161114474 311362485 /nfs/dbraw/zinc/36/24/85/311362485.db2.gz CNTSDLRVTRKMPB-CYBMUJFWSA-N 1 2 346.431 2.286 20 70 EEIDLO C[C@H](C(=O)NCc1ccccc1C[NH+]1CCOCC1)C1CCOCC1 ZINC000159728519 463301091 /nfs/dbraw/zinc/30/10/91/463301091.db2.gz TYTANUYWVQQJOP-INIZCTEOSA-N 1 2 346.471 2.198 20 70 EEIDLO CC[C@](C)([NH2+]Cc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000160658953 463359853 /nfs/dbraw/zinc/35/98/53/463359853.db2.gz UBEPJPDZXQKUPQ-ZDUSSCGKSA-N 1 2 325.210 2.069 20 70 EEIDLO NC(=O)[C@@H](c1cccc(Br)c1)[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000161027053 463393380 /nfs/dbraw/zinc/39/33/80/463393380.db2.gz HDMRQXRVCRQYNO-HIFRSBDPSA-N 1 2 339.233 2.088 20 70 EEIDLO NC(=O)[C@@H](c1cccc(Br)c1)[N@H+]1CC[C@]2(CCOC2)C1 ZINC000161027053 463393386 /nfs/dbraw/zinc/39/33/86/463393386.db2.gz HDMRQXRVCRQYNO-HIFRSBDPSA-N 1 2 339.233 2.088 20 70 EEIDLO CCCCn1ncc(C(=O)N2CC[NH+](Cc3cccnc3)CC2)c1C ZINC000161158489 463405936 /nfs/dbraw/zinc/40/59/36/463405936.db2.gz VMKULIRCFJXRIH-UHFFFAOYSA-N 1 2 341.459 2.345 20 70 EEIDLO CC(C)N(Cc1ccccc1)C(=O)CSCC[NH+]1CCOCC1 ZINC000159967012 528947287 /nfs/dbraw/zinc/94/72/87/528947287.db2.gz NMLXJMMVANOHSH-UHFFFAOYSA-N 1 2 336.501 2.489 20 70 EEIDLO O=C(NCc1cn2ccccc2[nH+]1)Nc1ccn(CC(F)(F)F)n1 ZINC000160426637 463336937 /nfs/dbraw/zinc/33/69/37/463336937.db2.gz KMDHYEWNZKIOMB-UHFFFAOYSA-N 1 2 338.293 2.415 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCC(NC(=O)c3ccccc3)CC2)n1 ZINC000160616992 463354693 /nfs/dbraw/zinc/35/46/93/463354693.db2.gz WKCMTOUTHVRKSH-UHFFFAOYSA-N 1 2 340.427 2.139 20 70 EEIDLO C[C@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)c1nccs1 ZINC000161244150 463412747 /nfs/dbraw/zinc/41/27/47/463412747.db2.gz LISKRLFLCMQDRP-CQSZACIVSA-N 1 2 345.472 2.169 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(F)cc1F ZINC000159973350 533993878 /nfs/dbraw/zinc/99/38/78/533993878.db2.gz ASDFSFSWEMJNAE-LLVKDONJSA-N 1 2 330.400 2.357 20 70 EEIDLO CC[N@H+](CCCNC(=O)C(=O)Nc1ccc(C)nc1)c1ccccc1 ZINC000159862392 528452394 /nfs/dbraw/zinc/45/23/94/528452394.db2.gz QKAROAMXQOISSV-UHFFFAOYSA-N 1 2 340.427 2.361 20 70 EEIDLO CC[N@@H+](CCCNC(=O)C(=O)Nc1ccc(C)nc1)c1ccccc1 ZINC000159862392 528452399 /nfs/dbraw/zinc/45/23/99/528452399.db2.gz QKAROAMXQOISSV-UHFFFAOYSA-N 1 2 340.427 2.361 20 70 EEIDLO CCCOC(=O)[C@@H](C)[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000160232090 528577741 /nfs/dbraw/zinc/57/77/41/528577741.db2.gz BQSIDGOPCPECHF-DOMZBBRYSA-N 1 2 337.395 2.363 20 70 EEIDLO CCCOC(=O)[C@@H](C)[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000160232090 528577746 /nfs/dbraw/zinc/57/77/46/528577746.db2.gz BQSIDGOPCPECHF-DOMZBBRYSA-N 1 2 337.395 2.363 20 70 EEIDLO Cc1cccn2cc(CCNC(=O)c3cccc4[nH]c(=O)oc43)[nH+]c12 ZINC000159880639 539518462 /nfs/dbraw/zinc/51/84/62/539518462.db2.gz IXRKTAGGHLFYLL-UHFFFAOYSA-N 1 2 336.351 2.050 20 70 EEIDLO CCn1cnnc1C[NH2+]Cc1cc(Br)ccc1OC ZINC000218228000 241308476 /nfs/dbraw/zinc/30/84/76/241308476.db2.gz TUVLNTMETBFBIK-UHFFFAOYSA-N 1 2 325.210 2.359 20 70 EEIDLO Cc1cc(C)c(C(=O)N[C@@H](C[NH+]2CCOCC2)c2ccccc2)[nH]1 ZINC000159721430 311345162 /nfs/dbraw/zinc/34/51/62/311345162.db2.gz VFIHAXJGICFSRG-KRWDZBQOSA-N 1 2 327.428 2.435 20 70 EEIDLO Cc1nc(CN2CCN(Cc3c[nH+]c4ccccn34)CC2)oc1C ZINC000159744877 463302580 /nfs/dbraw/zinc/30/25/80/463302580.db2.gz ABLXSIJHRNFJSA-UHFFFAOYSA-N 1 2 325.416 2.257 20 70 EEIDLO CN(Cc1[nH+]ccn1C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000160680017 463362318 /nfs/dbraw/zinc/36/23/18/463362318.db2.gz ITUXGDBJUIACRZ-HOTGVXAUSA-N 1 2 328.416 2.482 20 70 EEIDLO C[C@@H]1CCC[N@H+](Cc2csc(NC(=O)c3cccc(=O)n3C)n2)C1 ZINC000160820247 463373828 /nfs/dbraw/zinc/37/38/28/463373828.db2.gz CCWOZAHXCJGQJJ-GFCCVEGCSA-N 1 2 346.456 2.326 20 70 EEIDLO C[C@@H]1CCC[N@@H+](Cc2csc(NC(=O)c3cccc(=O)n3C)n2)C1 ZINC000160820247 463373833 /nfs/dbraw/zinc/37/38/33/463373833.db2.gz CCWOZAHXCJGQJJ-GFCCVEGCSA-N 1 2 346.456 2.326 20 70 EEIDLO O=C(Nc1ccc(-n2nccn2)cc1)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000160863734 463378737 /nfs/dbraw/zinc/37/87/37/463378737.db2.gz RQYPJQFYHLBBCG-OAHLLOKOSA-N 1 2 349.398 2.063 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@H+]3CCC[C@H](OC)C3)c2c1 ZINC000160882831 463379217 /nfs/dbraw/zinc/37/92/17/463379217.db2.gz ASXNQIYMUMTKJA-ZDUSSCGKSA-N 1 2 330.384 2.248 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@@H+]3CCC[C@H](OC)C3)c2c1 ZINC000160882831 463379221 /nfs/dbraw/zinc/37/92/21/463379221.db2.gz ASXNQIYMUMTKJA-ZDUSSCGKSA-N 1 2 330.384 2.248 20 70 EEIDLO CC(C)OCCCCNC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000161216708 463410808 /nfs/dbraw/zinc/41/08/08/463410808.db2.gz XCTMERYJCWOBBZ-UHFFFAOYSA-N 1 2 334.464 2.114 20 70 EEIDLO COc1ccc(COCCCNC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000161237479 463412683 /nfs/dbraw/zinc/41/26/83/463412683.db2.gz VHODKWGQKNMWSA-INIZCTEOSA-N 1 2 343.427 2.177 20 70 EEIDLO O=C(N[C@H]1CCN(c2cccc[nH+]2)C1)c1ccn(-c2ccccc2)n1 ZINC000161310789 463418506 /nfs/dbraw/zinc/41/85/06/463418506.db2.gz DIUMJTQLBVOVJZ-HNNXBMFYSA-N 1 2 333.395 2.276 20 70 EEIDLO CC(C)c1ccc(C(=O)N2CCN(C3=[NH+]C[C@H](C)S3)CC2)cn1 ZINC000159724418 528064142 /nfs/dbraw/zinc/06/41/42/528064142.db2.gz SCYDKVXTFRLZKD-ZDUSSCGKSA-N 1 2 332.473 2.454 20 70 EEIDLO CCCC[C@H](COC)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160306497 528962551 /nfs/dbraw/zinc/96/25/51/528962551.db2.gz UFGMVJQJESWDBM-QGZVFWFLSA-N 1 2 334.464 2.114 20 70 EEIDLO C[C@@]1(O)CCCN(C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)C1 ZINC000160120574 225341153 /nfs/dbraw/zinc/34/11/53/225341153.db2.gz YPMJUAOREKTBFX-GOSISDBHSA-N 1 2 332.448 2.128 20 70 EEIDLO Cn1nc(Br)c2c1nc[nH+]c2N[C@H]1CCOC(C)(C)C1 ZINC000160579624 279395408 /nfs/dbraw/zinc/39/54/08/279395408.db2.gz MFXPSDIVDDLHKT-QMMMGPOBSA-N 1 2 340.225 2.495 20 70 EEIDLO CC(C)N(C(=O)[C@@H](C)[NH+]1CCN(Cc2ccncc2)CC1)C(C)C ZINC000161230735 311363827 /nfs/dbraw/zinc/36/38/27/311363827.db2.gz XTNWIMJRBLIBLO-QGZVFWFLSA-N 1 2 332.492 2.233 20 70 EEIDLO CC(C)N(C(=O)[C@@H](C)N1CC[NH+](Cc2ccncc2)CC1)C(C)C ZINC000161230735 311363828 /nfs/dbraw/zinc/36/38/28/311363828.db2.gz XTNWIMJRBLIBLO-QGZVFWFLSA-N 1 2 332.492 2.233 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)NCCCc2ccccc2)CCCC1 ZINC000159436700 463285484 /nfs/dbraw/zinc/28/54/84/463285484.db2.gz NGASMCWCUBKCDR-UHFFFAOYSA-N 1 2 332.444 2.153 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)NCCCc2ccccc2)CCCC1 ZINC000159436700 463285491 /nfs/dbraw/zinc/28/54/91/463285491.db2.gz NGASMCWCUBKCDR-UHFFFAOYSA-N 1 2 332.444 2.153 20 70 EEIDLO O=C(c1cc2ccccc2[nH]1)N1CC[NH+](CCOCC2CC2)CC1 ZINC000160137502 463320268 /nfs/dbraw/zinc/32/02/68/463320268.db2.gz GFNRLFVPFSGXPN-UHFFFAOYSA-N 1 2 327.428 2.352 20 70 EEIDLO CCCNC(=O)c1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000160161081 463321236 /nfs/dbraw/zinc/32/12/36/463321236.db2.gz VJAXBVOOZSOTJR-CQSZACIVSA-N 1 2 326.400 2.224 20 70 EEIDLO COc1ccc(C[N@H+](CCO)Cc2cnc3ccccn23)c(OC)c1 ZINC000160361218 463332257 /nfs/dbraw/zinc/33/22/57/463332257.db2.gz ZXMINLSEYVSLEC-UHFFFAOYSA-N 1 2 341.411 2.346 20 70 EEIDLO COc1ccc(C[N@@H+](CCO)Cc2cnc3ccccn23)c(OC)c1 ZINC000160361218 463332261 /nfs/dbraw/zinc/33/22/61/463332261.db2.gz ZXMINLSEYVSLEC-UHFFFAOYSA-N 1 2 341.411 2.346 20 70 EEIDLO CNC(=O)COc1cccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000160624811 463356147 /nfs/dbraw/zinc/35/61/47/463356147.db2.gz WLMCBDWSTWSGDX-UHFFFAOYSA-N 1 2 341.411 2.313 20 70 EEIDLO Cn1cccc1C[N@H+](C)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000161246311 463412634 /nfs/dbraw/zinc/41/26/34/463412634.db2.gz LNTFORKPEWXWEE-CQSZACIVSA-N 1 2 336.233 2.446 20 70 EEIDLO Cn1cccc1C[N@@H+](C)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000161246311 463412637 /nfs/dbraw/zinc/41/26/37/463412637.db2.gz LNTFORKPEWXWEE-CQSZACIVSA-N 1 2 336.233 2.446 20 70 EEIDLO CC(=O)Nc1ccc(F)c(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000161291495 463417342 /nfs/dbraw/zinc/41/73/42/463417342.db2.gz RAHZGOHJGSOOTE-CQSZACIVSA-N 1 2 342.374 2.188 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)NO[C@@H]1CCCCO1 ZINC000161295872 463417465 /nfs/dbraw/zinc/41/74/65/463417465.db2.gz JDDYXJDVVDKUGP-MRXNPFEDSA-N 1 2 332.404 2.492 20 70 EEIDLO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCC(=O)c1ccccc1 ZINC000160276929 529846204 /nfs/dbraw/zinc/84/62/04/529846204.db2.gz QFLFWUMBMHVLRS-UHFFFAOYSA-N 1 2 346.471 2.466 20 70 EEIDLO Cc1cc(F)c(C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)cc1F ZINC000160793700 539524010 /nfs/dbraw/zinc/52/40/10/539524010.db2.gz NGZKYCIFUIRHHT-INIZCTEOSA-N 1 2 326.387 2.360 20 70 EEIDLO C[C@@H](C(=O)N1CC[NH+](CCOc2ccccc2)CC1)C1CCOCC1 ZINC000159505884 311342203 /nfs/dbraw/zinc/34/22/03/311342203.db2.gz CQZNPDXWIMUBPC-QGZVFWFLSA-N 1 2 346.471 2.272 20 70 EEIDLO CCCCCNC(=O)C1CC[NH+](Cc2nc(CC)cc(=O)[nH]2)CC1 ZINC000160842802 311359316 /nfs/dbraw/zinc/35/93/16/311359316.db2.gz TVOLXINYVWQZGT-UHFFFAOYSA-N 1 2 334.464 2.263 20 70 EEIDLO COc1ccc([C@H](NC(=O)[C@H]2CCCCO2)c2[nH+]ccn2C)cc1 ZINC000160336523 463329805 /nfs/dbraw/zinc/32/98/05/463329805.db2.gz NWFORKACKWHFAC-CVEARBPZSA-N 1 2 329.400 2.203 20 70 EEIDLO CCOC[C@@H]1CC[N@@H+]([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000160497780 463344031 /nfs/dbraw/zinc/34/40/31/463344031.db2.gz KVLZVKVOSGCGHO-RISCZKNCSA-N 1 2 341.249 2.334 20 70 EEIDLO CCOC[C@@H]1CC[N@H+]([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000160497780 463344034 /nfs/dbraw/zinc/34/40/34/463344034.db2.gz KVLZVKVOSGCGHO-RISCZKNCSA-N 1 2 341.249 2.334 20 70 EEIDLO O=C1CN(Cc2c[nH+]c3ccccn23)CCN1Cc1cccc(F)c1 ZINC000160603797 463353621 /nfs/dbraw/zinc/35/36/21/463353621.db2.gz QVGWVDZRDHFOPG-UHFFFAOYSA-N 1 2 338.386 2.318 20 70 EEIDLO COc1ccc2nc(C)cc(C(=O)N[C@H](C)C[NH+]3CCOCC3)c2c1 ZINC000160597156 463354031 /nfs/dbraw/zinc/35/40/31/463354031.db2.gz BCQQXILBZODLLW-CQSZACIVSA-N 1 2 343.427 2.002 20 70 EEIDLO CCOC(=O)[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160678382 463361732 /nfs/dbraw/zinc/36/17/32/463361732.db2.gz NFOPBBSLXYAMKQ-HNNXBMFYSA-N 1 2 328.416 2.257 20 70 EEIDLO CCOC(=O)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160678382 463361736 /nfs/dbraw/zinc/36/17/36/463361736.db2.gz NFOPBBSLXYAMKQ-HNNXBMFYSA-N 1 2 328.416 2.257 20 70 EEIDLO C[C@H](C(=O)N[C@H]1CCCC[C@@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161186114 463408339 /nfs/dbraw/zinc/40/83/39/463408339.db2.gz MMFXIWPLFSHLOD-SCTDSRPQSA-N 1 2 344.503 2.283 20 70 EEIDLO C[C@H](C(=O)N[C@H]1CCCC[C@@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161186114 463408342 /nfs/dbraw/zinc/40/83/42/463408342.db2.gz MMFXIWPLFSHLOD-SCTDSRPQSA-N 1 2 344.503 2.283 20 70 EEIDLO C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161197060 463409643 /nfs/dbraw/zinc/40/96/43/463409643.db2.gz QDVKWLWAFLODDP-OAHLLOKOSA-N 1 2 349.438 2.197 20 70 EEIDLO CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)[C@@H]2CSC[NH2+]2)c1 ZINC000159832956 526601036 /nfs/dbraw/zinc/60/10/36/526601036.db2.gz QAJGAYDEASDREU-ZDUSSCGKSA-N 1 2 342.486 2.001 20 70 EEIDLO CC1CCN(c2ccc(CNC(=O)N3CCC[C@@](C)(O)C3)c[nH+]2)CC1 ZINC000160218772 528265277 /nfs/dbraw/zinc/26/52/77/528265277.db2.gz DATBCOCHFVBVGT-LJQANCHMSA-N 1 2 346.475 2.374 20 70 EEIDLO C[C@H](CNC(=O)[C@H](C)SCC[NH+]1CCOCC1)c1ccccc1 ZINC000159833757 225286167 /nfs/dbraw/zinc/28/61/67/225286167.db2.gz ZVDREGRKUUJJMC-CVEARBPZSA-N 1 2 336.501 2.360 20 70 EEIDLO C[C@H](NC(=O)CN1CC[NH+](Cc2ccncc2)CC1)c1cccs1 ZINC000161240591 225580501 /nfs/dbraw/zinc/58/05/01/225580501.db2.gz ZTOJRTJDZXSYJC-HNNXBMFYSA-N 1 2 344.484 2.138 20 70 EEIDLO CCc1ccc(S(=O)(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc1 ZINC000159381868 463283165 /nfs/dbraw/zinc/28/31/65/463283165.db2.gz KQESWBXXDHKZLP-HNNXBMFYSA-N 1 2 331.441 2.201 20 70 EEIDLO O=C(CCCc1nc(C2CC2)no1)NCCc1cn2c([nH+]1)CCCC2 ZINC000159552658 463292692 /nfs/dbraw/zinc/29/26/92/463292692.db2.gz FZOVOMUPWNHVJW-UHFFFAOYSA-N 1 2 343.431 2.161 20 70 EEIDLO COCCCOc1ccccc1NC(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000160361287 463331309 /nfs/dbraw/zinc/33/13/09/463331309.db2.gz DASDJDNQCQMZAW-CQSZACIVSA-N 1 2 329.400 2.500 20 70 EEIDLO CN(CC[NH+]1CCOCC1)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000160484113 463343157 /nfs/dbraw/zinc/34/31/57/463343157.db2.gz FAQLUTJIPDAXND-OALUTQOASA-N 1 2 345.487 2.371 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCC(NC(=O)c3ccsc3)CC2)n1 ZINC000160999895 463389625 /nfs/dbraw/zinc/38/96/25/463389625.db2.gz HGNDBHPGKLLXSE-UHFFFAOYSA-N 1 2 346.456 2.201 20 70 EEIDLO O=C([C@H]1CCn2cc[nH+]c2C1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000161242324 463412436 /nfs/dbraw/zinc/41/24/36/463412436.db2.gz WMRALINOPZXONA-XJKSGUPXSA-N 1 2 347.365 2.324 20 70 EEIDLO COC(=O)CC[C@@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000161457787 463431930 /nfs/dbraw/zinc/43/19/30/463431930.db2.gz AFHBLUYDWKRHOA-JKSUJKDBSA-N 1 2 341.411 2.256 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@H+](CC)C[C@H]2COc3ccccc3O2)n1 ZINC000160529180 311355246 /nfs/dbraw/zinc/35/52/46/311355246.db2.gz XXRRBDRXOHEULC-AWEZNQCLSA-N 1 2 329.400 2.407 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@@H+](CC)C[C@H]2COc3ccccc3O2)n1 ZINC000160529180 311355248 /nfs/dbraw/zinc/35/52/48/311355248.db2.gz XXRRBDRXOHEULC-AWEZNQCLSA-N 1 2 329.400 2.407 20 70 EEIDLO C[C@H](C(=O)N1CCCC1)[NH+]1CCN(C(=O)C2CCC(C)(C)CC2)CC1 ZINC000161143070 311362848 /nfs/dbraw/zinc/36/28/48/311362848.db2.gz HWLQMOQDIKLCKL-MRXNPFEDSA-N 1 2 349.519 2.358 20 70 EEIDLO CC[N@H+](Cc1ccc(OC)c(OC(F)F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160562503 463350343 /nfs/dbraw/zinc/35/03/43/463350343.db2.gz SGOXIXXJAYQNJQ-GFCCVEGCSA-N 1 2 349.399 2.306 20 70 EEIDLO CC[N@@H+](Cc1ccc(OC)c(OC(F)F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160562503 463350347 /nfs/dbraw/zinc/35/03/47/463350347.db2.gz SGOXIXXJAYQNJQ-GFCCVEGCSA-N 1 2 349.399 2.306 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1cccc(C(=O)NC)c1 ZINC000161168770 463406327 /nfs/dbraw/zinc/40/63/27/463406327.db2.gz XHEBNNMMBXWIKO-AWEZNQCLSA-N 1 2 340.427 2.290 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1cccc(C(=O)NC)c1 ZINC000161168770 463406332 /nfs/dbraw/zinc/40/63/32/463406332.db2.gz XHEBNNMMBXWIKO-AWEZNQCLSA-N 1 2 340.427 2.290 20 70 EEIDLO CC(C)[C@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1nc(C2CC2)no1 ZINC000161309220 463417648 /nfs/dbraw/zinc/41/76/48/463417648.db2.gz RSKATIFENFJSNB-OCCSQVGLSA-N 1 2 329.404 2.219 20 70 EEIDLO CCCN(C(=O)c1cccs1)C1CC[NH+](Cc2ncnn2C)CC1 ZINC000159780357 527792722 /nfs/dbraw/zinc/79/27/22/527792722.db2.gz MQEONGFDCKYNEX-UHFFFAOYSA-N 1 2 347.488 2.393 20 70 EEIDLO CCN(Cc1cccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1)C(C)=O ZINC000159771620 528814689 /nfs/dbraw/zinc/81/46/89/528814689.db2.gz KXYOYIJWSXHFNM-MRXNPFEDSA-N 1 2 340.427 2.453 20 70 EEIDLO O=C(N[C@H]1CCN(c2ccc(F)cc2F)C1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161473946 539528494 /nfs/dbraw/zinc/52/84/94/539528494.db2.gz WPGIFKCTRONZFT-OCCSQVGLSA-N 1 2 346.381 2.119 20 70 EEIDLO CSCC[NH+]1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1 ZINC000216825914 160216552 /nfs/dbraw/zinc/21/65/52/160216552.db2.gz HPAIRTFYMQXAJK-UHFFFAOYSA-N 1 2 342.530 2.479 20 70 EEIDLO C[C@H](c1cccnc1)[NH+]1CCN(C(=O)c2cccc3nc[nH]c32)CC1 ZINC000159554039 225238539 /nfs/dbraw/zinc/23/85/39/225238539.db2.gz RQNBEAPDGKASFJ-CQSZACIVSA-N 1 2 335.411 2.477 20 70 EEIDLO Cn1cnnc1C[N@H+](C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000160818132 311358874 /nfs/dbraw/zinc/35/88/74/311358874.db2.gz SNBGMEAMRVHNHP-UHFFFAOYSA-N 1 2 342.422 2.419 20 70 EEIDLO Cn1cnnc1C[N@@H+](C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000160818132 311358876 /nfs/dbraw/zinc/35/88/76/311358876.db2.gz SNBGMEAMRVHNHP-UHFFFAOYSA-N 1 2 342.422 2.419 20 70 EEIDLO CC(C)S(=O)(=O)CCCN1CC[NH+](Cc2cccs2)CC1 ZINC000160561255 463350484 /nfs/dbraw/zinc/35/04/84/463350484.db2.gz ABALCONLLGRDIK-UHFFFAOYSA-N 1 2 330.519 2.079 20 70 EEIDLO O=C([C@@H]1CCn2cc[nH+]c2C1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000160752351 463368298 /nfs/dbraw/zinc/36/82/98/463368298.db2.gz QCBJERMPIGJGPL-CQSZACIVSA-N 1 2 344.846 2.448 20 70 EEIDLO CC[C@H](O)CN(Cc1ccccc1)C(=O)NCCCn1cc[nH+]c1 ZINC000161086359 463398870 /nfs/dbraw/zinc/39/88/70/463398870.db2.gz CIXRFBQNQSUEPF-KRWDZBQOSA-N 1 2 330.432 2.256 20 70 EEIDLO C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161186243 463408251 /nfs/dbraw/zinc/40/82/51/463408251.db2.gz MMFXIWPLFSHLOD-ZHALLVOQSA-N 1 2 344.503 2.283 20 70 EEIDLO C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161186243 463408255 /nfs/dbraw/zinc/40/82/55/463408255.db2.gz MMFXIWPLFSHLOD-ZHALLVOQSA-N 1 2 344.503 2.283 20 70 EEIDLO CC(C)[C@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1nc(C2CC2)no1 ZINC000161309458 529106202 /nfs/dbraw/zinc/10/62/02/529106202.db2.gz RSKATIFENFJSNB-JSGCOSHPSA-N 1 2 329.404 2.219 20 70 EEIDLO O=C(CSCC[NH+]1CCOCC1)N[C@@H](c1ccccc1)C1CC1 ZINC000159977966 225312904 /nfs/dbraw/zinc/31/29/04/225312904.db2.gz GGEPPTPTSSHNDY-SFHVURJKSA-N 1 2 334.485 2.319 20 70 EEIDLO Cn1cc[nH+]c1-c1cccc(NC(=O)N2CCC[C@H](CC(N)=O)C2)c1 ZINC000159559175 225240200 /nfs/dbraw/zinc/24/02/00/225240200.db2.gz ZKVXADNLESZALE-CYBMUJFWSA-N 1 2 341.415 2.206 20 70 EEIDLO Cc1nc(NC(=O)[C@H](C)SCC[NH+]2CCOCC2)sc1C ZINC000160055752 225328631 /nfs/dbraw/zinc/32/86/31/225328631.db2.gz KIHKPMMRXLTEJS-LBPRGKRZSA-N 1 2 329.491 2.152 20 70 EEIDLO C[C@@]([NH2+]Cc1cnc2ccccn12)(C(N)=O)c1cccc(Cl)c1 ZINC000160977056 311360510 /nfs/dbraw/zinc/36/05/10/311360510.db2.gz FFDWXWXHEDYFSW-KRWDZBQOSA-N 1 2 328.803 2.478 20 70 EEIDLO CCCNC(=O)c1cccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1 ZINC000159950252 463311840 /nfs/dbraw/zinc/31/18/40/463311840.db2.gz WTBXGLGEXULYNM-AWEZNQCLSA-N 1 2 326.400 2.224 20 70 EEIDLO CSc1nc2ncn(Cc3[nH+]cc(Cl)n3C)c(=O)c2s1 ZINC000160321059 463328148 /nfs/dbraw/zinc/32/81/48/463328148.db2.gz NJESGNXVUNQUHC-UHFFFAOYSA-N 1 2 327.822 2.010 20 70 EEIDLO Cc1c([C@@H](C)[NH2+]CC(=O)NC(C)C)nnn1-c1cccc(Cl)c1 ZINC000160906212 463381453 /nfs/dbraw/zinc/38/14/53/463381453.db2.gz DKEMYQYXYPATFF-LLVKDONJSA-N 1 2 335.839 2.404 20 70 EEIDLO CC(C)(CO)[C@@H](CNC(=O)NCCCn1cc[nH+]c1)c1ccccc1 ZINC000160968495 463386186 /nfs/dbraw/zinc/38/61/86/463386186.db2.gz DUBJSVGGVXECAC-KRWDZBQOSA-N 1 2 344.459 2.375 20 70 EEIDLO Cn1cc[nH+]c1CS(=O)(=O)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000161171253 463407160 /nfs/dbraw/zinc/40/71/60/463407160.db2.gz LCTSPLSHVSMYGG-UHFFFAOYSA-N 1 2 335.360 2.329 20 70 EEIDLO O=C1[C@H](SCC[NH+]2CCOCC2)CCCN1c1cccc(F)c1 ZINC000159998813 206274512 /nfs/dbraw/zinc/27/45/12/206274512.db2.gz UIWUDZMKXVSUFY-MRXNPFEDSA-N 1 2 338.448 2.387 20 70 EEIDLO C[C@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)c1cccs1 ZINC000160063465 206277372 /nfs/dbraw/zinc/27/73/72/206277372.db2.gz NJDVJBHRKDCWFE-HNNXBMFYSA-N 1 2 349.500 2.008 20 70 EEIDLO C[C@H](C(=O)N1CCC[N@H+](CC(=O)N2CCCC2)CC1)c1cccs1 ZINC000160063465 206277370 /nfs/dbraw/zinc/27/73/70/206277370.db2.gz NJDVJBHRKDCWFE-HNNXBMFYSA-N 1 2 349.500 2.008 20 70 EEIDLO Cc1nc(CC(=O)N2CC[NH+](Cc3ccccn3)CC2)c(C)s1 ZINC000160092787 206278908 /nfs/dbraw/zinc/27/89/08/206278908.db2.gz GQQCKQIPNYXDDG-UHFFFAOYSA-N 1 2 330.457 2.042 20 70 EEIDLO CCn1nccc1C[N@H+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1 ZINC000160214652 206284693 /nfs/dbraw/zinc/28/46/93/206284693.db2.gz LANYFYJYKJHAPF-UHFFFAOYSA-N 1 2 343.431 2.322 20 70 EEIDLO CCn1nccc1C[N@@H+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1 ZINC000160214652 206284698 /nfs/dbraw/zinc/28/46/98/206284698.db2.gz LANYFYJYKJHAPF-UHFFFAOYSA-N 1 2 343.431 2.322 20 70 EEIDLO O=C([C@@H]1CCCO1)N1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000160993070 206322247 /nfs/dbraw/zinc/32/22/47/206322247.db2.gz STGNFMFGJDYADS-SFHVURJKSA-N 1 2 325.412 2.058 20 70 EEIDLO CCC[C@@H]1C(=O)NCCN1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000161215458 206335371 /nfs/dbraw/zinc/33/53/71/206335371.db2.gz HDZSPYWHKDKDOH-OAHLLOKOSA-N 1 2 341.415 2.220 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@@H]3OCC[N@@H+](C)[C@H]3C2)c(C)c1C ZINC000160695757 255800359 /nfs/dbraw/zinc/80/03/59/255800359.db2.gz DWVUSERKTVBYSA-OALUTQOASA-N 1 2 345.487 2.453 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@@H]3OCC[N@H+](C)[C@H]3C2)c(C)c1C ZINC000160695757 255800360 /nfs/dbraw/zinc/80/03/60/255800360.db2.gz DWVUSERKTVBYSA-OALUTQOASA-N 1 2 345.487 2.453 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N[C@@H]2CCOc3ccccc32)CCCC1 ZINC000159451423 277050067 /nfs/dbraw/zinc/05/00/67/277050067.db2.gz SKBIKDXRIYRDMF-OAHLLOKOSA-N 1 2 346.427 2.044 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N[C@@H]2CCOc3ccccc32)CCCC1 ZINC000159451423 277050069 /nfs/dbraw/zinc/05/00/69/277050069.db2.gz SKBIKDXRIYRDMF-OAHLLOKOSA-N 1 2 346.427 2.044 20 70 EEIDLO CC[N@H+](CC(=O)N1CCCc2cc(OC)ccc21)Cc1cnn(C)c1 ZINC000161108892 311362149 /nfs/dbraw/zinc/36/21/49/311362149.db2.gz HECUFJRUTLIBRX-UHFFFAOYSA-N 1 2 342.443 2.230 20 70 EEIDLO CC[N@@H+](CC(=O)N1CCCc2cc(OC)ccc21)Cc1cnn(C)c1 ZINC000161108892 311362151 /nfs/dbraw/zinc/36/21/51/311362151.db2.gz HECUFJRUTLIBRX-UHFFFAOYSA-N 1 2 342.443 2.230 20 70 EEIDLO C[C@H](c1ccc(F)cc1)N(C)C(=O)CSCC[NH+]1CCOCC1 ZINC000159786702 463305531 /nfs/dbraw/zinc/30/55/31/463305531.db2.gz KJMJMVOCAXWMES-CQSZACIVSA-N 1 2 340.464 2.411 20 70 EEIDLO C[C@H](C[NH+]1CCOCC1)NC(=O)Cc1c[nH]c2ccc(Cl)cc12 ZINC000159905695 463310766 /nfs/dbraw/zinc/31/07/66/463310766.db2.gz LGLPUGCDSGRFTB-GFCCVEGCSA-N 1 2 335.835 2.201 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N[C@@H](C)[C@@H](C)[NH+]2CCOCC2)n1 ZINC000160485867 463343358 /nfs/dbraw/zinc/34/33/58/463343358.db2.gz PYPWTVBGEJCTCS-LSDHHAIUSA-N 1 2 337.468 2.160 20 70 EEIDLO CC(C)c1ccccc1NC(=O)CS(=O)(=O)Cc1[nH+]ccn1C ZINC000161184761 463407751 /nfs/dbraw/zinc/40/77/51/463407751.db2.gz INUKNTWMCLAFOM-UHFFFAOYSA-N 1 2 335.429 2.097 20 70 EEIDLO CS(=O)(=O)CCCC[NH+]1CCN(Cc2cccc(Cl)c2)CC1 ZINC000161219107 539526134 /nfs/dbraw/zinc/52/61/34/539526134.db2.gz AEZJGJNHNQQADM-UHFFFAOYSA-N 1 2 344.908 2.282 20 70 EEIDLO O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc(-n2cc[nH+]c2)nc1 ZINC000159726363 206260899 /nfs/dbraw/zinc/26/08/99/206260899.db2.gz HIBKLZLQQGQWMC-OAHLLOKOSA-N 1 2 326.400 2.489 20 70 EEIDLO COc1cc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc(OC)c1 ZINC000159923121 206270571 /nfs/dbraw/zinc/27/05/71/206270571.db2.gz SYNINPHWXIGGKL-CYBMUJFWSA-N 1 2 342.399 2.499 20 70 EEIDLO CC(=O)c1cccc(NC(=O)[C@H](C)SCC[NH+]2CCOCC2)c1 ZINC000159974019 206273224 /nfs/dbraw/zinc/27/32/24/206273224.db2.gz ZLRJMWSXTLMWMT-AWEZNQCLSA-N 1 2 336.457 2.282 20 70 EEIDLO C[C@@H]1CN(c2ccc(CNC(=O)N3CCC4(CCC4)C3)c[nH+]2)CCO1 ZINC000160077264 206278002 /nfs/dbraw/zinc/27/80/02/206278002.db2.gz VFFGAPAPRMGCRX-OAHLLOKOSA-N 1 2 344.459 2.392 20 70 EEIDLO O=C(COc1ccccc1Br)NCCCn1cc[nH+]c1 ZINC000161360108 206342962 /nfs/dbraw/zinc/34/29/62/206342962.db2.gz IKCJBJBENDCMMT-UHFFFAOYSA-N 1 2 338.205 2.231 20 70 EEIDLO CN(C(=O)Nc1ccccc1C[NH+]1CCOCC1)[C@H]1CCSC1 ZINC000161434175 206347536 /nfs/dbraw/zinc/34/75/36/206347536.db2.gz DZJZDDVAKQJPCR-HNNXBMFYSA-N 1 2 335.473 2.488 20 70 EEIDLO O=C(NCCCOC1CCCC1)N1CC[NH+](Cc2ccccn2)CC1 ZINC000159824118 311346500 /nfs/dbraw/zinc/34/65/00/311346500.db2.gz ONUOWOYGSARPCW-UHFFFAOYSA-N 1 2 346.475 2.258 20 70 EEIDLO CC(C)[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCCC[C@H]1C ZINC000160020742 311349194 /nfs/dbraw/zinc/34/91/94/311349194.db2.gz BHVDTDLJUNSOCK-CVEARBPZSA-N 1 2 328.522 2.477 20 70 EEIDLO C[C@@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159385493 463282920 /nfs/dbraw/zinc/28/29/20/463282920.db2.gz LUXBCLJEGLVIPM-HNAYVOBHSA-N 1 2 348.491 2.147 20 70 EEIDLO C[C@@H](C(=O)N(C)C1CCCCC1)[N@H+]1CCO[C@@](C)(c2cnn(C)c2)C1 ZINC000159385493 463282926 /nfs/dbraw/zinc/28/29/26/463282926.db2.gz LUXBCLJEGLVIPM-HNAYVOBHSA-N 1 2 348.491 2.147 20 70 EEIDLO CCC[C@@H](C)CS(=O)(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159476517 463289136 /nfs/dbraw/zinc/28/91/36/463289136.db2.gz NHFDTGXSAHBWMR-OAHLLOKOSA-N 1 2 334.526 2.043 20 70 EEIDLO CC(=O)NC1CC[NH+]([C@@H](C)c2nc(Cc3ccccc3)no2)CC1 ZINC000159872588 463309490 /nfs/dbraw/zinc/30/94/90/463309490.db2.gz FUDBPCZFRCAJFE-ZDUSSCGKSA-N 1 2 328.416 2.322 20 70 EEIDLO C[C@@H](C[NH+]1CCOCC1)NC(=O)Cc1c[nH]c2ccc(Cl)cc12 ZINC000159905539 463310196 /nfs/dbraw/zinc/31/01/96/463310196.db2.gz LGLPUGCDSGRFTB-LBPRGKRZSA-N 1 2 335.835 2.201 20 70 EEIDLO Cc1ncsc1-c1nc(CSCC[NH+]2CCOCC2)no1 ZINC000160001684 463314348 /nfs/dbraw/zinc/31/43/48/463314348.db2.gz VFIUSXQYJFYFRN-UHFFFAOYSA-N 1 2 326.447 2.067 20 70 EEIDLO CO[C@H](C)C(=O)Nc1cccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1 ZINC000160588184 463352857 /nfs/dbraw/zinc/35/28/57/463352857.db2.gz DUCXGCMULTXBMP-OLZOCXBDSA-N 1 2 342.399 2.058 20 70 EEIDLO CCCC[N@H+](Cc1ccccc1C(=O)OC)[C@H]1CCS(=O)(=O)C1 ZINC000160752521 463368179 /nfs/dbraw/zinc/36/81/79/463368179.db2.gz PITBGDBQKADWOC-HNNXBMFYSA-N 1 2 339.457 2.262 20 70 EEIDLO CCCC[N@@H+](Cc1ccccc1C(=O)OC)[C@H]1CCS(=O)(=O)C1 ZINC000160752521 463368183 /nfs/dbraw/zinc/36/81/83/463368183.db2.gz PITBGDBQKADWOC-HNNXBMFYSA-N 1 2 339.457 2.262 20 70 EEIDLO CC(C)[NH+]1CCN(C(=O)c2ccc(Br)c(O)c2)CC1 ZINC000159797160 529040328 /nfs/dbraw/zinc/04/03/28/529040328.db2.gz HDASDEFCJYDPNI-UHFFFAOYSA-N 1 2 327.222 2.321 20 70 EEIDLO Cc1nccc(NC(=O)N[C@@H](C)[C@@H](C)[NH+]2CCOCC2)c1Cl ZINC000159726202 539518127 /nfs/dbraw/zinc/51/81/27/539518127.db2.gz HIOQUWQGDBWFRA-CMPLNLGQSA-N 1 2 326.828 2.274 20 70 EEIDLO CC(C)(CNC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccc2c(c1)OCO2 ZINC000161004688 539524318 /nfs/dbraw/zinc/52/43/18/539524318.db2.gz ZOQWGPJUHCTXCK-ZDUSSCGKSA-N 1 2 341.411 2.268 20 70 EEIDLO O=C(Nc1ccc2c(c1)OCO2)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000159682691 206257749 /nfs/dbraw/zinc/25/77/49/206257749.db2.gz FUPSFEDHWSPOQK-ZDUSSCGKSA-N 1 2 326.356 2.211 20 70 EEIDLO CN(C[C@H]1CCC[C@H]1O)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000159934910 206271135 /nfs/dbraw/zinc/27/11/35/206271135.db2.gz HKISLIHCTWGJNF-NVXWUHKLSA-N 1 2 328.416 2.175 20 70 EEIDLO CCC(=O)Nc1cccc(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000161301196 206340759 /nfs/dbraw/zinc/34/07/59/206340759.db2.gz WSJWJZMSWUIWLH-MRXNPFEDSA-N 1 2 338.411 2.439 20 70 EEIDLO COc1ccc([C@@H]2CCN(C(=O)[C@@H]3CCn4cc[nH+]c4C3)C2)cc1 ZINC000161097752 463399711 /nfs/dbraw/zinc/39/97/11/463399711.db2.gz UHFMNFSSYURIAW-HZPDHXFCSA-N 1 2 325.412 2.470 20 70 EEIDLO CC(C)n1cc[nH+]c1CS(=O)(=O)CC(=O)N[C@H]1CCCC[C@H]1C ZINC000161215007 463410290 /nfs/dbraw/zinc/41/02/90/463410290.db2.gz QZKCIZBPRQBFNK-KGLIPLIRSA-N 1 2 341.477 2.074 20 70 EEIDLO NC(=O)[C@H]1C[N@H+](CCOc2ccc(Oc3ccccc3)cc2)CCO1 ZINC000159898412 206270240 /nfs/dbraw/zinc/27/02/40/206270240.db2.gz PIPSWMIMMHPNNG-GOSISDBHSA-N 1 2 342.395 2.044 20 70 EEIDLO NC(=O)[C@H]1C[N@@H+](CCOc2ccc(Oc3ccccc3)cc2)CCO1 ZINC000159898412 206270243 /nfs/dbraw/zinc/27/02/43/206270243.db2.gz PIPSWMIMMHPNNG-GOSISDBHSA-N 1 2 342.395 2.044 20 70 EEIDLO C[C@H](SCC[NH+]1CCOCC1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000159965737 206273304 /nfs/dbraw/zinc/27/33/04/206273304.db2.gz MVLATZXQBCWBES-GJZGRUSLSA-N 1 2 334.485 2.418 20 70 EEIDLO Cc1cccc([C@@H](CNC(=O)c2cccc(F)n2)[NH+]2CCOCC2)c1 ZINC000160027708 206276113 /nfs/dbraw/zinc/27/61/13/206276113.db2.gz YBSXNQQXUFLOSL-QGZVFWFLSA-N 1 2 343.402 2.332 20 70 EEIDLO CCc1nnc(C[NH2+][C@@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)[nH]1 ZINC000160473967 206298711 /nfs/dbraw/zinc/29/87/11/206298711.db2.gz YOTZBWBNTQOGAS-GXFFZTMASA-N 1 2 329.404 2.327 20 70 EEIDLO CCOCCC1(C(=O)N2CC[NH+](Cc3ccncc3)CC2)CCC1 ZINC000160749252 206311765 /nfs/dbraw/zinc/31/17/65/206311765.db2.gz DVHCUGXVYVAJAZ-UHFFFAOYSA-N 1 2 331.460 2.323 20 70 EEIDLO COCC(C)(C)C(=O)N1CCN(c2cc(C)[nH+]c(C(C)C)n2)CC1 ZINC000160908589 206318024 /nfs/dbraw/zinc/31/80/24/206318024.db2.gz NSCSJLQVMZUXMF-UHFFFAOYSA-N 1 2 334.464 2.230 20 70 EEIDLO CCCC[N@H+](Cc1c[nH]nc1C(C)(C)C)[C@@H]1CCS(=O)(=O)C1 ZINC000160783035 311358362 /nfs/dbraw/zinc/35/83/62/311358362.db2.gz VLMJNJKFLXLEDL-CQSZACIVSA-N 1 2 327.494 2.496 20 70 EEIDLO CCCC[N@@H+](Cc1c[nH]nc1C(C)(C)C)[C@@H]1CCS(=O)(=O)C1 ZINC000160783035 311358363 /nfs/dbraw/zinc/35/83/63/311358363.db2.gz VLMJNJKFLXLEDL-CQSZACIVSA-N 1 2 327.494 2.496 20 70 EEIDLO CCOC(=O)N[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160793931 311358922 /nfs/dbraw/zinc/35/89/22/311358922.db2.gz WOWPAXFGJHVJQP-HNNXBMFYSA-N 1 2 343.431 2.193 20 70 EEIDLO CCOC(=O)N[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160793931 311358923 /nfs/dbraw/zinc/35/89/23/311358923.db2.gz WOWPAXFGJHVJQP-HNNXBMFYSA-N 1 2 343.431 2.193 20 70 EEIDLO C[C@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161239428 311363838 /nfs/dbraw/zinc/36/38/38/311363838.db2.gz NAEOYIPHARFRPF-KZNAEPCWSA-N 1 2 344.503 2.092 20 70 EEIDLO C[C@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161239428 311363839 /nfs/dbraw/zinc/36/38/39/311363839.db2.gz NAEOYIPHARFRPF-KZNAEPCWSA-N 1 2 344.503 2.092 20 70 EEIDLO C[C@@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)COCc1ccccc1 ZINC000160391271 463334611 /nfs/dbraw/zinc/33/46/11/463334611.db2.gz RQDSYWVDZGQJQX-RDJZCZTQSA-N 1 2 327.428 2.415 20 70 EEIDLO O=C(Nc1ccc(-n2cccn2)nc1)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000160777023 463369482 /nfs/dbraw/zinc/36/94/82/463369482.db2.gz QYWJLFCQXUINNP-HNNXBMFYSA-N 1 2 349.398 2.063 20 70 EEIDLO C[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000159995259 206274897 /nfs/dbraw/zinc/27/48/97/206274897.db2.gz GPUHJZLLHMYYGD-GDBMZVCRSA-N 1 2 336.399 2.187 20 70 EEIDLO COCc1nc2n(n1)C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)CC2 ZINC000161355988 206343092 /nfs/dbraw/zinc/34/30/92/206343092.db2.gz BZJYYMQXRWDBPC-SNVBAGLBSA-N 1 2 327.310 2.265 20 70 EEIDLO Cn1nc(Br)c2c1nc[nH+]c2N[C@H](CO)CC(C)(C)C ZINC000161411733 206346097 /nfs/dbraw/zinc/34/60/97/206346097.db2.gz CCYROGLDDXMCTA-QMMMGPOBSA-N 1 2 342.241 2.335 20 70 EEIDLO CN(Cc1ccco1)C(=O)C[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159591912 463293932 /nfs/dbraw/zinc/29/39/32/463293932.db2.gz NSIITTLIPCWRNM-FQEVSTJZSA-N 1 2 340.423 2.412 20 70 EEIDLO CN(Cc1ccco1)C(=O)C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159591912 463293937 /nfs/dbraw/zinc/29/39/37/463293937.db2.gz NSIITTLIPCWRNM-FQEVSTJZSA-N 1 2 340.423 2.412 20 70 EEIDLO CCOc1ccc(CNC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1OC ZINC000159849333 463308365 /nfs/dbraw/zinc/30/83/65/463308365.db2.gz ZLUUMWLRDAVWGP-AWEZNQCLSA-N 1 2 329.400 2.169 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@H]3OCC[N@@H+](C)[C@H]3C2)c(C)c1C ZINC000160695498 463363693 /nfs/dbraw/zinc/36/36/93/463363693.db2.gz DWVUSERKTVBYSA-RBUKOAKNSA-N 1 2 345.487 2.453 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@H]3OCC[N@H+](C)[C@H]3C2)c(C)c1C ZINC000160695498 463363695 /nfs/dbraw/zinc/36/36/95/463363695.db2.gz DWVUSERKTVBYSA-RBUKOAKNSA-N 1 2 345.487 2.453 20 70 EEIDLO CC(C)n1cc[nH+]c1CN1CCN(CC(=O)Nc2ccccc2)CC1 ZINC000160743296 463366925 /nfs/dbraw/zinc/36/69/25/463366925.db2.gz ZKIZQFKICAZGAV-UHFFFAOYSA-N 1 2 341.459 2.220 20 70 EEIDLO O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)N1CCC(n2cc[nH+]c2)CC1 ZINC000161073510 463397168 /nfs/dbraw/zinc/39/71/68/463397168.db2.gz DTCVVAPDTVNFEL-XHSDSOJGSA-N 1 2 330.432 2.187 20 70 EEIDLO CN(C)C(=O)Nc1ccc(C(=O)NCCn2cc[nH+]c2)c(Cl)c1 ZINC000160021843 206276826 /nfs/dbraw/zinc/27/68/26/206276826.db2.gz LITMHBBRZYHYHC-UHFFFAOYSA-N 1 2 335.795 2.060 20 70 EEIDLO CCc1nnc(C[NH2+][C@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)[nH]1 ZINC000160474051 206298832 /nfs/dbraw/zinc/29/88/32/206298832.db2.gz YOTZBWBNTQOGAS-ZWNOBZJWSA-N 1 2 329.404 2.327 20 70 EEIDLO CCCC[N@H+](Cc1ccc(OC)cc1OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160753178 206311371 /nfs/dbraw/zinc/31/13/71/206311371.db2.gz QZXMAOXZAANCSU-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCC[N@@H+](Cc1ccc(OC)cc1OC)[C@@H]1CCS(=O)(=O)C1 ZINC000160753178 206311374 /nfs/dbraw/zinc/31/13/74/206311374.db2.gz QZXMAOXZAANCSU-OAHLLOKOSA-N 1 2 341.473 2.493 20 70 EEIDLO CCn1nccc1CN1CC[NH+](Cc2cc(OC)ccc2OC)CC1 ZINC000161044237 206324631 /nfs/dbraw/zinc/32/46/31/206324631.db2.gz FRANEYHWTZUJBI-UHFFFAOYSA-N 1 2 344.459 2.238 20 70 EEIDLO CCn1nccc1C[NH+]1CCN(Cc2cc(OC)ccc2OC)CC1 ZINC000161044237 206324632 /nfs/dbraw/zinc/32/46/32/206324632.db2.gz FRANEYHWTZUJBI-UHFFFAOYSA-N 1 2 344.459 2.238 20 70 EEIDLO C[C@@H](C(=O)Nc1cccc(F)c1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161221777 206336643 /nfs/dbraw/zinc/33/66/43/206336643.db2.gz QLTLPMLWMLINQJ-HNNXBMFYSA-N 1 2 342.418 2.366 20 70 EEIDLO O=C(N[C@@H]1CCN(c2cccc[nH+]2)C1)c1cccnc1Br ZINC000161245725 206336940 /nfs/dbraw/zinc/33/69/40/206336940.db2.gz DUGSSSITIUNFJU-LLVKDONJSA-N 1 2 347.216 2.248 20 70 EEIDLO CCCC[N@H+](Cc1c[nH]nc1C(C)(C)C)[C@H]1CCS(=O)(=O)C1 ZINC000160783173 311358322 /nfs/dbraw/zinc/35/83/22/311358322.db2.gz VLMJNJKFLXLEDL-AWEZNQCLSA-N 1 2 327.494 2.496 20 70 EEIDLO CCCC[N@@H+](Cc1c[nH]nc1C(C)(C)C)[C@H]1CCS(=O)(=O)C1 ZINC000160783173 311358324 /nfs/dbraw/zinc/35/83/24/311358324.db2.gz VLMJNJKFLXLEDL-AWEZNQCLSA-N 1 2 327.494 2.496 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)C1(O)CCSCC1 ZINC000159452564 463287557 /nfs/dbraw/zinc/28/75/57/463287557.db2.gz YFYFJRNXLRCCMG-UHFFFAOYSA-N 1 2 333.457 2.109 20 70 EEIDLO CN(Cc1[nH+]ccn1Cc1ccccc1)c1ncnc2nc(N)ccc21 ZINC000159719333 463301306 /nfs/dbraw/zinc/30/13/06/463301306.db2.gz YSJDPEDSFPJNEF-UHFFFAOYSA-N 1 2 345.410 2.488 20 70 EEIDLO O=C(Nc1cc(F)cc(N2CCOCC2)c1)[C@H]1CCn2cc[nH+]c2C1 ZINC000161060937 463396561 /nfs/dbraw/zinc/39/65/61/463396561.db2.gz ZUJIBGFPYLQSQL-ZDUSSCGKSA-N 1 2 344.390 2.060 20 70 EEIDLO C[C@@H](C(=O)NCC(C)(C)[NH+]1CCOCC1)c1c(F)cccc1F ZINC000160331265 206291404 /nfs/dbraw/zinc/29/14/04/206291404.db2.gz NIVMPPWZCZQFDJ-GFCCVEGCSA-N 1 2 326.387 2.295 20 70 EEIDLO COc1ccc2oc(C[NH+]3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2c1 ZINC000161038321 206324968 /nfs/dbraw/zinc/32/49/68/206324968.db2.gz UQCPUQDBNGJAEZ-SFHVURJKSA-N 1 2 344.411 2.265 20 70 EEIDLO COc1ccc(OC)c(CN2CC[NH+](Cc3ccc(CO)o3)CC2)c1 ZINC000161044609 206325194 /nfs/dbraw/zinc/32/51/94/206325194.db2.gz ILKANOZDCVIAQV-UHFFFAOYSA-N 1 2 346.427 2.107 20 70 EEIDLO COc1ccc(OC)c(C[NH+]2CCN(Cc3ccc(CO)o3)CC2)c1 ZINC000161044609 206325197 /nfs/dbraw/zinc/32/51/97/206325197.db2.gz ILKANOZDCVIAQV-UHFFFAOYSA-N 1 2 346.427 2.107 20 70 EEIDLO CC[N@H+](Cc1ccc(Oc2cnccn2)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160581823 206304925 /nfs/dbraw/zinc/30/49/25/206304925.db2.gz YFAMZMFWXVIQKA-HNNXBMFYSA-N 1 2 347.440 2.278 20 70 EEIDLO CC[N@@H+](Cc1ccc(Oc2cnccn2)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160581823 206304929 /nfs/dbraw/zinc/30/49/29/206304929.db2.gz YFAMZMFWXVIQKA-HNNXBMFYSA-N 1 2 347.440 2.278 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)NO[C@H]1CCCCO1 ZINC000161295991 206340699 /nfs/dbraw/zinc/34/06/99/206340699.db2.gz JDDYXJDVVDKUGP-INIZCTEOSA-N 1 2 332.404 2.492 20 70 EEIDLO Cc1ccc(Nc2nc(N)nc(C[N@H+](C)C[C@H]3CCC[C@@H]3O)n2)cc1 ZINC000159731820 311345258 /nfs/dbraw/zinc/34/52/58/311345258.db2.gz JRKUFDCZDUXDNV-HIFRSBDPSA-N 1 2 342.447 2.099 20 70 EEIDLO Cc1ccc(Nc2nc(N)nc(C[N@@H+](C)C[C@H]3CCC[C@@H]3O)n2)cc1 ZINC000159731820 311345260 /nfs/dbraw/zinc/34/52/60/311345260.db2.gz JRKUFDCZDUXDNV-HIFRSBDPSA-N 1 2 342.447 2.099 20 70 EEIDLO COc1cccc(-c2cc(C(=O)N(C)[C@@H]3CCC[N@H+](C)C3)n[nH]2)c1 ZINC000159909323 311347830 /nfs/dbraw/zinc/34/78/30/311347830.db2.gz KRKJEOOFDKKDON-CQSZACIVSA-N 1 2 328.416 2.252 20 70 EEIDLO COc1cccc(-c2cc(C(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)n[nH]2)c1 ZINC000159909323 311347832 /nfs/dbraw/zinc/34/78/32/311347832.db2.gz KRKJEOOFDKKDON-CQSZACIVSA-N 1 2 328.416 2.252 20 70 EEIDLO CN(C)c1ncc(C[N@H+](C)CC(=O)Nc2ccccc2Cl)cn1 ZINC000160733366 311357660 /nfs/dbraw/zinc/35/76/60/311357660.db2.gz PLXLQIYHSYTJDS-UHFFFAOYSA-N 1 2 333.823 2.267 20 70 EEIDLO CN(C)c1ncc(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)cn1 ZINC000160733366 311357663 /nfs/dbraw/zinc/35/76/63/311357663.db2.gz PLXLQIYHSYTJDS-UHFFFAOYSA-N 1 2 333.823 2.267 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161115457 311362428 /nfs/dbraw/zinc/36/24/28/311362428.db2.gz KENIGSVWFLSUEJ-INIZCTEOSA-N 1 2 344.459 2.134 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161115457 311362430 /nfs/dbraw/zinc/36/24/30/311362430.db2.gz KENIGSVWFLSUEJ-INIZCTEOSA-N 1 2 344.459 2.134 20 70 EEIDLO Cc1cccc(C[NH+]2CCN(S(=O)(=O)c3cccnc3)CC2)c1C ZINC000159881089 463309234 /nfs/dbraw/zinc/30/92/34/463309234.db2.gz ZUHPOIVCIQZHGJ-UHFFFAOYSA-N 1 2 345.468 2.205 20 70 EEIDLO CCc1ccc([C@H](C)CC(=O)NC[C@H](C)[NH+]2CCN(C)CC2)cc1 ZINC000160158318 206282070 /nfs/dbraw/zinc/28/20/70/206282070.db2.gz UKJOPOUCHLKCSW-SJORKVTESA-N 1 2 331.504 2.495 20 70 EEIDLO Cc1[nH]nc(C(C)C)c1C(=O)NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000159579269 311343336 /nfs/dbraw/zinc/34/33/36/311343336.db2.gz KAMNCHSVUIKGQD-OAHLLOKOSA-N 1 2 336.480 2.318 20 70 EEIDLO Cc1n[nH]c(C(C)C)c1C(=O)NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000159579269 311343338 /nfs/dbraw/zinc/34/33/38/311343338.db2.gz KAMNCHSVUIKGQD-OAHLLOKOSA-N 1 2 336.480 2.318 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@H+](CC)C[C@@H]2COc3ccccc3O2)n1 ZINC000160529054 311355229 /nfs/dbraw/zinc/35/52/29/311355229.db2.gz XXRRBDRXOHEULC-CQSZACIVSA-N 1 2 329.400 2.407 20 70 EEIDLO CCc1cc(=O)[nH]c(C[N@@H+](CC)C[C@@H]2COc3ccccc3O2)n1 ZINC000160529054 311355231 /nfs/dbraw/zinc/35/52/31/311355231.db2.gz XXRRBDRXOHEULC-CQSZACIVSA-N 1 2 329.400 2.407 20 70 EEIDLO C[C@@H](NC(=O)N1C[C@H]2OCC[N@H+](C)[C@@H]2C1)c1cc2ccccc2o1 ZINC000160663743 463360569 /nfs/dbraw/zinc/36/05/69/463360569.db2.gz LUDFZUKODIGROO-SUYBPPKGSA-N 1 2 329.400 2.218 20 70 EEIDLO C[C@@H](NC(=O)N1C[C@H]2OCC[N@@H+](C)[C@@H]2C1)c1cc2ccccc2o1 ZINC000160663743 463360571 /nfs/dbraw/zinc/36/05/71/463360571.db2.gz LUDFZUKODIGROO-SUYBPPKGSA-N 1 2 329.400 2.218 20 70 EEIDLO CC(C)[C@H]1CC(=O)N(C[N@H+](C)CCN(C)C(=O)OC(C)(C)C)C1 ZINC000160556467 311355661 /nfs/dbraw/zinc/35/56/61/311355661.db2.gz VQDFUCNMTOYKKX-AWEZNQCLSA-N 1 2 327.469 2.247 20 70 EEIDLO CC(C)[C@H]1CC(=O)N(C[N@@H+](C)CCN(C)C(=O)OC(C)(C)C)C1 ZINC000160556467 311355663 /nfs/dbraw/zinc/35/56/63/311355663.db2.gz VQDFUCNMTOYKKX-AWEZNQCLSA-N 1 2 327.469 2.247 20 70 EEIDLO CCCC[N@H+](Cc1ccc([S@](C)=O)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160789147 311358845 /nfs/dbraw/zinc/35/88/45/311358845.db2.gz LXXZSWPMMWLEKM-QVKFZJNVSA-N 1 2 343.514 2.213 20 70 EEIDLO CCCC[N@@H+](Cc1ccc([S@](C)=O)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160789147 311358847 /nfs/dbraw/zinc/35/88/47/311358847.db2.gz LXXZSWPMMWLEKM-QVKFZJNVSA-N 1 2 343.514 2.213 20 70 EEIDLO CN1CC[C@H]([NH2+][C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1=O ZINC000161271513 463415232 /nfs/dbraw/zinc/41/52/32/463415232.db2.gz RILHNQDCFPADNE-DLBZAZTESA-N 1 2 341.386 2.326 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N1CCc2sccc2C1 ZINC000159871584 533992621 /nfs/dbraw/zinc/99/26/21/533992621.db2.gz PTHZQPUBVGNADK-CYBMUJFWSA-N 1 2 340.514 2.087 20 70 EEIDLO CCOc1ccc(NC(=O)[C@@H](C)SCC[NH+]2CCOCC2)cc1 ZINC000159918540 528539940 /nfs/dbraw/zinc/53/99/40/528539940.db2.gz QUULLZKVZNHNQQ-CQSZACIVSA-N 1 2 338.473 2.478 20 70 EEIDLO CC[C@@H](COC)NC(=O)NC[C@@H](c1c(F)cccc1F)[NH+](C)C ZINC000160118185 286849352 /nfs/dbraw/zinc/84/93/52/286849352.db2.gz BDSGHEJSWVZDAK-FZMZJTMJSA-N 1 2 329.391 2.292 20 70 EEIDLO O=C(NCCc1cscn1)N1CC[NH+](Cc2cccs2)CC1 ZINC000159378763 311340653 /nfs/dbraw/zinc/34/06/53/311340653.db2.gz YYKZTWMEQLGOSC-UHFFFAOYSA-N 1 2 336.486 2.275 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccccc1C(C)=O ZINC000161105909 311362331 /nfs/dbraw/zinc/36/23/31/311362331.db2.gz YDTOZTCBLXHKNU-CYBMUJFWSA-N 1 2 328.416 2.472 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)C(=O)Nc1ccccc1C(C)=O ZINC000161105909 311362333 /nfs/dbraw/zinc/36/23/33/311362333.db2.gz YDTOZTCBLXHKNU-CYBMUJFWSA-N 1 2 328.416 2.472 20 70 EEIDLO CCN1CC[NH+]([C@H]2CCN(Cc3noc(C4CCCCC4)n3)C2)CC1 ZINC000160050665 463317187 /nfs/dbraw/zinc/31/71/87/463317187.db2.gz NCFDUUPJHUYORJ-KRWDZBQOSA-N 1 2 347.507 2.329 20 70 EEIDLO CC[C@H](C)[C@H](NC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(C)n1)C(=O)OC ZINC000160228802 463323924 /nfs/dbraw/zinc/32/39/24/463323924.db2.gz DXAVPWPGTZNJNP-XCRHUMRWSA-N 1 2 347.459 2.231 20 70 EEIDLO CC[C@H](C)[C@H](NC(=O)C[N@H+]1CCC[C@@H]1c1cccc(C)n1)C(=O)OC ZINC000160228802 463323929 /nfs/dbraw/zinc/32/39/29/463323929.db2.gz DXAVPWPGTZNJNP-XCRHUMRWSA-N 1 2 347.459 2.231 20 70 EEIDLO C[C@@H](CSCc1ccccc1)C(=O)N(C)CC[NH+]1CCOCC1 ZINC000161457898 463432338 /nfs/dbraw/zinc/43/23/38/463432338.db2.gz BLHTVBYQAWDJTG-INIZCTEOSA-N 1 2 336.501 2.347 20 70 EEIDLO COc1ccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)cc1OC ZINC000159916823 534134638 /nfs/dbraw/zinc/13/46/38/534134638.db2.gz DMNJQBJUXIFVFF-CQSZACIVSA-N 1 2 342.399 2.499 20 70 EEIDLO CC(C)OC(=O)CCCNC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000160170635 527774842 /nfs/dbraw/zinc/77/48/42/527774842.db2.gz HHQDRASJKIBZNX-GJZGRUSLSA-N 1 2 336.436 2.207 20 70 EEIDLO CC[C@@H](C)OCC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCOCC1 ZINC000159756278 529377015 /nfs/dbraw/zinc/37/70/15/529377015.db2.gz PDZDWKINKGTZBW-AEFFLSMTSA-N 1 2 334.460 2.300 20 70 EEIDLO COC[C@H](NC(=O)Nc1ccccc1C[NH+]1CCOCC1)C1CC1 ZINC000159384988 533066012 /nfs/dbraw/zinc/06/60/12/533066012.db2.gz DUSNYBAXHSJCRA-KRWDZBQOSA-N 1 2 333.432 2.065 20 70 EEIDLO Clc1ccc(-n2cc(CSCC[NH+]3CCOCC3)nn2)cc1 ZINC000160037373 311349176 /nfs/dbraw/zinc/34/91/76/311349176.db2.gz QMRZJYPYGWQMSN-UHFFFAOYSA-N 1 2 338.864 2.486 20 70 EEIDLO CCC(CC)[C@@H](C(=O)Nc1ccc(OC)c(N)c1)[NH+]1CCOCC1 ZINC000161240360 463412963 /nfs/dbraw/zinc/41/29/63/463412963.db2.gz DQNFTWGGGUYFPN-KRWDZBQOSA-N 1 2 335.448 2.353 20 70 EEIDLO O=C(Nc1nnc(C(F)F)s1)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000161419176 463429927 /nfs/dbraw/zinc/42/99/27/463429927.db2.gz MZZJGMAZONBBKE-QMMMGPOBSA-N 1 2 340.359 2.271 20 70 EEIDLO CC1CCN(c2cccc(NC(=O)NCC[NH+]3CCOCC3)c2)CC1 ZINC000159687152 528270297 /nfs/dbraw/zinc/27/02/97/528270297.db2.gz QYARUJVCXMFLAV-UHFFFAOYSA-N 1 2 346.475 2.377 20 70 EEIDLO CC[N@@H+](Cc1ccc(N(C)C)nc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000159914531 539518768 /nfs/dbraw/zinc/51/87/68/539518768.db2.gz OMWOVCKGPREHRA-UHFFFAOYSA-N 1 2 337.427 2.406 20 70 EEIDLO CC[N@H+](Cc1ccc(N(C)C)nc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000159914531 539518771 /nfs/dbraw/zinc/51/87/71/539518771.db2.gz OMWOVCKGPREHRA-UHFFFAOYSA-N 1 2 337.427 2.406 20 70 EEIDLO O=C(Nc1nnc(C(F)F)s1)N[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000161419316 225624404 /nfs/dbraw/zinc/62/44/04/225624404.db2.gz MZZJGMAZONBBKE-MRVPVSSYSA-N 1 2 340.359 2.271 20 70 EEIDLO CC[C@@H](SCC[NH+]1CCOCC1)C(=O)Nc1ccc(OC)cc1 ZINC000159875123 311347588 /nfs/dbraw/zinc/34/75/88/311347588.db2.gz KGDUCLSPVIUQNV-MRXNPFEDSA-N 1 2 338.473 2.478 20 70 EEIDLO CC(C)[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCCC[C@@H]1C ZINC000160020829 311349182 /nfs/dbraw/zinc/34/91/82/311349182.db2.gz BHVDTDLJUNSOCK-HOTGVXAUSA-N 1 2 328.522 2.477 20 70 EEIDLO CCOC(=O)N[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160793796 311358807 /nfs/dbraw/zinc/35/88/07/311358807.db2.gz WOWPAXFGJHVJQP-OAHLLOKOSA-N 1 2 343.431 2.193 20 70 EEIDLO CCOC(=O)N[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3)n2C)C1 ZINC000160793796 311358809 /nfs/dbraw/zinc/35/88/09/311358809.db2.gz WOWPAXFGJHVJQP-OAHLLOKOSA-N 1 2 343.431 2.193 20 70 EEIDLO CCOC(=O)CN(C(=O)C[N@H+](C)Cc1cccnc1)c1ccccc1 ZINC000160568040 463350629 /nfs/dbraw/zinc/35/06/29/463350629.db2.gz FECUVTUIGLVREG-UHFFFAOYSA-N 1 2 341.411 2.110 20 70 EEIDLO CCOC(=O)CN(C(=O)C[N@@H+](C)Cc1cccnc1)c1ccccc1 ZINC000160568040 463350632 /nfs/dbraw/zinc/35/06/32/463350632.db2.gz FECUVTUIGLVREG-UHFFFAOYSA-N 1 2 341.411 2.110 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@H]1CCC(=O)C[C@@H]1C ZINC000160586990 463352355 /nfs/dbraw/zinc/35/23/55/463352355.db2.gz IIQIRPRQOQCOTO-WFASDCNBSA-N 1 2 331.416 2.170 20 70 EEIDLO CCc1cc(=O)[nH]c(C[NH+]2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)n1 ZINC000160838715 463375044 /nfs/dbraw/zinc/37/50/44/463375044.db2.gz UXELHCDYXHBEKK-CQSZACIVSA-N 1 2 346.475 2.215 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@H+]3CCC[C@@H](OC)C3)c2c1 ZINC000160882702 463378896 /nfs/dbraw/zinc/37/88/96/463378896.db2.gz ASXNQIYMUMTKJA-CYBMUJFWSA-N 1 2 330.384 2.248 20 70 EEIDLO COC(=O)c1ccc2[nH]cc(C(=O)C[N@@H+]3CCC[C@@H](OC)C3)c2c1 ZINC000160882702 463378899 /nfs/dbraw/zinc/37/88/99/463378899.db2.gz ASXNQIYMUMTKJA-CYBMUJFWSA-N 1 2 330.384 2.248 20 70 EEIDLO Cc1ccc(C(=O)N[C@H](C)C[NH+]2CCOCC2)c(Br)c1 ZINC000161105963 463399468 /nfs/dbraw/zinc/39/94/68/463399468.db2.gz PSDUCYYPWRORII-GFCCVEGCSA-N 1 2 341.249 2.208 20 70 EEIDLO C[C@@H](C(=O)Nc1ccccc1Cl)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161178133 463408127 /nfs/dbraw/zinc/40/81/27/463408127.db2.gz GGTTVAQBZYIOAL-JTQLQIEISA-N 1 2 341.820 2.016 20 70 EEIDLO Cn1c(=O)cccc1C(=O)NCc1ccc(N2CCCCCC2)[nH+]c1 ZINC000159856769 225291788 /nfs/dbraw/zinc/29/17/88/225291788.db2.gz MKXMHFHATXMRHD-UHFFFAOYSA-N 1 2 340.427 2.091 20 70 EEIDLO COC[C@@H](O)CCNC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000160863979 311359774 /nfs/dbraw/zinc/35/97/74/311359774.db2.gz LINREBMAWGAVFZ-HNNXBMFYSA-N 1 2 330.384 2.310 20 70 EEIDLO COc1c(C)cc(C[NH+]2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1C ZINC000160985693 311361157 /nfs/dbraw/zinc/36/11/57/311361157.db2.gz SLZGVMYVSXSOHG-KRWDZBQOSA-N 1 2 332.444 2.135 20 70 EEIDLO CCOC(=O)C1(C(=O)NCCc2cn3cccc(C)c3[nH+]2)CCC1 ZINC000159883555 463308823 /nfs/dbraw/zinc/30/88/23/463308823.db2.gz MZVUAORLXAXDOP-UHFFFAOYSA-N 1 2 329.400 2.035 20 70 EEIDLO CC[C@H](C)[C@@H](NC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(C)n1)C(=O)OC ZINC000160229028 463323355 /nfs/dbraw/zinc/32/33/55/463323355.db2.gz DXAVPWPGTZNJNP-FDQGKXFDSA-N 1 2 347.459 2.231 20 70 EEIDLO CC[C@H](C)[C@@H](NC(=O)C[N@H+]1CCC[C@@H]1c1cccc(C)n1)C(=O)OC ZINC000160229028 463323361 /nfs/dbraw/zinc/32/33/61/463323361.db2.gz DXAVPWPGTZNJNP-FDQGKXFDSA-N 1 2 347.459 2.231 20 70 EEIDLO CCN(CC)c1ccc(CNC(=O)CCNC(=O)CC(C)C)c[nH+]1 ZINC000160753899 463368672 /nfs/dbraw/zinc/36/86/72/463368672.db2.gz UNXDSJKMRROCHE-UHFFFAOYSA-N 1 2 334.464 2.096 20 70 EEIDLO COCCOCCC(=O)N1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000161390020 463428019 /nfs/dbraw/zinc/42/80/19/463428019.db2.gz WEONXVAILZJEGM-UHFFFAOYSA-N 1 2 340.851 2.037 20 70 EEIDLO COC(=O)CC[C@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000161457453 463431760 /nfs/dbraw/zinc/43/17/60/463431760.db2.gz AFHBLUYDWKRHOA-CVEARBPZSA-N 1 2 341.411 2.256 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)NC[C@@H](C)c1ccccc1 ZINC000159833480 533993990 /nfs/dbraw/zinc/99/39/90/533993990.db2.gz ZVDREGRKUUJJMC-HZPDHXFCSA-N 1 2 336.501 2.360 20 70 EEIDLO COc1ccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c(OC)c1 ZINC000159988481 534133562 /nfs/dbraw/zinc/13/35/62/534133562.db2.gz DGGJTWQCBSSHOC-CYBMUJFWSA-N 1 2 342.399 2.499 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)NCc2ccc(Cl)cc2)CCCC1 ZINC000159433499 533226959 /nfs/dbraw/zinc/22/69/59/533226959.db2.gz ZUZVKFCVYMMYAQ-UHFFFAOYSA-N 1 2 338.835 2.374 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)NCc2ccc(Cl)cc2)CCCC1 ZINC000159433499 533226963 /nfs/dbraw/zinc/22/69/63/533226963.db2.gz ZUZVKFCVYMMYAQ-UHFFFAOYSA-N 1 2 338.835 2.374 20 70 EEIDLO COC(=O)C[C@H]1C(=O)NCC[N@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000159815621 311346506 /nfs/dbraw/zinc/34/65/06/311346506.db2.gz MHIKIBJEPIMTDS-HNNXBMFYSA-N 1 2 344.436 2.279 20 70 EEIDLO COC(=O)C[C@H]1C(=O)NCC[N@@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000159815621 311346508 /nfs/dbraw/zinc/34/65/08/311346508.db2.gz MHIKIBJEPIMTDS-HNNXBMFYSA-N 1 2 344.436 2.279 20 70 EEIDLO CC[C@H]1CCCCN1C(=O)[C@H](C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161178073 311363370 /nfs/dbraw/zinc/36/33/70/311363370.db2.gz TVBUQRUMXUVILM-HKUYNNGSSA-N 1 2 344.503 2.379 20 70 EEIDLO CC[C@H]1CCCCN1C(=O)[C@H](C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161178073 311363372 /nfs/dbraw/zinc/36/33/72/311363372.db2.gz TVBUQRUMXUVILM-HKUYNNGSSA-N 1 2 344.503 2.379 20 70 EEIDLO CCc1nnc(C[NH2+][C@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)[nH]1 ZINC000160474298 463341081 /nfs/dbraw/zinc/34/10/81/463341081.db2.gz YOTZBWBNTQOGAS-MFKMUULPSA-N 1 2 329.404 2.327 20 70 EEIDLO CC(=O)NC1CCC([NH2+]c2ccc(OCC(=O)N(C)C)cc2)CC1 ZINC000161087495 463398272 /nfs/dbraw/zinc/39/82/72/463398272.db2.gz CJTRQKSBIUPQJD-UHFFFAOYSA-N 1 2 333.432 2.013 20 70 EEIDLO CC(C)(CNC(=O)COc1ccc(Cl)c(F)c1)[NH+]1CCOCC1 ZINC000161124110 463401883 /nfs/dbraw/zinc/40/18/83/463401883.db2.gz MUKZYILKINVCCN-UHFFFAOYSA-N 1 2 344.814 2.085 20 70 EEIDLO CCCOc1ccc(CNC(=O)C[N@H+](CC)Cc2cnn(C)c2)cc1 ZINC000161129077 463402227 /nfs/dbraw/zinc/40/22/27/463402227.db2.gz LPXGREMDEPWYKK-UHFFFAOYSA-N 1 2 344.459 2.347 20 70 EEIDLO CCCOc1ccc(CNC(=O)C[N@@H+](CC)Cc2cnn(C)c2)cc1 ZINC000161129077 463402232 /nfs/dbraw/zinc/40/22/32/463402232.db2.gz LPXGREMDEPWYKK-UHFFFAOYSA-N 1 2 344.459 2.347 20 70 EEIDLO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000161167368 463406521 /nfs/dbraw/zinc/40/65/21/463406521.db2.gz DLNQCVUUYBCQDW-LBPRGKRZSA-N 1 2 339.399 2.100 20 70 EEIDLO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000161167368 463406527 /nfs/dbraw/zinc/40/65/27/463406527.db2.gz DLNQCVUUYBCQDW-LBPRGKRZSA-N 1 2 339.399 2.100 20 70 EEIDLO CC(C)c1ccccc1NC(=O)[C@H](C)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161167670 463406933 /nfs/dbraw/zinc/40/69/33/463406933.db2.gz CQIXFRAIMKQEEG-ZDUSSCGKSA-N 1 2 349.456 2.486 20 70 EEIDLO CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1C ZINC000161409157 463428660 /nfs/dbraw/zinc/42/86/60/463428660.db2.gz XHRPOWCIGNTKMV-AWEZNQCLSA-N 1 2 326.400 2.238 20 70 EEIDLO COc1ccc2oc(C[NH+]3CCN(C(=O)[C@H]4CCCO4)CC3)cc2c1 ZINC000161038431 533354022 /nfs/dbraw/zinc/35/40/22/533354022.db2.gz UQCPUQDBNGJAEZ-GOSISDBHSA-N 1 2 344.411 2.265 20 70 EEIDLO CC[C@H]1C[N@H+](CC(=O)NC(=O)Nc2ccc(C)c(C)c2)C[C@@H](C)O1 ZINC000217140430 160216161 /nfs/dbraw/zinc/21/61/61/160216161.db2.gz SATQRQCBIZLYQE-ZBFHGGJFSA-N 1 2 333.432 2.451 20 70 EEIDLO CC[C@H]1C[N@@H+](CC(=O)NC(=O)Nc2ccc(C)c(C)c2)C[C@@H](C)O1 ZINC000217140430 160216163 /nfs/dbraw/zinc/21/61/63/160216163.db2.gz SATQRQCBIZLYQE-ZBFHGGJFSA-N 1 2 333.432 2.451 20 70 EEIDLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)CCNC(N)=O)c1 ZINC000160160668 311350989 /nfs/dbraw/zinc/35/09/89/311350989.db2.gz JPXMMITZDFMZLE-UHFFFAOYSA-N 1 2 329.404 2.347 20 70 EEIDLO CC[N@H+](CC(=O)N[C@H](C)c1ccccc1OC)Cc1cnn(C)c1 ZINC000161091887 311361659 /nfs/dbraw/zinc/36/16/59/311361659.db2.gz CRMNCTRVJXZFCK-CQSZACIVSA-N 1 2 330.432 2.128 20 70 EEIDLO CC[N@@H+](CC(=O)N[C@H](C)c1ccccc1OC)Cc1cnn(C)c1 ZINC000161091887 311361663 /nfs/dbraw/zinc/36/16/63/311361663.db2.gz CRMNCTRVJXZFCK-CQSZACIVSA-N 1 2 330.432 2.128 20 70 EEIDLO COc1ccc(NC(=O)c2cccc(C[NH+]3CCOCC3)c2)cc1N ZINC000161183044 311363346 /nfs/dbraw/zinc/36/33/46/311363346.db2.gz YOEHHHRXXULWKT-UHFFFAOYSA-N 1 2 341.411 2.362 20 70 EEIDLO O=C(NCc1ncccc1F)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161393663 311365667 /nfs/dbraw/zinc/36/56/67/311365667.db2.gz YMOWSNNGVSBYTE-UHFFFAOYSA-N 1 2 344.390 2.375 20 70 EEIDLO CC1CCN(c2ccc(CNC(=O)C3(O)CCSCC3)c[nH+]2)CC1 ZINC000159799051 463305470 /nfs/dbraw/zinc/30/54/70/463305470.db2.gz PKQCTHSLCOFYCG-UHFFFAOYSA-N 1 2 349.500 2.192 20 70 EEIDLO CC[C@H](O)CCNC(=O)N[C@@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000160838147 463374794 /nfs/dbraw/zinc/37/47/94/463374794.db2.gz JZQPDEPPVUQMHF-LSDHHAIUSA-N 1 2 334.395 2.109 20 70 EEIDLO O=C(NCCCNc1cccc[nH+]1)NCCc1ccc(Cl)nc1 ZINC000161036726 463394490 /nfs/dbraw/zinc/39/44/90/463394490.db2.gz GEHRWMQFWCRZIG-UHFFFAOYSA-N 1 2 333.823 2.474 20 70 EEIDLO C[C@H](C(=O)N[C@@H]1CCCC[C@@H]1C)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161186359 463407869 /nfs/dbraw/zinc/40/78/69/463407869.db2.gz MMFXIWPLFSHLOD-YQVWRLOYSA-N 1 2 344.503 2.283 20 70 EEIDLO C[C@H](C(=O)N[C@@H]1CCCC[C@@H]1C)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161186359 463407875 /nfs/dbraw/zinc/40/78/75/463407875.db2.gz MMFXIWPLFSHLOD-YQVWRLOYSA-N 1 2 344.503 2.283 20 70 EEIDLO CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)[C@H]2CSC[NH2+]2)c1 ZINC000159833095 526601116 /nfs/dbraw/zinc/60/11/16/526601116.db2.gz QAJGAYDEASDREU-CYBMUJFWSA-N 1 2 342.486 2.001 20 70 EEIDLO Cc1cc(F)c(C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)cc1F ZINC000160793826 539524335 /nfs/dbraw/zinc/52/43/35/539524335.db2.gz NGZKYCIFUIRHHT-MRXNPFEDSA-N 1 2 326.387 2.360 20 70 EEIDLO O=C(N[C@@H]1CCN(c2ccc(F)cc2F)C1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161474097 539528219 /nfs/dbraw/zinc/52/82/19/539528219.db2.gz WPGIFKCTRONZFT-TZMCWYRMSA-N 1 2 346.381 2.119 20 70 EEIDLO O=C(Nc1n[nH]c(-c2ccccc2F)n1)[C@H]1CCn2cc[nH+]c2C1 ZINC000161333879 275001658 /nfs/dbraw/zinc/00/16/58/275001658.db2.gz TXIMIAOSHJYKPV-JTQLQIEISA-N 1 2 326.335 2.008 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@H]1CCC(=O)C[C@H]1C ZINC000160587233 293298847 /nfs/dbraw/zinc/29/88/47/293298847.db2.gz IIQIRPRQOQCOTO-DOMZBBRYSA-N 1 2 331.416 2.170 20 70 EEIDLO CC[N@H+](Cc1c[nH]c(C(=O)OC)c1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000159907707 311348018 /nfs/dbraw/zinc/34/80/18/311348018.db2.gz CYVWBXSIOWHOJG-UHFFFAOYSA-N 1 2 340.383 2.060 20 70 EEIDLO CC[N@@H+](Cc1c[nH]c(C(=O)OC)c1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000159907707 311348020 /nfs/dbraw/zinc/34/80/20/311348020.db2.gz CYVWBXSIOWHOJG-UHFFFAOYSA-N 1 2 340.383 2.060 20 70 EEIDLO COc1ccc(OC)c(C[NH+]2CCN(Cc3c(C)n[nH]c3C)CC2)c1 ZINC000161047064 463394639 /nfs/dbraw/zinc/39/46/39/463394639.db2.gz GTKNQUSNVLOOPW-UHFFFAOYSA-N 1 2 344.459 2.362 20 70 EEIDLO C[C@@H](SCC[NH+]1CCOCC1)C(=O)N1c2ccccc2C[C@H]1C ZINC000159965360 533992988 /nfs/dbraw/zinc/99/29/88/533992988.db2.gz MVLATZXQBCWBES-HUUCEWRRSA-N 1 2 334.485 2.418 20 70 EEIDLO O=C1[C@H](SCC[NH+]2CCOCC2)CCN1c1c(F)cccc1F ZINC000159766339 534846360 /nfs/dbraw/zinc/84/63/60/534846360.db2.gz JATPNETVNWFAQE-CQSZACIVSA-N 1 2 342.411 2.136 20 70 EEIDLO O=C(Nc1ccc2c(c1)OCCO2)N[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000159689348 225261632 /nfs/dbraw/zinc/26/16/32/225261632.db2.gz ZZKQVQIDRGDUKP-AWEZNQCLSA-N 1 2 340.383 2.253 20 70 EEIDLO COCCC[N@H+](C)[C@H](C(N)=O)c1ccc(Br)cc1F ZINC000159687881 225260008 /nfs/dbraw/zinc/26/00/08/225260008.db2.gz DYRKHJVXILGJEG-LBPRGKRZSA-N 1 2 333.201 2.083 20 70 EEIDLO COCCC[N@@H+](C)[C@H](C(N)=O)c1ccc(Br)cc1F ZINC000159687881 225260014 /nfs/dbraw/zinc/26/00/14/225260014.db2.gz DYRKHJVXILGJEG-LBPRGKRZSA-N 1 2 333.201 2.083 20 70 EEIDLO CCOc1cccc(N2CC[NH+](Cc3cnc4ccccn34)CC2)n1 ZINC000160216721 463323260 /nfs/dbraw/zinc/32/32/60/463323260.db2.gz ZGXYDEVMWPAAMO-UHFFFAOYSA-N 1 2 337.427 2.450 20 70 EEIDLO COc1ccccc1[C@H](NC(=O)[C@@H]1CCCCO1)c1[nH+]ccn1C ZINC000160320542 463328913 /nfs/dbraw/zinc/32/89/13/463328913.db2.gz AIBCDIBCTRTVPX-HOTGVXAUSA-N 1 2 329.400 2.203 20 70 EEIDLO CCCC(O)(CCC)CC(=O)NC(C)(C)c1noc(C[NH+](C)C)n1 ZINC000160405521 463336277 /nfs/dbraw/zinc/33/62/77/463336277.db2.gz LPQZRFJSZQLTPP-UHFFFAOYSA-N 1 2 340.468 2.204 20 70 EEIDLO COC(=O)CCOc1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000161043816 463393701 /nfs/dbraw/zinc/39/37/01/463393701.db2.gz LIJRBXIUCQUQBD-ZDUSSCGKSA-N 1 2 343.383 2.026 20 70 EEIDLO C[C@@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)Cc1[nH+]ccn1C ZINC000161190493 463408862 /nfs/dbraw/zinc/40/88/62/463408862.db2.gz NDUFRRMKDCDXDG-JTQLQIEISA-N 1 2 341.820 2.016 20 70 EEIDLO C[C@H](C(=O)Nc1cccc(F)c1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161221889 463411818 /nfs/dbraw/zinc/41/18/18/463411818.db2.gz QLTLPMLWMLINQJ-OAHLLOKOSA-N 1 2 342.418 2.366 20 70 EEIDLO CC(C)[C@@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1nc(C2CC2)no1 ZINC000161309583 528568186 /nfs/dbraw/zinc/56/81/86/528568186.db2.gz RSKATIFENFJSNB-GXTWGEPZSA-N 1 2 329.404 2.219 20 70 EEIDLO C[C@H](C(=O)NC1CC1)[NH+]1CCN(C(=O)C[C@H]2CCCC(C)(C)C2)CC1 ZINC000161222971 539526062 /nfs/dbraw/zinc/52/60/62/539526062.db2.gz WDZQHPYHUQXLFX-HZPDHXFCSA-N 1 2 349.519 2.404 20 70 EEIDLO COc1cc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)cc(OC)c1 ZINC000159923275 225304037 /nfs/dbraw/zinc/30/40/37/225304037.db2.gz SYNINPHWXIGGKL-ZDUSSCGKSA-N 1 2 342.399 2.499 20 70 EEIDLO CCc1noc([C@H](C)N2CCN(Cc3c[nH+]c4ccccn34)CC2)n1 ZINC000160016303 225319753 /nfs/dbraw/zinc/31/97/53/225319753.db2.gz QSMPDMUWRPUFFD-AWEZNQCLSA-N 1 2 340.431 2.159 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)NCc2ccc(Cl)s2)CCCC1 ZINC000159415947 463285800 /nfs/dbraw/zinc/28/58/00/463285800.db2.gz VOVASIGIHFXECM-UHFFFAOYSA-N 1 2 344.864 2.435 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)NCc2ccc(Cl)s2)CCCC1 ZINC000159415947 463285806 /nfs/dbraw/zinc/28/58/06/463285806.db2.gz VOVASIGIHFXECM-UHFFFAOYSA-N 1 2 344.864 2.435 20 70 EEIDLO Cn1cnc(-c2ccc(NC(=O)NCc3cn4ccccc4[nH+]3)cc2)n1 ZINC000160788080 463371537 /nfs/dbraw/zinc/37/15/37/463371537.db2.gz MSVOVACAUMEZOS-UHFFFAOYSA-N 1 2 347.382 2.452 20 70 EEIDLO COC(=O)CCOc1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000161043709 463394012 /nfs/dbraw/zinc/39/40/12/463394012.db2.gz LIJRBXIUCQUQBD-CYBMUJFWSA-N 1 2 343.383 2.026 20 70 EEIDLO COC(=O)c1cccc(CN2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000161198479 463409330 /nfs/dbraw/zinc/40/93/30/463409330.db2.gz JTRAATKORNJWEN-UHFFFAOYSA-N 1 2 325.412 2.186 20 70 EEIDLO COC(=O)c1cccc(C[NH+]2CCN(Cc3ccncc3)CC2)c1 ZINC000161198479 463409335 /nfs/dbraw/zinc/40/93/35/463409335.db2.gz JTRAATKORNJWEN-UHFFFAOYSA-N 1 2 325.412 2.186 20 70 EEIDLO COC(=O)CC[C@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccccc1 ZINC000161457682 463432561 /nfs/dbraw/zinc/43/25/61/463432561.db2.gz AFHBLUYDWKRHOA-HOTGVXAUSA-N 1 2 341.411 2.256 20 70 EEIDLO CC1=C(C(=O)NCc2ccccc2C[NH+]2CCOCC2)CCCO1 ZINC000159726687 528077474 /nfs/dbraw/zinc/07/74/74/528077474.db2.gz SEPMPVSLZWOEAD-UHFFFAOYSA-N 1 2 330.428 2.219 20 70 EEIDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)[C@@H]1CCC(=O)C[C@@H]1C ZINC000160586862 255799490 /nfs/dbraw/zinc/79/94/90/255799490.db2.gz IIQIRPRQOQCOTO-SWLSCSKDSA-N 1 2 331.416 2.170 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N(C)Cc2ccccc2F)CCCC1 ZINC000159382024 533225822 /nfs/dbraw/zinc/22/58/22/533225822.db2.gz DDCVRUYGBRITCK-UHFFFAOYSA-N 1 2 336.407 2.202 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N(C)Cc2ccccc2F)CCCC1 ZINC000159382024 533225830 /nfs/dbraw/zinc/22/58/30/533225830.db2.gz DDCVRUYGBRITCK-UHFFFAOYSA-N 1 2 336.407 2.202 20 70 EEIDLO CO[C@@H]1CCC[C@H]1NC(=O)NCc1cccc(Cn2cc[nH+]c2)c1 ZINC000160143692 311350590 /nfs/dbraw/zinc/35/05/90/311350590.db2.gz GRRZDOMMBRVMGK-IAGOWNOFSA-N 1 2 328.416 2.298 20 70 EEIDLO O=C(Nc1ccc(N2CCOC2=O)cc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000160279880 463325391 /nfs/dbraw/zinc/32/53/91/463325391.db2.gz JUVFHHKZVRVXIB-LBPRGKRZSA-N 1 2 326.356 2.041 20 70 EEIDLO C[C@H](C(=O)N(C)C1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161188278 463409274 /nfs/dbraw/zinc/40/92/74/463409274.db2.gz NQWPTWMLUOYBLR-QGZVFWFLSA-N 1 2 344.503 2.379 20 70 EEIDLO C[C@H](C(=O)N(C)C1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161188278 463409279 /nfs/dbraw/zinc/40/92/79/463409279.db2.gz NQWPTWMLUOYBLR-QGZVFWFLSA-N 1 2 344.503 2.379 20 70 EEIDLO CC(C)OC(=O)CCCNC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000160170558 527774061 /nfs/dbraw/zinc/77/40/61/527774061.db2.gz HHQDRASJKIBZNX-CABCVRRESA-N 1 2 336.436 2.207 20 70 EEIDLO C[C@]1(O)CCCN(C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)C1 ZINC000160120459 225341111 /nfs/dbraw/zinc/34/11/11/225341111.db2.gz YPMJUAOREKTBFX-SFHVURJKSA-N 1 2 332.448 2.128 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@H+]1Cc1cccc(-c2ccccc2)c1 ZINC000159828071 463306511 /nfs/dbraw/zinc/30/65/11/463306511.db2.gz JICGJFONOLJCLD-GOSISDBHSA-N 1 2 338.407 2.217 20 70 EEIDLO COC(=O)C[C@@H]1C(=O)NCC[N@@H+]1Cc1cccc(-c2ccccc2)c1 ZINC000159828071 463306519 /nfs/dbraw/zinc/30/65/19/463306519.db2.gz JICGJFONOLJCLD-GOSISDBHSA-N 1 2 338.407 2.217 20 70 EEIDLO O=C(Nc1ccc(CN2CCOC2=O)cc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000160144481 463321082 /nfs/dbraw/zinc/32/10/82/463321082.db2.gz MMMHYRFLWZKVPU-CQSZACIVSA-N 1 2 340.383 2.036 20 70 EEIDLO CCc1nsc(N2CCN(Cc3c[nH+]c4ccccn34)CC2)n1 ZINC000160877825 463379493 /nfs/dbraw/zinc/37/94/93/463379493.db2.gz VWSDESKFPYNSFQ-UHFFFAOYSA-N 1 2 328.445 2.070 20 70 EEIDLO CC(C)CCn1ccc(NC(=O)N2C[C@H]([NH+]3CCOCC3)[C@@H](C)C2)n1 ZINC000160978954 463387485 /nfs/dbraw/zinc/38/74/85/463387485.db2.gz DVTJUDVDKHBTGI-HOTGVXAUSA-N 1 2 349.479 2.114 20 70 EEIDLO C[N@@H+]1CCc2nc(NC(=O)c3cccc(-c4nc[nH]n4)c3)sc2C1 ZINC000161501156 463434716 /nfs/dbraw/zinc/43/47/16/463434716.db2.gz JAMNTAIPLAKSAZ-UHFFFAOYSA-N 1 2 340.412 2.168 20 70 EEIDLO C[N@H+]1CCc2nc(NC(=O)c3cccc(-c4nc[nH]n4)c3)sc2C1 ZINC000161501156 463434722 /nfs/dbraw/zinc/43/47/22/463434722.db2.gz JAMNTAIPLAKSAZ-UHFFFAOYSA-N 1 2 340.412 2.168 20 70 EEIDLO CCc1ccc([C@@H](C)CC(=O)NC[C@@H](C)[NH+]2CCN(C)CC2)cc1 ZINC000160157915 529703850 /nfs/dbraw/zinc/70/38/50/529703850.db2.gz UKJOPOUCHLKCSW-DLBZAZTESA-N 1 2 331.504 2.495 20 70 EEIDLO COc1ccc([C@@H](NC(=O)NCCn2cc[nH+]c2)C(F)(F)F)cc1 ZINC000161504713 225641181 /nfs/dbraw/zinc/64/11/81/225641181.db2.gz OCFWNTBXRWPSKN-CYBMUJFWSA-N 1 2 342.321 2.495 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N[C@H]2CCOc3ccccc32)CCCC1 ZINC000159451568 277309616 /nfs/dbraw/zinc/30/96/16/277309616.db2.gz SKBIKDXRIYRDMF-HNNXBMFYSA-N 1 2 346.427 2.044 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N[C@H]2CCOc3ccccc32)CCCC1 ZINC000159451568 277309617 /nfs/dbraw/zinc/30/96/17/277309617.db2.gz SKBIKDXRIYRDMF-HNNXBMFYSA-N 1 2 346.427 2.044 20 70 EEIDLO Cc1[nH+]c2ccccc2n1CCCNC(=O)CCNC(=O)CC(C)C ZINC000160471625 463341520 /nfs/dbraw/zinc/34/15/20/463341520.db2.gz KVMNCUQLXBYKIK-UHFFFAOYSA-N 1 2 344.459 2.403 20 70 EEIDLO Cn1c(=O)cccc1C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000160819150 463373600 /nfs/dbraw/zinc/37/36/00/463373600.db2.gz VFWCFXXIZUQBAR-UHFFFAOYSA-N 1 2 332.429 2.080 20 70 EEIDLO CCOC(=O)C1(C(=O)Nc2cccc(C[NH+]3CCOCC3)c2)CCC1 ZINC000160930736 463383939 /nfs/dbraw/zinc/38/39/39/463383939.db2.gz SIAGBNRRUDEQBY-UHFFFAOYSA-N 1 2 346.427 2.191 20 70 EEIDLO CC[N@H+](CC(=O)N[C@@H](C)Cc1ccccc1C)Cc1cnn(C)c1 ZINC000161130749 463402317 /nfs/dbraw/zinc/40/23/17/463402317.db2.gz CUBJAJGCPFWHKK-INIZCTEOSA-N 1 2 328.460 2.298 20 70 EEIDLO CC[N@@H+](CC(=O)N[C@@H](C)Cc1ccccc1C)Cc1cnn(C)c1 ZINC000161130749 463402323 /nfs/dbraw/zinc/40/23/23/463402323.db2.gz CUBJAJGCPFWHKK-INIZCTEOSA-N 1 2 328.460 2.298 20 70 EEIDLO CC[C@@H]1C[N@H+](CC(=O)NC(=O)Nc2ccc(C)c(C)c2)C[C@@H](C)O1 ZINC000217140418 160216136 /nfs/dbraw/zinc/21/61/36/160216136.db2.gz SATQRQCBIZLYQE-GDBMZVCRSA-N 1 2 333.432 2.451 20 70 EEIDLO CC[C@@H]1C[N@@H+](CC(=O)NC(=O)Nc2ccc(C)c(C)c2)C[C@@H](C)O1 ZINC000217140418 160216138 /nfs/dbraw/zinc/21/61/38/160216138.db2.gz SATQRQCBIZLYQE-GDBMZVCRSA-N 1 2 333.432 2.451 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000161113509 311362471 /nfs/dbraw/zinc/36/24/71/311362471.db2.gz CTKHSDQDPSEHCY-ZDUSSCGKSA-N 1 2 343.431 2.228 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000161113509 311362472 /nfs/dbraw/zinc/36/24/72/311362472.db2.gz CTKHSDQDPSEHCY-ZDUSSCGKSA-N 1 2 343.431 2.228 20 70 EEIDLO Cc1ncsc1C[NH+]1CCN(C(=O)COc2ccc(F)cc2)CC1 ZINC000160623274 463356008 /nfs/dbraw/zinc/35/60/08/463356008.db2.gz VBLWFMCVXWJIHK-UHFFFAOYSA-N 1 2 349.431 2.314 20 70 EEIDLO CCc1nsc(N2CC[NH+](Cc3c(C)nc4ccccn43)CC2)n1 ZINC000160877964 463379364 /nfs/dbraw/zinc/37/93/64/463379364.db2.gz LODIMSBYKRUNCI-UHFFFAOYSA-N 1 2 342.472 2.379 20 70 EEIDLO C[N@H+](CCOCC1CC1)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000161016046 463390559 /nfs/dbraw/zinc/39/05/59/463390559.db2.gz SSDPBQLIVJRATB-CQSZACIVSA-N 1 2 341.249 2.334 20 70 EEIDLO C[N@@H+](CCOCC1CC1)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000161016046 463390565 /nfs/dbraw/zinc/39/05/65/463390565.db2.gz SSDPBQLIVJRATB-CQSZACIVSA-N 1 2 341.249 2.334 20 70 EEIDLO CC(=O)N1CCCc2cc(NC(=O)[C@H]3CCn4cc[nH+]c4C3)ccc21 ZINC000161085665 463398339 /nfs/dbraw/zinc/39/83/39/463398339.db2.gz POTNEDTUVIQHEO-HNNXBMFYSA-N 1 2 338.411 2.383 20 70 EEIDLO C[C@H](O)C[C@@H]1CCCN1C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161395527 463427624 /nfs/dbraw/zinc/42/76/24/463427624.db2.gz ULINGZDWNKVKJS-RDJZCZTQSA-N 1 2 347.459 2.286 20 70 EEIDLO Cc1cc(F)ccc1N1CC(=O)C(C(=O)N[C@H]2CCC[C@H]([NH3+])C2)=N1 ZINC000161452318 463430663 /nfs/dbraw/zinc/43/06/63/463430663.db2.gz BLXHNRRFZDKJJI-STQMWFEESA-N 1 2 332.379 2.025 20 70 EEIDLO CS(=O)(=O)NCC[C@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000161434211 539528252 /nfs/dbraw/zinc/52/82/52/539528252.db2.gz SJVUGMRVKPDZBR-CQSZACIVSA-N 1 2 343.518 2.314 20 70 EEIDLO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000161434211 539528254 /nfs/dbraw/zinc/52/82/54/539528254.db2.gz SJVUGMRVKPDZBR-CQSZACIVSA-N 1 2 343.518 2.314 20 70 EEIDLO Cn1c(SCCn2cc[nH+]c2)nnc1[C@@H]1COc2ccccc2O1 ZINC000159568749 311342958 /nfs/dbraw/zinc/34/29/58/311342958.db2.gz GJBMAWYMEPJOOA-AWEZNQCLSA-N 1 2 343.412 2.316 20 70 EEIDLO CCN(CC)c1ccc(CNC(=O)CNC(=O)CC2CCCC2)c[nH+]1 ZINC000160344320 311353101 /nfs/dbraw/zinc/35/31/01/311353101.db2.gz IFHCNCVBDUDGID-UHFFFAOYSA-N 1 2 346.475 2.241 20 70 EEIDLO CCOCc1ccccc1CNC(=O)C[N@H+](CC)Cc1cnn(C)c1 ZINC000161128234 463402576 /nfs/dbraw/zinc/40/25/76/463402576.db2.gz OGIRYTLLNUIIMP-UHFFFAOYSA-N 1 2 344.459 2.095 20 70 EEIDLO CCOCc1ccccc1CNC(=O)C[N@@H+](CC)Cc1cnn(C)c1 ZINC000161128234 463402582 /nfs/dbraw/zinc/40/25/82/463402582.db2.gz OGIRYTLLNUIIMP-UHFFFAOYSA-N 1 2 344.459 2.095 20 70 EEIDLO O=C(CN1CC[NH+](Cc2ccncc2)CC1)NCCC1=CCCCC1 ZINC000161165407 463406956 /nfs/dbraw/zinc/40/69/56/463406956.db2.gz UASAZIILPPGZBI-UHFFFAOYSA-N 1 2 342.487 2.206 20 70 EEIDLO O=C(NCC[NH+]1CCOCC1)NCC1(c2ccccc2Cl)CC1 ZINC000160641379 534340053 /nfs/dbraw/zinc/34/00/53/534340053.db2.gz UYAZCJNGTHVTEG-UHFFFAOYSA-N 1 2 337.851 2.003 20 70 EEIDLO C[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000159995161 225316441 /nfs/dbraw/zinc/31/64/41/225316441.db2.gz GPUHJZLLHMYYGD-HOCLYGCPSA-N 1 2 336.399 2.187 20 70 EEIDLO Cn1ncc2c1nc[nH+]c2S[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000159538767 311342524 /nfs/dbraw/zinc/34/25/24/311342524.db2.gz AJJMCWWGADTAPG-SECBINFHSA-N 1 2 345.350 2.009 20 70 EEIDLO Cn1cnnc1CSc1[nH+]cnc2c1cnn2-c1ccc(F)cc1 ZINC000161015747 311361146 /nfs/dbraw/zinc/36/11/46/311361146.db2.gz ZDKQQJWRSCQMFC-UHFFFAOYSA-N 1 2 341.375 2.375 20 70 EEIDLO COc1cc[nH+]cc1NC(=O)C(=O)NCCCc1ccc(Cl)cc1 ZINC000159363330 463281460 /nfs/dbraw/zinc/28/14/60/463281460.db2.gz BTUPLULIEYMAJY-UHFFFAOYSA-N 1 2 347.802 2.431 20 70 EEIDLO C[C@@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160390267 463333167 /nfs/dbraw/zinc/33/31/67/463333167.db2.gz XOQCGJDQWRAGAK-APWZRJJASA-N 1 2 346.471 2.066 20 70 EEIDLO C[C@@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160390267 463333173 /nfs/dbraw/zinc/33/31/73/463333173.db2.gz XOQCGJDQWRAGAK-APWZRJJASA-N 1 2 346.471 2.066 20 70 EEIDLO O=C1[C@@H]([NH+]2CCN(c3ccccc3)CC2)CCCN1CC(F)(F)F ZINC000160641691 463357342 /nfs/dbraw/zinc/35/73/42/463357342.db2.gz SXNOKLXILNAROI-HNNXBMFYSA-N 1 2 341.377 2.362 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@H]3OCC[N@@H+](C)[C@@H]3C2)c(C)c1C ZINC000160695358 463363519 /nfs/dbraw/zinc/36/35/19/463363519.db2.gz DWVUSERKTVBYSA-RTBURBONSA-N 1 2 345.487 2.453 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@H]3OCC[N@H+](C)[C@@H]3C2)c(C)c1C ZINC000160695358 463363522 /nfs/dbraw/zinc/36/35/22/463363522.db2.gz DWVUSERKTVBYSA-RTBURBONSA-N 1 2 345.487 2.453 20 70 EEIDLO CCCCN(C)C(=O)C1CC[NH+](Cc2nc(CC)cc(=O)[nH]2)CC1 ZINC000160927724 463382888 /nfs/dbraw/zinc/38/28/88/463382888.db2.gz BYIMSAALGPQFMA-UHFFFAOYSA-N 1 2 334.464 2.215 20 70 EEIDLO CC1(O)CC[NH+](CC(=O)Nc2ccc(Br)cc2F)CC1 ZINC000161199293 463409038 /nfs/dbraw/zinc/40/90/38/463409038.db2.gz KRRBQXQLETXCGR-UHFFFAOYSA-N 1 2 345.212 2.374 20 70 EEIDLO CC(=O)Nc1cc(C(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)ccc1F ZINC000161279011 463416010 /nfs/dbraw/zinc/41/60/10/463416010.db2.gz BKBVUZULBGFGJU-CQSZACIVSA-N 1 2 342.374 2.188 20 70 EEIDLO C[C@H](O)C[C@H]1CCCN1C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000161395796 463427346 /nfs/dbraw/zinc/42/73/46/463427346.db2.gz ULINGZDWNKVKJS-DOTOQJQBSA-N 1 2 347.459 2.286 20 70 EEIDLO Cc1nc(NCCC(=O)NCc2ccccn2)c2c([nH+]1)CCCC2 ZINC000161023843 534623329 /nfs/dbraw/zinc/62/33/29/534623329.db2.gz HSCSZHUMXWZYLQ-UHFFFAOYSA-N 1 2 325.416 2.177 20 70 EEIDLO CC(=O)c1c(C)[nH]c(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1C ZINC000160318414 527160338 /nfs/dbraw/zinc/16/03/38/527160338.db2.gz UFJOJRDSRUIEHL-UHFFFAOYSA-N 1 2 349.475 2.265 20 70 EEIDLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(OCCOC)c(OC)c2)[nH]1 ZINC000160326697 529740466 /nfs/dbraw/zinc/74/04/66/529740466.db2.gz VWUKGYJZTXBQGW-LBPRGKRZSA-N 1 2 334.420 2.252 20 70 EEIDLO CS(=O)(=O)CCCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000161090966 539524926 /nfs/dbraw/zinc/52/49/26/539524926.db2.gz PWRYFZQAPGNQSW-UHFFFAOYSA-N 1 2 330.881 2.287 20 70 EEIDLO C[N@@H+]1CCc2nc(NC(=O)C[C@@H]3CSCCS3)sc2C1 ZINC000160001954 283175317 /nfs/dbraw/zinc/17/53/17/283175317.db2.gz PBCJKRDCJYXEBU-SECBINFHSA-N 1 2 329.516 2.308 20 70 EEIDLO C[N@H+]1CCc2nc(NC(=O)C[C@@H]3CSCCS3)sc2C1 ZINC000160001954 283175318 /nfs/dbraw/zinc/17/53/18/283175318.db2.gz PBCJKRDCJYXEBU-SECBINFHSA-N 1 2 329.516 2.308 20 70 EEIDLO CN(CC(=O)Nc1cccc(Cl)c1)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000159746628 276823882 /nfs/dbraw/zinc/82/38/82/276823882.db2.gz WOWUWESIOZFIIT-LBPRGKRZSA-N 1 2 346.818 2.196 20 70 EEIDLO CN(CC1CCOCC1)C(=O)Nc1ccccc1C[NH+]1CCOCC1 ZINC000159658820 311344302 /nfs/dbraw/zinc/34/43/02/311344302.db2.gz MUUNDOFTKPHQOX-UHFFFAOYSA-N 1 2 347.459 2.409 20 70 EEIDLO O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CC[NH+](Cc2ccccn2)CC1 ZINC000159634479 463296424 /nfs/dbraw/zinc/29/64/24/463296424.db2.gz ITXYBPGJFZVEMC-RBUKOAKNSA-N 1 2 336.439 2.465 20 70 EEIDLO Cn1cc[nH+]c1CN1CCN(Cc2csc(C(C)(C)C)n2)CC1 ZINC000160794393 463371892 /nfs/dbraw/zinc/37/18/92/463371892.db2.gz PKVAHKFNWGSTLV-UHFFFAOYSA-N 1 2 333.505 2.492 20 70 EEIDLO CCc1nc(-c2ccccc2NC(=O)[C@@H](C)[NH+]2CCSCC2)n[nH]1 ZINC000161250963 463413958 /nfs/dbraw/zinc/41/39/58/463413958.db2.gz ZSNWCZLXYAMHDJ-GFCCVEGCSA-N 1 2 345.472 2.410 20 70 EEIDLO COc1ccc(NC(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc1N ZINC000161278883 463415840 /nfs/dbraw/zinc/41/58/40/463415840.db2.gz DJUAJVQJMIRKKM-XNJGSVPQSA-N 1 2 335.448 2.350 20 70 EEIDLO Cc1noc(C)c1CCS(=O)(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000159618746 311343877 /nfs/dbraw/zinc/34/38/77/311343877.db2.gz CWFNQTDEMYGJMP-UHFFFAOYSA-N 1 2 333.413 2.405 20 70 EEIDLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccc(C(C)=O)cc1 ZINC000161079256 311361901 /nfs/dbraw/zinc/36/19/01/311361901.db2.gz VAXWRCLLQJZSEH-ZDUSSCGKSA-N 1 2 328.416 2.472 20 70 EEIDLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)C(=O)Nc1ccc(C(C)=O)cc1 ZINC000161079256 311361902 /nfs/dbraw/zinc/36/19/02/311361902.db2.gz VAXWRCLLQJZSEH-ZDUSSCGKSA-N 1 2 328.416 2.472 20 70 EEIDLO CC1(C)Cc2cccc(C[NH+]3CCN(C(=O)[C@@H]4CCCO4)CC3)c2O1 ZINC000160989636 463388224 /nfs/dbraw/zinc/38/82/24/463388224.db2.gz BOVAMYDZPWAZDH-KRWDZBQOSA-N 1 2 344.455 2.223 20 70 EEIDLO CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000160371718 527066925 /nfs/dbraw/zinc/06/69/25/527066925.db2.gz FYTBFXTVZJVQNC-MRXNPFEDSA-N 1 2 339.399 2.440 20 70 EEIDLO CC1(C)Cc2cccc(C[NH+]3CCN(C(=O)[C@H]4CCCO4)CC3)c2O1 ZINC000160989760 527777035 /nfs/dbraw/zinc/77/70/35/527777035.db2.gz BOVAMYDZPWAZDH-QGZVFWFLSA-N 1 2 344.455 2.223 20 70 EEIDLO CCCn1c(C)nnc1C[N@@H+]1CCCN(c2nc(CC)ns2)CC1 ZINC000160112491 528813684 /nfs/dbraw/zinc/81/36/84/528813684.db2.gz SWUHOMNUGQLFEU-UHFFFAOYSA-N 1 2 349.508 2.123 20 70 EEIDLO CCCn1c(C)nnc1C[N@H+]1CCCN(c2nc(CC)ns2)CC1 ZINC000160112491 528813686 /nfs/dbraw/zinc/81/36/86/528813686.db2.gz SWUHOMNUGQLFEU-UHFFFAOYSA-N 1 2 349.508 2.123 20 70 EEIDLO COc1ccc(C)cc1NC(=O)[C@@H](C)SCC[NH+]1CCOCC1 ZINC000159789415 311346242 /nfs/dbraw/zinc/34/62/42/311346242.db2.gz FLXIITUANSXYHE-CQSZACIVSA-N 1 2 338.473 2.396 20 70 EEIDLO CC(C)[C@H](SCC[NH+]1CCOCC1)C(=O)N1CCC[C@@H](C)C1 ZINC000159957605 311348229 /nfs/dbraw/zinc/34/82/29/311348229.db2.gz QKWJMMXSENJMPF-CVEARBPZSA-N 1 2 328.522 2.335 20 70 EEIDLO CCC(=O)N1CCC[N@@H+]([C@H]2CCN(c3ccc(C)cc3)C2=O)CC1 ZINC000159469154 463288383 /nfs/dbraw/zinc/28/83/83/463288383.db2.gz GTWKNFQBRKCSLP-KRWDZBQOSA-N 1 2 329.444 2.045 20 70 EEIDLO CCC(=O)N1CCC[N@H+]([C@H]2CCN(c3ccc(C)cc3)C2=O)CC1 ZINC000159469154 463288386 /nfs/dbraw/zinc/28/83/86/463288386.db2.gz GTWKNFQBRKCSLP-KRWDZBQOSA-N 1 2 329.444 2.045 20 70 EEIDLO O=C(Nc1ccc(N2CCOC2=O)cc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000160279735 463324790 /nfs/dbraw/zinc/32/47/90/463324790.db2.gz JUVFHHKZVRVXIB-GFCCVEGCSA-N 1 2 326.356 2.041 20 70 EEIDLO C[N@@H+]1CCO[C@H]2CN(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3)C[C@@H]21 ZINC000160269087 463325497 /nfs/dbraw/zinc/32/54/97/463325497.db2.gz NDVYRUAVVVGGAJ-BDXSIMOUSA-N 1 2 329.444 2.047 20 70 EEIDLO C[N@H+]1CCO[C@H]2CN(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3)C[C@@H]21 ZINC000160269087 463325502 /nfs/dbraw/zinc/32/55/02/463325502.db2.gz NDVYRUAVVVGGAJ-BDXSIMOUSA-N 1 2 329.444 2.047 20 70 EEIDLO NC(=O)[C@H]1CCC[N@@H+]1Cc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000160311282 463327420 /nfs/dbraw/zinc/32/74/20/463327420.db2.gz CDBGGJDFAOYHFC-CYBMUJFWSA-N 1 2 349.232 2.289 20 70 EEIDLO NC(=O)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000160311282 463327423 /nfs/dbraw/zinc/32/74/23/463327423.db2.gz CDBGGJDFAOYHFC-CYBMUJFWSA-N 1 2 349.232 2.289 20 70 EEIDLO FC(F)C(F)(F)CN1CCN(Cc2c[nH+]c3ccccn23)CC1 ZINC000160417615 463337603 /nfs/dbraw/zinc/33/76/03/463337603.db2.gz AUNXUWRMDSVNNA-UHFFFAOYSA-N 1 2 330.329 2.352 20 70 EEIDLO CCCC[N@H+](Cc1cccc(OC)c1OC)[C@H]1CCS(=O)(=O)C1 ZINC000160775802 463369494 /nfs/dbraw/zinc/36/94/94/463369494.db2.gz AGNNEMYIQYPCNZ-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO CCCC[N@@H+](Cc1cccc(OC)c1OC)[C@H]1CCS(=O)(=O)C1 ZINC000160775802 463369498 /nfs/dbraw/zinc/36/94/98/463369498.db2.gz AGNNEMYIQYPCNZ-HNNXBMFYSA-N 1 2 341.473 2.493 20 70 EEIDLO C[C@@H]1[C@H](C)OCCN1C(=O)NCc1cc[nH+]c(N2CCCCC2)c1 ZINC000161047301 463393786 /nfs/dbraw/zinc/39/37/86/463393786.db2.gz FGEBRAQPYFZZRF-CABCVRRESA-N 1 2 332.448 2.391 20 70 EEIDLO C[C@H]1OCCN(C(=O)NCc2cc[nH+]c(N3CCCCC3)c2)[C@@H]1C ZINC000161047550 463394433 /nfs/dbraw/zinc/39/44/33/463394433.db2.gz FGEBRAQPYFZZRF-HUUCEWRRSA-N 1 2 332.448 2.391 20 70 EEIDLO C[C@@H](C(=O)NCC1CCCCC1)N1CC[NH+](Cc2ccncc2)CC1 ZINC000161180800 463408354 /nfs/dbraw/zinc/40/83/54/463408354.db2.gz GYHIUWOXQLPFOV-KRWDZBQOSA-N 1 2 344.503 2.284 20 70 EEIDLO C[C@@H](C(=O)NCC1CCCCC1)[NH+]1CCN(Cc2ccncc2)CC1 ZINC000161180800 463408360 /nfs/dbraw/zinc/40/83/60/463408360.db2.gz GYHIUWOXQLPFOV-KRWDZBQOSA-N 1 2 344.503 2.284 20 70 EEIDLO O=C(Nc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161335857 463421909 /nfs/dbraw/zinc/42/19/09/463421909.db2.gz QPMXKAKREMMPLG-CYBMUJFWSA-N 1 2 344.390 2.060 20 70 EEIDLO CC(C)(C)S(=O)(=O)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000161443639 463431026 /nfs/dbraw/zinc/43/10/26/463431026.db2.gz OKSZSWSYYZIWLM-UHFFFAOYSA-N 1 2 339.392 2.163 20 70 EEIDLO Cc1cccn2cc(CCNC(=O)N(C)CC3CCOCC3)[nH+]c12 ZINC000159631085 539517209 /nfs/dbraw/zinc/51/72/09/539517209.db2.gz IVGZCHLDNNDJAY-UHFFFAOYSA-N 1 2 330.432 2.253 20 70 EEIDLO COc1ccccc1[C@@H](NC(=O)[C@H]1CCCCO1)c1[nH+]ccn1C ZINC000160320673 463329067 /nfs/dbraw/zinc/32/90/67/463329067.db2.gz AIBCDIBCTRTVPX-HZPDHXFCSA-N 1 2 329.400 2.203 20 70 EEIDLO C[C@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160390136 463332889 /nfs/dbraw/zinc/33/28/89/463332889.db2.gz XOQCGJDQWRAGAK-LPHOPBHVSA-N 1 2 346.471 2.066 20 70 EEIDLO C[C@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CCOCC1 ZINC000160390136 463332893 /nfs/dbraw/zinc/33/28/93/463332893.db2.gz XOQCGJDQWRAGAK-LPHOPBHVSA-N 1 2 346.471 2.066 20 70 EEIDLO CC(=O)Nc1ccc(F)c(C(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000161291617 463416711 /nfs/dbraw/zinc/41/67/11/463416711.db2.gz RAHZGOHJGSOOTE-AWEZNQCLSA-N 1 2 342.374 2.188 20 70 EEIDLO CCCCC[NH+]1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1 ZINC000216683749 160216087 /nfs/dbraw/zinc/21/60/87/160216087.db2.gz GSNISGANRGYSIY-UHFFFAOYSA-N 1 2 332.416 2.461 20 70 EEIDLO COC[C@@H](NC(=O)Nc1ccccc1C[NH+]1CCOCC1)C1CC1 ZINC000159385120 225207643 /nfs/dbraw/zinc/20/76/43/225207643.db2.gz DUSNYBAXHSJCRA-QGZVFWFLSA-N 1 2 333.432 2.065 20 70 EEIDLO Cn1cc[nH+]c1[C@H](NC(=O)N1CCC[C@@](C)(O)C1)c1cccc(F)c1 ZINC000160034171 225324239 /nfs/dbraw/zinc/32/42/39/225324239.db2.gz BOBLNJHUJCOGHF-CRAIPNDOSA-N 1 2 346.406 2.205 20 70 EEIDLO O=C(c1ccc(=O)[nH]c1)N1CC[NH+](CCc2ccccc2Cl)CC1 ZINC000159435459 311341510 /nfs/dbraw/zinc/34/15/10/311341510.db2.gz ABJAPMBQAZPARB-UHFFFAOYSA-N 1 2 345.830 2.029 20 70 EEIDLO CC(C)CCn1cccc1C[NH+]1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC000161041471 311361272 /nfs/dbraw/zinc/36/12/72/311361272.db2.gz LITVNJBAGGYEPW-SFHVURJKSA-N 1 2 333.476 2.357 20 70 EEIDLO CC(C)N(C(=O)[C@H](C)[NH+]1CCN(Cc2ccncc2)CC1)C(C)C ZINC000161230839 311363798 /nfs/dbraw/zinc/36/37/98/311363798.db2.gz XTNWIMJRBLIBLO-KRWDZBQOSA-N 1 2 332.492 2.233 20 70 EEIDLO CC(C)N(C(=O)[C@H](C)N1CC[NH+](Cc2ccncc2)CC1)C(C)C ZINC000161230839 311363799 /nfs/dbraw/zinc/36/37/99/311363799.db2.gz XTNWIMJRBLIBLO-KRWDZBQOSA-N 1 2 332.492 2.233 20 70 EEIDLO O=C(NCCNc1nc2ccccc2s1)[C@H]1CCn2cc[nH+]c2C1 ZINC000159607471 463294970 /nfs/dbraw/zinc/29/49/70/463294970.db2.gz VRSXZJCRNXDZHP-LBPRGKRZSA-N 1 2 341.440 2.284 20 70 EEIDLO CCc1ncc(NC(=O)NCc2cc[nH+]c(N3CCCC3)c2)cn1 ZINC000161185715 463407514 /nfs/dbraw/zinc/40/75/14/463407514.db2.gz CZPRBKKDWYVJCE-UHFFFAOYSA-N 1 2 326.404 2.356 20 70 EEIDLO Cc1nnc(-c2ccc(C(=O)N[C@H]3CCN(c4cccc[nH+]4)C3)cc2)o1 ZINC000161289350 463417365 /nfs/dbraw/zinc/41/73/65/463417365.db2.gz BOTRJEDVMGYQGM-INIZCTEOSA-N 1 2 349.394 2.449 20 70 EEIDLO C[C@@H](C(=O)N[C@H]1CCN(c2cccc[nH+]2)C1)n1cnc2ccccc21 ZINC000161381907 463426239 /nfs/dbraw/zinc/42/62/39/463426239.db2.gz RBAVINROPILLJG-GJZGRUSLSA-N 1 2 335.411 2.387 20 70 EEIDLO Cc1cc(F)ccc1N1CC(=O)C(C(=O)N[C@@H]2CCC[C@@H]([NH3+])C2)=N1 ZINC000161452427 463430982 /nfs/dbraw/zinc/43/09/82/463430982.db2.gz BLXHNRRFZDKJJI-CHWSQXEVSA-N 1 2 332.379 2.025 20 70 EEIDLO CC[C@H](C)OCC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCOCC1 ZINC000159756392 529185434 /nfs/dbraw/zinc/18/54/34/529185434.db2.gz PDZDWKINKGTZBW-WMZOPIPTSA-N 1 2 334.460 2.300 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N(C)Cc2ccccc2OC)CCCC1 ZINC000159445438 533225587 /nfs/dbraw/zinc/22/55/87/533225587.db2.gz VBGQPKXPAYAHOD-UHFFFAOYSA-N 1 2 348.443 2.071 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N(C)Cc2ccccc2OC)CCCC1 ZINC000159445438 533225597 /nfs/dbraw/zinc/22/55/97/533225597.db2.gz VBGQPKXPAYAHOD-UHFFFAOYSA-N 1 2 348.443 2.071 20 70 EEIDLO C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2cccc3nc[nH]c32)cc1 ZINC000159773675 311346261 /nfs/dbraw/zinc/34/62/61/311346261.db2.gz WYQCGCFYQYOOEH-UHFFFAOYSA-N 1 2 337.383 2.315 20 70 EEIDLO O=C(C[NH+]1CCC([C@@H](O)C(F)(F)F)CC1)NCc1ccccc1F ZINC000161423204 311365714 /nfs/dbraw/zinc/36/57/14/311365714.db2.gz XETVEKNCSKVYDD-OAHLLOKOSA-N 1 2 348.340 2.077 20 70 EEIDLO CN(CC(C)(C)C[NH+]1CCOCC1)S(=O)(=O)CC1CCCCC1 ZINC000159432472 463285299 /nfs/dbraw/zinc/28/52/99/463285299.db2.gz WSNLPWHLRAPWMV-UHFFFAOYSA-N 1 2 346.537 2.187 20 70 EEIDLO CC(C)S(=O)(=O)CCC[N@@H+]1CCCN(Cc2ccccc2)CC1 ZINC000160628846 463356142 /nfs/dbraw/zinc/35/61/42/463356142.db2.gz CZPZLLTTYIUWNF-UHFFFAOYSA-N 1 2 338.517 2.408 20 70 EEIDLO CC(C)S(=O)(=O)CCC[N@H+]1CCCN(Cc2ccccc2)CC1 ZINC000160628846 463356144 /nfs/dbraw/zinc/35/61/44/463356144.db2.gz CZPZLLTTYIUWNF-UHFFFAOYSA-N 1 2 338.517 2.408 20 70 EEIDLO COC(=O)c1ccc(CN2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000161140100 463403480 /nfs/dbraw/zinc/40/34/80/463403480.db2.gz QTIQLZARYRGOHL-UHFFFAOYSA-N 1 2 325.412 2.186 20 70 EEIDLO CCC[C@H]1C(=O)NCCN1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000161215588 463410009 /nfs/dbraw/zinc/41/00/09/463410009.db2.gz HDZSPYWHKDKDOH-HNNXBMFYSA-N 1 2 341.415 2.220 20 70 EEIDLO Cc1nc(Cl)ccc1C(=O)N1CC[NH+](CCOC(C)C)CC1 ZINC000159685164 534427676 /nfs/dbraw/zinc/42/76/76/534427676.db2.gz NCULCLOBAHKMCB-UHFFFAOYSA-N 1 2 325.840 2.226 20 70 EEIDLO CC(=O)N(c1nc(CSCC[NH+]2CCOCC2)cs1)C1CC1 ZINC000160067701 526506917 /nfs/dbraw/zinc/50/69/17/526506917.db2.gz AQBAGCMNDLRFFH-UHFFFAOYSA-N 1 2 341.502 2.224 20 70 EEIDLO CC[N@H+](CC(=O)Nc1ccccc1OC(F)F)Cc1cnn(C)c1 ZINC000161090690 311361670 /nfs/dbraw/zinc/36/16/70/311361670.db2.gz TWSDRLLMVDCJMI-UHFFFAOYSA-N 1 2 338.358 2.482 20 70 EEIDLO CC[N@@H+](CC(=O)Nc1ccccc1OC(F)F)Cc1cnn(C)c1 ZINC000161090690 311361673 /nfs/dbraw/zinc/36/16/73/311361673.db2.gz TWSDRLLMVDCJMI-UHFFFAOYSA-N 1 2 338.358 2.482 20 70 EEIDLO COC(=O)C1([N@H+](C)CC(=O)N[C@@H](C)Cc2ccccc2C)CCCC1 ZINC000159482477 463289081 /nfs/dbraw/zinc/28/90/81/463289081.db2.gz KQVRZUFIHFUUHN-INIZCTEOSA-N 1 2 346.471 2.460 20 70 EEIDLO COC(=O)C1([N@@H+](C)CC(=O)N[C@@H](C)Cc2ccccc2C)CCCC1 ZINC000159482477 463289085 /nfs/dbraw/zinc/28/90/85/463289085.db2.gz KQVRZUFIHFUUHN-INIZCTEOSA-N 1 2 346.471 2.460 20 70 EEIDLO CC[C@@H](COC)NC(=O)NC[C@H](c1c(F)cccc1F)[NH+](C)C ZINC000160118414 463319606 /nfs/dbraw/zinc/31/96/06/463319606.db2.gz BDSGHEJSWVZDAK-SMDDNHRTSA-N 1 2 329.391 2.292 20 70 EEIDLO CCSCC[C@@H](C)NC(=O)N1CC[NH+](Cc2ccccn2)CC1 ZINC000160499821 463343885 /nfs/dbraw/zinc/34/38/85/463343885.db2.gz LZMCIRKBXPJQFR-OAHLLOKOSA-N 1 2 336.505 2.441 20 70 EEIDLO CC[N@H+](CC(=O)Nc1cccc(OC)c1)Cc1c[nH]c(C(=O)OC)c1 ZINC000160649374 463358725 /nfs/dbraw/zinc/35/87/25/463358725.db2.gz ZKAJGGRESLGBES-UHFFFAOYSA-N 1 2 345.399 2.271 20 70 EEIDLO CC[N@@H+](CC(=O)Nc1cccc(OC)c1)Cc1c[nH]c(C(=O)OC)c1 ZINC000160649374 463358728 /nfs/dbraw/zinc/35/87/28/463358728.db2.gz ZKAJGGRESLGBES-UHFFFAOYSA-N 1 2 345.399 2.271 20 70 EEIDLO CN(Cc1[nH+]ccn1C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000160680268 463362983 /nfs/dbraw/zinc/36/29/83/463362983.db2.gz ITUXGDBJUIACRZ-JKSUJKDBSA-N 1 2 328.416 2.482 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@@H]3[C@H](C2)OCC[N@H+]3C)c(C)c1C ZINC000160695635 463363892 /nfs/dbraw/zinc/36/38/92/463363892.db2.gz DWVUSERKTVBYSA-MOPGFXCFSA-N 1 2 345.487 2.453 20 70 EEIDLO Cc1c(C)c(C)c(CNC(=O)N2C[C@@H]3[C@H](C2)OCC[N@@H+]3C)c(C)c1C ZINC000160695635 463363896 /nfs/dbraw/zinc/36/38/96/463363896.db2.gz DWVUSERKTVBYSA-MOPGFXCFSA-N 1 2 345.487 2.453 20 70 EEIDLO Cn1cccc1C[N@H+](C)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000161246184 463412756 /nfs/dbraw/zinc/41/27/56/463412756.db2.gz LNTFORKPEWXWEE-AWEZNQCLSA-N 1 2 336.233 2.446 20 70 EEIDLO Cn1cccc1C[N@@H+](C)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000161246184 463412760 /nfs/dbraw/zinc/41/27/60/463412760.db2.gz LNTFORKPEWXWEE-AWEZNQCLSA-N 1 2 336.233 2.446 20 70 EEIDLO CCN(Cc1ccccc1)C(=O)[C@H](C)SCC[NH+]1CCOCC1 ZINC000160009209 528828214 /nfs/dbraw/zinc/82/82/14/528828214.db2.gz NUNGMFDPOKUJQG-INIZCTEOSA-N 1 2 336.501 2.489 20 70 EEIDLO Cc1ccc(CN(C(=O)CSCC[NH+]2CCOCC2)C2CC2)o1 ZINC000159814447 311346490 /nfs/dbraw/zinc/34/64/90/311346490.db2.gz JTZRMLYPPYMSQH-UHFFFAOYSA-N 1 2 338.473 2.144 20 70 EEIDLO CC(C)NC(=O)Cc1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000159649590 463297630 /nfs/dbraw/zinc/29/76/30/463297630.db2.gz GYRVBSQHJRYWLK-OAHLLOKOSA-N 1 2 340.427 2.151 20 70 EEIDLO O=C(N[C@@H]1CCN(c2cccc[nH+]2)C1)c1ccn(-c2ccccc2)n1 ZINC000161310652 463418773 /nfs/dbraw/zinc/41/87/73/463418773.db2.gz DIUMJTQLBVOVJZ-OAHLLOKOSA-N 1 2 333.395 2.276 20 70 EEIDLO