smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCCN(C)CCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001648785778 1079565615 /nfs/dbraw/zinc/56/56/15/1079565615.db2.gz DHLUXTKUUJPGMB-UHFFFAOYSA-N 1 1 364.574 4.045 20 10 FICDMO COc1cc(C[N@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c(O)cc1C ZINC000160213953 1079636447 /nfs/dbraw/zinc/63/64/47/1079636447.db2.gz NAJDZXVDGKCCNB-UHFFFAOYSA-N 1 1 357.294 4.026 20 10 FICDMO COc1ccc(N2CCC[N@@H+](CCCOc3cccc(Cl)c3)CC2)cc1 ZINC001167107623 1080552197 /nfs/dbraw/zinc/55/21/97/1080552197.db2.gz FNAHEXDNSAITJU-UHFFFAOYSA-N 1 1 374.912 4.330 20 10 FICDMO O=C(C[N@H+]1CC[C@@]2(CCOC2)C1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255343739 1082762669 /nfs/dbraw/zinc/76/26/69/1082762669.db2.gz KUKXPWWZKGMCBC-OAQYLSRUSA-N 1 1 364.449 4.153 20 10 FICDMO COc1cc(C[N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)ccc1SC ZINC000177270002 1083800118 /nfs/dbraw/zinc/80/01/18/1083800118.db2.gz BWSAGZRZJAZUDS-UHFFFAOYSA-N 1 1 363.454 4.096 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)ccc1SC ZINC000177270002 1083800135 /nfs/dbraw/zinc/80/01/35/1083800135.db2.gz BWSAGZRZJAZUDS-UHFFFAOYSA-N 1 1 363.454 4.096 20 10 FICDMO c1cc(N2CCOCC2)ccc1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000121985017 1085923697 /nfs/dbraw/zinc/92/36/97/1085923697.db2.gz HNSBJKWVDOSCIG-UHFFFAOYSA-N 1 1 351.494 4.126 20 10 FICDMO C[C@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1cc(Cl)c(Cl)cc1O ZINC000278227064 1086631147 /nfs/dbraw/zinc/63/11/47/1086631147.db2.gz JSMHJUMQLHXTCN-NSHDSACASA-N 1 1 367.276 4.252 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cc2n(n1)CCC2 ZINC000840719675 1095668192 /nfs/dbraw/zinc/66/81/92/1095668192.db2.gz IGOYSBZHHQOEIU-QGZVFWFLSA-N 1 1 352.526 4.449 20 10 FICDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)Cc2cccc(=O)[nH]2)cc1 ZINC000897391364 1101591219 /nfs/dbraw/zinc/59/12/19/1101591219.db2.gz NATFXADLBLDCKA-UHFFFAOYSA-N 1 1 353.491 4.117 20 10 FICDMO C[C@H]([NH2+]Cc1cccnc1-n1cccn1)c1cc(Cl)c(Cl)cc1O ZINC000192654094 1101967000 /nfs/dbraw/zinc/96/70/00/1101967000.db2.gz KDWQXIHOWPQFFV-NSHDSACASA-N 1 1 363.248 4.131 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1CCC[C@H](C(F)(F)F)O1 ZINC001167982233 1102786131 /nfs/dbraw/zinc/78/61/31/1102786131.db2.gz ALSSIUKBCVAUQW-SJLPKXTDSA-N 1 1 369.383 4.487 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCSC[C@H]3C3CCC3)cc2)CC1 ZINC000842170526 1112423214 /nfs/dbraw/zinc/42/32/14/1112423214.db2.gz HVRNMFKGCRUBSQ-NRFANRHFSA-N 1 1 360.567 4.019 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H](O)c1ccc(Cl)cc1 ZINC000111232808 1112890164 /nfs/dbraw/zinc/89/01/64/1112890164.db2.gz ZSZUJNJXKUDNDG-HXUWFJFHSA-N 1 1 357.837 4.374 20 10 FICDMO COC(=O)c1c(C[N@@H+]2CCCc3sccc3C2)c2cc(F)ccc2n1C ZINC000911596085 1114001811 /nfs/dbraw/zinc/00/18/11/1114001811.db2.gz OYBSSSDBJNVWET-UHFFFAOYSA-N 1 1 372.465 4.114 20 10 FICDMO COC(=O)c1c(C[N@H+]2CCCc3sccc3C2)c2cc(F)ccc2n1C ZINC000911596085 1114001815 /nfs/dbraw/zinc/00/18/15/1114001815.db2.gz OYBSSSDBJNVWET-UHFFFAOYSA-N 1 1 372.465 4.114 20 10 FICDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000762073333 1120695121 /nfs/dbraw/zinc/69/51/21/1120695121.db2.gz IOMOAPGSHSOFDX-UHFFFAOYSA-N 1 1 373.541 4.369 20 10 FICDMO Cc1cc(O)c(C[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)cc1C ZINC000762557131 1120930347 /nfs/dbraw/zinc/93/03/47/1120930347.db2.gz RDOMDMZKJAHMQS-FQEVSTJZSA-N 1 1 355.869 4.275 20 10 FICDMO COc1ccc(N2CCC[N@H+](Cc3nc4ccc(F)cc4s3)CC2)cc1 ZINC000762981532 1121067777 /nfs/dbraw/zinc/06/77/77/1121067777.db2.gz WWDHVKHGWBLBRZ-UHFFFAOYSA-N 1 1 371.481 4.156 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3nc4ccc(F)cc4s3)CC2)cc1 ZINC000762981532 1121067786 /nfs/dbraw/zinc/06/77/86/1121067786.db2.gz WWDHVKHGWBLBRZ-UHFFFAOYSA-N 1 1 371.481 4.156 20 10 FICDMO COc1ccc(Br)c(C[N@H+](C)Cc2cc(C)ccc2O)c1 ZINC000763378748 1121554688 /nfs/dbraw/zinc/55/46/88/1121554688.db2.gz DSYZNGZNSUIIKJ-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO COc1ccc(Br)c(C[N@@H+](C)Cc2cc(C)ccc2O)c1 ZINC000763378748 1121554693 /nfs/dbraw/zinc/55/46/93/1121554693.db2.gz DSYZNGZNSUIIKJ-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO C[N@@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccc(N2CCCCC2)cc1 ZINC000917020957 1122007907 /nfs/dbraw/zinc/00/79/07/1122007907.db2.gz XDCSKRFIARCEOX-UHFFFAOYSA-N 1 1 369.484 4.277 20 10 FICDMO CN(C)c1ccc(C[N@H+](CC(=O)Nc2cccc(Cl)c2)C2CC2)cc1 ZINC000917075455 1122070406 /nfs/dbraw/zinc/07/04/06/1122070406.db2.gz WCOMFQGLMJMOCH-UHFFFAOYSA-N 1 1 357.885 4.009 20 10 FICDMO CN(C)c1ccc(C[N@@H+](CC(=O)Nc2cccc(Cl)c2)C2CC2)cc1 ZINC000917075455 1122070411 /nfs/dbraw/zinc/07/04/11/1122070411.db2.gz WCOMFQGLMJMOCH-UHFFFAOYSA-N 1 1 357.885 4.009 20 10 FICDMO Oc1cc2c(cc1C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1)OCO2 ZINC000917473528 1122321317 /nfs/dbraw/zinc/32/13/17/1122321317.db2.gz DAHDVRCAWVXGIP-UHFFFAOYSA-N 1 1 365.351 4.304 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCN(C(=O)c3ccsc3)CC2)cc1C(C)C ZINC000917487655 1122332765 /nfs/dbraw/zinc/33/27/65/1122332765.db2.gz JORGTNZUEYTIEW-UHFFFAOYSA-N 1 1 372.534 4.234 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cccc2c1OCCCO2 ZINC000154727801 1122643012 /nfs/dbraw/zinc/64/30/12/1122643012.db2.gz YIWURCGINVKHSK-UHFFFAOYSA-N 1 1 365.429 4.349 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccc2c1OCCCO2 ZINC000154727801 1122643019 /nfs/dbraw/zinc/64/30/19/1122643019.db2.gz YIWURCGINVKHSK-UHFFFAOYSA-N 1 1 365.429 4.349 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1O ZINC000155016167 1123042126 /nfs/dbraw/zinc/04/21/26/1123042126.db2.gz LZLWHYFHQLJNNY-KGVIQGDOSA-N 1 1 368.521 4.242 20 10 FICDMO CC(C)n1ncc2cc(C[N@H+](C)Cc3ccc(N(C)C)cc3)c(Cl)nc21 ZINC000155196998 1123377337 /nfs/dbraw/zinc/37/73/37/1123377337.db2.gz NQJKUEVNNOBSOP-UHFFFAOYSA-N 1 1 371.916 4.364 20 10 FICDMO CC(C)n1ncc2cc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c(Cl)nc21 ZINC000155196998 1123377342 /nfs/dbraw/zinc/37/73/42/1123377342.db2.gz NQJKUEVNNOBSOP-UHFFFAOYSA-N 1 1 371.916 4.364 20 10 FICDMO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H](c2ccccc2)O1 ZINC000920306514 1123437626 /nfs/dbraw/zinc/43/76/26/1123437626.db2.gz VZGOLZIMOSFEQG-QRWLVFNGSA-N 1 1 355.478 4.357 20 10 FICDMO COc1ccc(N2CCC[N@H+](Cc3csc(CCC(C)C)n3)CC2)cc1 ZINC000920837919 1123526302 /nfs/dbraw/zinc/52/63/02/1123526302.db2.gz AGYYNDUOEPRUHQ-UHFFFAOYSA-N 1 1 373.566 4.453 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3csc(CCC(C)C)n3)CC2)cc1 ZINC000920837919 1123526303 /nfs/dbraw/zinc/52/63/03/1123526303.db2.gz AGYYNDUOEPRUHQ-UHFFFAOYSA-N 1 1 373.566 4.453 20 10 FICDMO COc1ccc(O)c(C[N@@H+](C)CCCc2cc(-c3ccccc3)no2)c1 ZINC000179909299 1124139130 /nfs/dbraw/zinc/13/91/30/1124139130.db2.gz KCLIBGAMHSAHEG-UHFFFAOYSA-N 1 1 352.434 4.120 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(F)cc1 ZINC000765852036 1124219581 /nfs/dbraw/zinc/21/95/81/1124219581.db2.gz JEEJQNXRXAWOSL-OAQYLSRUSA-N 1 1 373.491 4.348 20 10 FICDMO Cc1[nH+]c(N2CCOCC2)ccc1N[C@@H](C)c1ccc2ccccc2c1O ZINC000186489405 1124709325 /nfs/dbraw/zinc/70/93/25/1124709325.db2.gz BZHRQNDQXXWGQM-HNNXBMFYSA-N 1 1 363.461 4.259 20 10 FICDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143104226 1125265165 /nfs/dbraw/zinc/26/51/65/1125265165.db2.gz QYJXYHRGVJRLBM-YJBOKZPZSA-N 1 1 374.525 4.131 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc(C)cc3)o2)c1 ZINC000182428352 1125476178 /nfs/dbraw/zinc/47/61/78/1125476178.db2.gz OEKNDOQYKDPGTI-KBPBESRZSA-N 1 1 353.422 4.171 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000183115277 1125750981 /nfs/dbraw/zinc/75/09/81/1125750981.db2.gz DBYYJFPDNNTPEB-QFIPXVFZSA-N 1 1 365.429 4.138 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000183115277 1125750988 /nfs/dbraw/zinc/75/09/88/1125750988.db2.gz DBYYJFPDNNTPEB-QFIPXVFZSA-N 1 1 365.429 4.138 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1c[nH]nc1-c1cccs1)C[C@H]1CCCO1 ZINC000160178374 1079548077 /nfs/dbraw/zinc/54/80/77/1079548077.db2.gz UISAYVIOLHFXFN-QGZVFWFLSA-N 1 1 369.490 4.025 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000274832828 1080205362 /nfs/dbraw/zinc/20/53/62/1080205362.db2.gz MQGYAGDBIJWTEX-VXGBXAGGSA-N 1 1 357.385 4.002 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)cc1OC ZINC000160271452 1080676804 /nfs/dbraw/zinc/67/68/04/1080676804.db2.gz OFYFUPMRUOQKTG-KRWDZBQOSA-N 1 1 359.491 4.008 20 10 FICDMO CCC[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc(F)cc1F ZINC001167237762 1080890837 /nfs/dbraw/zinc/89/08/37/1080890837.db2.gz RXVQRZWULGJNKT-UHFFFAOYSA-N 1 1 360.448 4.214 20 10 FICDMO COc1ccc(Cl)cc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000096971092 1082657559 /nfs/dbraw/zinc/65/75/59/1082657559.db2.gz ZEROMZMFQYDOMR-GOSISDBHSA-N 1 1 361.869 4.235 20 10 FICDMO COc1cc(O)c(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)cc1OC ZINC000179433842 1083462259 /nfs/dbraw/zinc/46/22/59/1083462259.db2.gz OFGYHBQKTLHEMW-GFCCVEGCSA-N 1 1 358.463 4.212 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)cc1OC ZINC000179433842 1083462264 /nfs/dbraw/zinc/46/22/64/1083462264.db2.gz OFGYHBQKTLHEMW-GFCCVEGCSA-N 1 1 358.463 4.212 20 10 FICDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H](C)c1cccc(OC)c1 ZINC000179470088 1083471690 /nfs/dbraw/zinc/47/16/90/1083471690.db2.gz FVECRKGGPWRFSN-SFHVURJKSA-N 1 1 354.494 4.115 20 10 FICDMO Cc1c(O)ccc(C[N@H+](C)[C@H](C)c2cccc(Br)c2)c1O ZINC001140749775 1083906044 /nfs/dbraw/zinc/90/60/44/1083906044.db2.gz MKWWPZKUQNETQY-GFCCVEGCSA-N 1 1 350.256 4.362 20 10 FICDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)NC1CCCC1)Cc1ccccc1O ZINC000176674314 1085054685 /nfs/dbraw/zinc/05/46/85/1085054685.db2.gz VJIOELQKHUAUTC-KRWDZBQOSA-N 1 1 352.478 4.014 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)CC[C@H]2C)C1 ZINC001126429928 1089139209 /nfs/dbraw/zinc/13/92/09/1089139209.db2.gz YJZBCYDYCJSOAB-QZTJIDSGSA-N 1 1 367.537 4.055 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)[C@@H](C)C2(C)CC2)C1 ZINC000435806270 1089954187 /nfs/dbraw/zinc/95/41/87/1089954187.db2.gz CKYBIODRRJKYMP-KRWDZBQOSA-N 1 1 367.537 4.055 20 10 FICDMO C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014883 1092907330 /nfs/dbraw/zinc/90/73/30/1092907330.db2.gz MWLVROUTICONPX-OPMZPASUSA-N 1 1 350.506 4.153 20 10 FICDMO C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168014883 1092907332 /nfs/dbraw/zinc/90/73/32/1092907332.db2.gz MWLVROUTICONPX-OPMZPASUSA-N 1 1 350.506 4.153 20 10 FICDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@H](C)N1Cc1ccccc1 ZINC001168014883 1092907334 /nfs/dbraw/zinc/90/73/34/1092907334.db2.gz MWLVROUTICONPX-OPMZPASUSA-N 1 1 350.506 4.153 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(OC(F)F)cc3)CC2)cc1 ZINC000108722663 1093711411 /nfs/dbraw/zinc/71/14/11/1093711411.db2.gz YBHFNIPMXSGNGW-UHFFFAOYSA-N 1 1 362.420 4.009 20 10 FICDMO CC(C)(C)OC(=O)Nc1ccsc1C[NH2+]Cc1c(O)cccc1F ZINC000896641188 1094873167 /nfs/dbraw/zinc/87/31/67/1094873167.db2.gz LWVAFNXCULXRIQ-UHFFFAOYSA-N 1 1 352.431 4.230 20 10 FICDMO C[C@@H]([NH2+]Cc1cccnc1-n1cccn1)c1cc(Cl)c(Cl)cc1O ZINC000192654110 1101966859 /nfs/dbraw/zinc/96/68/59/1101966859.db2.gz KDWQXIHOWPQFFV-LLVKDONJSA-N 1 1 363.248 4.131 20 10 FICDMO COCCC1CC[NH+]([C@@H](C)c2cc(Br)c(F)cc2O)CC1 ZINC000527931553 1109869906 /nfs/dbraw/zinc/86/99/06/1109869906.db2.gz BPSPHOJIEQEHBN-NSHDSACASA-N 1 1 360.267 4.103 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cn(-c3ccccc3)nn2)cc1F ZINC000760713853 1114670642 /nfs/dbraw/zinc/67/06/42/1114670642.db2.gz NKSNIDZLHAJSSH-INIZCTEOSA-N 1 1 367.472 4.103 20 10 FICDMO C[C@@H](O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880907 1115121075 /nfs/dbraw/zinc/12/10/75/1115121075.db2.gz ZMGLDAFLGJPMHP-IAGOWNOFSA-N 1 1 366.465 4.133 20 10 FICDMO C[C@@H](O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880907 1115121077 /nfs/dbraw/zinc/12/10/77/1115121077.db2.gz ZMGLDAFLGJPMHP-IAGOWNOFSA-N 1 1 366.465 4.133 20 10 FICDMO FC(F)Oc1ccc(N2CCC(Nc3[nH]c4ccccc4[nH+]3)CC2)cc1 ZINC000762521849 1120922344 /nfs/dbraw/zinc/92/23/44/1120922344.db2.gz KLOCFCLVPNXJMH-UHFFFAOYSA-N 1 1 358.392 4.245 20 10 FICDMO CCc1nnc([C@@H](C)[NH2+]Cc2ccc(N(CC)Cc3ccccc3)cc2)[nH]1 ZINC000762626747 1120940947 /nfs/dbraw/zinc/94/09/47/1120940947.db2.gz HXINRAYQEFTBOJ-QGZVFWFLSA-N 1 1 363.509 4.244 20 10 FICDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000917066387 1122061859 /nfs/dbraw/zinc/06/18/59/1122061859.db2.gz BUFGSONRJGFKQX-MRXNPFEDSA-N 1 1 373.928 4.057 20 10 FICDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000917066387 1122061863 /nfs/dbraw/zinc/06/18/63/1122061863.db2.gz BUFGSONRJGFKQX-MRXNPFEDSA-N 1 1 373.928 4.057 20 10 FICDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000917066386 1122062259 /nfs/dbraw/zinc/06/22/59/1122062259.db2.gz BUFGSONRJGFKQX-INIZCTEOSA-N 1 1 373.928 4.057 20 10 FICDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000917066386 1122062267 /nfs/dbraw/zinc/06/22/67/1122062267.db2.gz BUFGSONRJGFKQX-INIZCTEOSA-N 1 1 373.928 4.057 20 10 FICDMO CC(C)[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074943 1122068420 /nfs/dbraw/zinc/06/84/20/1122068420.db2.gz MHGKLPCEHOLNBB-IRLDBZIGSA-N 1 1 371.569 4.144 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601897 1122723364 /nfs/dbraw/zinc/72/33/64/1122723364.db2.gz LLDUUOVYSBMEMI-IEBWSBKVSA-N 1 1 371.912 4.104 20 10 FICDMO C[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@H]1CCCCO1 ZINC000918735304 1122765937 /nfs/dbraw/zinc/76/59/37/1122765937.db2.gz JFASWXLCCGYLCU-OAHLLOKOSA-N 1 1 364.283 4.309 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1C ZINC000181467193 1124959438 /nfs/dbraw/zinc/95/94/38/1124959438.db2.gz SBXHGZHQNYRRRQ-HNNXBMFYSA-N 1 1 353.388 4.061 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c(Br)c1 ZINC001237064745 1125414086 /nfs/dbraw/zinc/41/40/86/1125414086.db2.gz ICXAWHHGQOHSKJ-UHFFFAOYSA-N 1 1 364.230 4.031 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nc3sc(C)c(C)c3c(N)n2)c1 ZINC000182472402 1125518424 /nfs/dbraw/zinc/51/84/24/1125518424.db2.gz JPOLVROUVALZQX-QWRGUYRKSA-N 1 1 372.494 4.016 20 10 FICDMO COc1ccc(N2CCC[N@@H+](C[C@H]3CC[C@@H](c4ccccc4)O3)CC2)cc1 ZINC001167107680 1080552658 /nfs/dbraw/zinc/55/26/58/1080552658.db2.gz GIJKPJSBNSJBSQ-PKTZIBPZSA-N 1 1 366.505 4.128 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(OC(F)F)c(OC)c1)c1ccc(F)cc1O ZINC000796675288 1081622393 /nfs/dbraw/zinc/62/23/93/1081622393.db2.gz LRGJOEMAKJHPLN-AWEZNQCLSA-N 1 1 355.356 4.382 20 10 FICDMO CCC[N@@H+](CC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)Cc1ccccc1O ZINC001167521904 1084439206 /nfs/dbraw/zinc/43/92/06/1084439206.db2.gz MPQQTDIZRPVGIY-KRWDZBQOSA-N 1 1 372.484 4.353 20 10 FICDMO COc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cc1OC ZINC000161612399 1086476880 /nfs/dbraw/zinc/47/68/80/1086476880.db2.gz VKTWAFNJUDIYDP-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO CCN(CC)c1ccc(CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000728594311 1087531602 /nfs/dbraw/zinc/53/16/02/1087531602.db2.gz PJRBRDCKVWAROI-HSZRJFAPSA-N 1 1 365.565 4.187 20 10 FICDMO CCN(CC)c1ccc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000728594311 1087531605 /nfs/dbraw/zinc/53/16/05/1087531605.db2.gz PJRBRDCKVWAROI-HSZRJFAPSA-N 1 1 365.565 4.187 20 10 FICDMO CC(C)[C@H](C)NC(=O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000255953982 1088243519 /nfs/dbraw/zinc/24/35/19/1088243519.db2.gz ZTUOPFWBSHUNAD-ZWKOTPCHSA-N 1 1 354.494 4.116 20 10 FICDMO Cn1cc([C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2cccc(F)c2)cn1 ZINC000180101296 1090156808 /nfs/dbraw/zinc/15/68/08/1090156808.db2.gz UMZGSWGGMVTREP-QFIPXVFZSA-N 1 1 364.468 4.039 20 10 FICDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1 ZINC000180937864 1090244924 /nfs/dbraw/zinc/24/49/24/1090244924.db2.gz JARGEPDPPCEHKM-OQRGYWNNSA-N 1 1 366.461 4.124 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(F)cc1Br)c1cc(F)cc(F)c1O ZINC000756451267 1090452149 /nfs/dbraw/zinc/45/21/49/1090452149.db2.gz YJYULMIFTAIRCO-MRVPVSSYSA-N 1 1 360.173 4.423 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)C(C)C)C1 ZINC001269468175 1096620659 /nfs/dbraw/zinc/62/06/59/1096620659.db2.gz DHMYMAROBUVEDB-UHFFFAOYSA-N 1 1 369.553 4.206 20 10 FICDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 ZINC000843758721 1102864834 /nfs/dbraw/zinc/86/48/34/1102864834.db2.gz WAEPXWDYLPVXQP-GOSISDBHSA-N 1 1 368.525 4.046 20 10 FICDMO Oc1ccccc1C[N@H+](C[C@H]1CC[C@@H](c2ccccc2)O1)C[C@@H]1CCCO1 ZINC001167984670 1103214454 /nfs/dbraw/zinc/21/44/54/1103214454.db2.gz VNSRXORLRPDMST-XJUOHMSHSA-N 1 1 367.489 4.294 20 10 FICDMO C[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1ccc(F)cc1O ZINC000760036242 1104893662 /nfs/dbraw/zinc/89/36/62/1104893662.db2.gz DTUIMZXMMUAHTQ-SZFUDVHCSA-N 1 1 361.432 4.095 20 10 FICDMO CCN(CC)c1ccc(CN(C)C(=O)[C@H](c2ccccc2)[N@@H+](C)CC)cc1 ZINC000729512911 1105025028 /nfs/dbraw/zinc/02/50/28/1105025028.db2.gz WMWOOXLGGTVCJQ-QFIPXVFZSA-N 1 1 367.537 4.184 20 10 FICDMO CC(C)[N@@H+](C)CC(=O)Nc1ccc(/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001142588158 1112389668 /nfs/dbraw/zinc/38/96/68/1112389668.db2.gz NFBWWTWILBPJIW-VOTSOKGWSA-N 1 1 351.494 4.202 20 10 FICDMO COc1cc(C)cc(C[N@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c1O ZINC000164344156 1114474727 /nfs/dbraw/zinc/47/47/27/1114474727.db2.gz SZSNCUWJGXIJGV-UHFFFAOYSA-N 1 1 357.294 4.026 20 10 FICDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)nc(-c2ccc(Cl)cc2)n1 ZINC000157252469 1115046516 /nfs/dbraw/zinc/04/65/16/1115046516.db2.gz AOPRTOTUNRIVEE-UHFFFAOYSA-N 1 1 353.853 4.443 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1O ZINC000761191840 1115613925 /nfs/dbraw/zinc/61/39/25/1115613925.db2.gz XQQVLUUEDYGCNX-UHFFFAOYSA-N 1 1 362.813 4.127 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000761203580 1115622960 /nfs/dbraw/zinc/62/29/60/1115622960.db2.gz WOAFCFAOGGGRSY-BMGDILEWSA-N 1 1 353.890 4.080 20 10 FICDMO CN(Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000174450178 1116134937 /nfs/dbraw/zinc/13/49/37/1116134937.db2.gz VPVJCRYBDIHFGD-UHFFFAOYSA-N 1 1 362.473 4.136 20 10 FICDMO Cc1nc(NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)c(C)[nH+]1 ZINC000761889868 1120566172 /nfs/dbraw/zinc/56/61/72/1120566172.db2.gz TYRBYZADAOIYNP-UHFFFAOYSA-N 1 1 362.424 4.084 20 10 FICDMO C[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000762647992 1120945108 /nfs/dbraw/zinc/94/51/08/1120945108.db2.gz GSSKSFBKJIEIRO-SFTDATJTSA-N 1 1 373.585 4.219 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1nc2ccc(F)cc2s1)C[C@H]1CCCO1 ZINC000762946552 1121030621 /nfs/dbraw/zinc/03/06/21/1121030621.db2.gz RCHQCTABSZZVHV-MRXNPFEDSA-N 1 1 372.465 4.322 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1nc2ccc(F)cc2s1)C[C@H]1CCCO1 ZINC000762946552 1121030633 /nfs/dbraw/zinc/03/06/33/1121030633.db2.gz RCHQCTABSZZVHV-MRXNPFEDSA-N 1 1 372.465 4.322 20 10 FICDMO C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000763217049 1121296491 /nfs/dbraw/zinc/29/64/91/1121296491.db2.gz QWXKUTFXBSIDCC-GOSISDBHSA-N 1 1 367.537 4.417 20 10 FICDMO C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000763217049 1121296497 /nfs/dbraw/zinc/29/64/97/1121296497.db2.gz QWXKUTFXBSIDCC-GOSISDBHSA-N 1 1 367.537 4.417 20 10 FICDMO Cc1ccccc1-c1noc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000917074023 1122067670 /nfs/dbraw/zinc/06/76/70/1122067670.db2.gz NJWXVEJHQCYNAH-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1ccccc1-c1noc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000917074023 1122067678 /nfs/dbraw/zinc/06/76/78/1122067678.db2.gz NJWXVEJHQCYNAH-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917417991 1122294414 /nfs/dbraw/zinc/29/44/14/1122294414.db2.gz RISFZDKUFAUKOF-UHFFFAOYSA-N 1 1 353.510 4.219 20 10 FICDMO COc1cc(C[NH+]2CCN(Cc3cccs3)CC2)c(O)c(C(C)(C)C)c1 ZINC000918067790 1122543132 /nfs/dbraw/zinc/54/31/32/1122543132.db2.gz UFGQRGDIAMENJB-UHFFFAOYSA-N 1 1 374.550 4.078 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1C(C)C ZINC000918182622 1122583928 /nfs/dbraw/zinc/58/39/28/1122583928.db2.gz BSVIWPWCNPNWEF-QGZVFWFLSA-N 1 1 362.514 4.313 20 10 FICDMO CC[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@H]1CCCO1 ZINC000919946287 1123277276 /nfs/dbraw/zinc/27/72/76/1123277276.db2.gz ZPJZALRFSZZDSW-OAHLLOKOSA-N 1 1 364.283 4.309 20 10 FICDMO Cc1ccc(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179932580 1124144661 /nfs/dbraw/zinc/14/46/61/1124144661.db2.gz PBYMGHALTBIAAW-SFHVURJKSA-N 1 1 367.493 4.043 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)c1 ZINC000182345233 1125426013 /nfs/dbraw/zinc/42/60/13/1125426013.db2.gz QTUAUDLLFWSRTH-STQMWFEESA-N 1 1 371.412 4.310 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c1 ZINC000182436392 1125491850 /nfs/dbraw/zinc/49/18/50/1125491850.db2.gz JGLSNDURPOUFSO-CABCVRRESA-N 1 1 367.449 4.479 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160272829 1080700806 /nfs/dbraw/zinc/70/08/06/1080700806.db2.gz KVJWYAZLCOZTPI-VLIAUNLRSA-N 1 1 359.491 4.088 20 10 FICDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275322818 1080758705 /nfs/dbraw/zinc/75/87/05/1080758705.db2.gz LLVORQDPUQHWOZ-BDAKNGLRSA-N 1 1 356.289 4.035 20 10 FICDMO O=C1O[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CN1C1CCCCC1 ZINC001167353868 1081595023 /nfs/dbraw/zinc/59/50/23/1081595023.db2.gz QQMDXIIGZCITGM-FQEVSTJZSA-N 1 1 372.509 4.290 20 10 FICDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1cccc(Cl)c1 ZINC000160528458 1081987577 /nfs/dbraw/zinc/98/75/77/1081987577.db2.gz RYWOEZJUAIPVKB-CQSZACIVSA-N 1 1 369.900 4.146 20 10 FICDMO CCOc1ccc(C2=CC[N@@H+](Cc3cc(OC)c(OC)cc3O)CC2)cc1 ZINC000160668221 1082195303 /nfs/dbraw/zinc/19/53/03/1082195303.db2.gz IFUPTGDYXDXTAL-UHFFFAOYSA-N 1 1 369.461 4.097 20 10 FICDMO CC(C)([NH2+]Cc1cccc(Br)c1O)c1ccc([N+](=O)[O-])cc1 ZINC000175985565 1082391674 /nfs/dbraw/zinc/39/16/74/1082391674.db2.gz VNOUPWCQWQKRED-UHFFFAOYSA-N 1 1 365.227 4.088 20 10 FICDMO COc1cc(Br)cc(C[N@@H+](C)[C@@H](C)c2cccs2)c1O ZINC000157804513 1082407467 /nfs/dbraw/zinc/40/74/67/1082407467.db2.gz LFJWOCNTERNLAN-JTQLQIEISA-N 1 1 356.285 4.418 20 10 FICDMO CC[C@@H]([NH2+][C@@H](Cc1ccccc1)C(=O)N(CC)CC)c1ccc(F)cc1O ZINC000796664541 1083555668 /nfs/dbraw/zinc/55/56/68/1083555668.db2.gz YQVVHBFEEOJIAW-UXHICEINSA-N 1 1 372.484 4.052 20 10 FICDMO CC[C@H]([NH2+][C@@H](Cc1ccccc1)C(=O)N(CC)CC)c1ccc(F)cc1O ZINC000796664540 1083556107 /nfs/dbraw/zinc/55/61/07/1083556107.db2.gz YQVVHBFEEOJIAW-PMACEKPBSA-N 1 1 372.484 4.052 20 10 FICDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000048796506 1085006155 /nfs/dbraw/zinc/00/61/55/1085006155.db2.gz DPVFVEMJBGZYCV-JTQLQIEISA-N 1 1 354.219 4.153 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)c1 ZINC000312948770 1085140073 /nfs/dbraw/zinc/14/00/73/1085140073.db2.gz RHNDWCSOVIXDHB-QUCCMNQESA-N 1 1 368.521 4.354 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)c1 ZINC000312948768 1085140577 /nfs/dbraw/zinc/14/05/77/1085140577.db2.gz RHNDWCSOVIXDHB-AZUAARDMSA-N 1 1 368.521 4.354 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CC[C@H](C)CC2)C1 ZINC001125970105 1085146536 /nfs/dbraw/zinc/14/65/36/1085146536.db2.gz IQUADGYSVYJKKP-IYARVYRRSA-N 1 1 367.537 4.103 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](CC)Cc2ccc(C(=O)N(C)C)cc2)cc1 ZINC000093084103 1085289817 /nfs/dbraw/zinc/28/98/17/1085289817.db2.gz ZNKOILILIOJMBR-UHFFFAOYSA-N 1 1 367.537 4.257 20 10 FICDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000311584333 1086478183 /nfs/dbraw/zinc/47/81/83/1086478183.db2.gz XYYXDRSDVOSWAX-NNMXDRDESA-N 1 1 351.538 4.314 20 10 FICDMO CC[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc(F)cc1O ZINC000796705106 1086501272 /nfs/dbraw/zinc/50/12/72/1086501272.db2.gz OYJUVEFBPSWKOX-HNNXBMFYSA-N 1 1 351.805 4.197 20 10 FICDMO CCN(CC)c1ccc(CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000728594312 1087531764 /nfs/dbraw/zinc/53/17/64/1087531764.db2.gz PJRBRDCKVWAROI-QHCPKHFHSA-N 1 1 365.565 4.187 20 10 FICDMO CCN(CC)c1ccc(CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000728594312 1087531768 /nfs/dbraw/zinc/53/17/68/1087531768.db2.gz PJRBRDCKVWAROI-QHCPKHFHSA-N 1 1 365.565 4.187 20 10 FICDMO COc1ccc([C@H]([NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)C2CC2)cc1 ZINC000176996360 1087730175 /nfs/dbraw/zinc/73/01/75/1087730175.db2.gz MDOYJNBADKGPGY-LJQANCHMSA-N 1 1 359.853 4.498 20 10 FICDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C(F)(F)F)c1 ZINC001143484794 1088958519 /nfs/dbraw/zinc/95/85/19/1088958519.db2.gz RLGJIJGGTVLLHF-UHFFFAOYSA-N 1 1 352.400 4.412 20 10 FICDMO Cc1cc(C(=O)N2CCC[N@H+](C(C)C)CC2)c(C)n1-c1cccc(Cl)c1 ZINC001143557809 1096084029 /nfs/dbraw/zinc/08/40/29/1096084029.db2.gz GQTBODREWDPVLI-UHFFFAOYSA-N 1 1 373.928 4.304 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1CCC[C@@H](C(F)(F)F)O1 ZINC001167982230 1102786486 /nfs/dbraw/zinc/78/64/86/1102786486.db2.gz ALSSIUKBCVAUQW-AEFFLSMTSA-N 1 1 369.383 4.487 20 10 FICDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001167984665 1103204112 /nfs/dbraw/zinc/20/41/12/1103204112.db2.gz VNSRXORLRPDMST-FUDKSRODSA-N 1 1 367.489 4.294 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)c1O ZINC001167990477 1104372059 /nfs/dbraw/zinc/37/20/59/1104372059.db2.gz UPUVXSJNCPOYID-FQEVSTJZSA-N 1 1 373.880 4.120 20 10 FICDMO C[C@@H](O)[C@H]1CCC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880913 1115121149 /nfs/dbraw/zinc/12/11/49/1115121149.db2.gz ZMGLDAFLGJPMHP-SJORKVTESA-N 1 1 366.465 4.133 20 10 FICDMO C[C@@H](O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880913 1115121153 /nfs/dbraw/zinc/12/11/53/1115121153.db2.gz ZMGLDAFLGJPMHP-SJORKVTESA-N 1 1 366.465 4.133 20 10 FICDMO COc1cc(Cl)cc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1O ZINC000761184222 1115598487 /nfs/dbraw/zinc/59/84/87/1115598487.db2.gz UEWSSISIBIZVMQ-HNNXBMFYSA-N 1 1 367.898 4.297 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1O ZINC000761192684 1115612793 /nfs/dbraw/zinc/61/27/93/1115612793.db2.gz YQUDIMITWUIOMU-QGZVFWFLSA-N 1 1 371.868 4.278 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1O ZINC000761192684 1115612796 /nfs/dbraw/zinc/61/27/96/1115612796.db2.gz YQUDIMITWUIOMU-QGZVFWFLSA-N 1 1 371.868 4.278 20 10 FICDMO COc1cc(O)c(C[N@H+](C)Cc2ccccc2Br)cc1Cl ZINC001232266546 1115780092 /nfs/dbraw/zinc/78/00/92/1115780092.db2.gz OTYSNVJIKPCWGJ-UHFFFAOYSA-N 1 1 370.674 4.449 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)Cc2ccccc2Br)cc1Cl ZINC001232266546 1115780096 /nfs/dbraw/zinc/78/00/96/1115780096.db2.gz OTYSNVJIKPCWGJ-UHFFFAOYSA-N 1 1 370.674 4.449 20 10 FICDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)NCc2ccccc2O)c1 ZINC000761650862 1120001076 /nfs/dbraw/zinc/00/10/76/1120001076.db2.gz LYIWOCFSJUDGJY-UHFFFAOYSA-N 1 1 369.509 4.014 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc3c(c2)OCCO3)c(O)c(C(C)(C)C)c1 ZINC000915832332 1121121975 /nfs/dbraw/zinc/12/19/75/1121121975.db2.gz SWBAYGSVHCPLAX-UHFFFAOYSA-N 1 1 371.477 4.102 20 10 FICDMO CCOCc1cc(CNC[C@@H]2CCC[N@H+]2CC2CCCCC2)ccc1OC ZINC001649095529 1121755663 /nfs/dbraw/zinc/75/56/63/1121755663.db2.gz DYYNKZYNKVIUTN-QFIPXVFZSA-N 1 1 374.569 4.366 20 10 FICDMO CCOCc1cc(C[NH2+]C[C@@H]2CCCN2CC2CCCCC2)ccc1OC ZINC001649095529 1121755674 /nfs/dbraw/zinc/75/56/74/1121755674.db2.gz DYYNKZYNKVIUTN-QFIPXVFZSA-N 1 1 374.569 4.366 20 10 FICDMO CSc1cccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917073809 1122066209 /nfs/dbraw/zinc/06/62/09/1122066209.db2.gz BJUAKLMUEZMRKH-UHFFFAOYSA-N 1 1 369.534 4.078 20 10 FICDMO CSc1cccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917073809 1122066218 /nfs/dbraw/zinc/06/62/18/1122066218.db2.gz BJUAKLMUEZMRKH-UHFFFAOYSA-N 1 1 369.534 4.078 20 10 FICDMO CC(C)[N@@H+](CC(=O)N(C)[C@H](C)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000917075101 1122070566 /nfs/dbraw/zinc/07/05/66/1122070566.db2.gz PYYLTNUYELCJLE-LJQANCHMSA-N 1 1 367.537 4.183 20 10 FICDMO C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNCc2ccc3c(c2)CCO3)C1 ZINC000917395657 1122287252 /nfs/dbraw/zinc/28/72/52/1122287252.db2.gz XJLCZGOKDVKCTM-OALUTQOASA-N 1 1 364.533 4.389 20 10 FICDMO Cc1cc(C[NH+]2CCN(C(=O)c3ccsc3)CC2)c(O)c(C(C)(C)C)c1 ZINC000917481479 1122325000 /nfs/dbraw/zinc/32/50/00/1122325000.db2.gz LOJXEFIKQRDQEC-UHFFFAOYSA-N 1 1 372.534 4.018 20 10 FICDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000917485903 1122326647 /nfs/dbraw/zinc/32/66/47/1122326647.db2.gz VBCRQNHAQSZDCJ-UHFFFAOYSA-N 1 1 354.494 4.108 20 10 FICDMO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc2c(cc1O)OCO2 ZINC000917488815 1122333721 /nfs/dbraw/zinc/33/37/21/1122333721.db2.gz WVVDDLMMVZVPFS-UHFFFAOYSA-N 1 1 354.233 4.450 20 10 FICDMO COc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1OC ZINC000154712660 1122636984 /nfs/dbraw/zinc/63/69/84/1122636984.db2.gz VRMRBYANZSWNPU-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO COc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1OC ZINC000154712660 1122636986 /nfs/dbraw/zinc/63/69/86/1122636986.db2.gz VRMRBYANZSWNPU-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO CCCn1nc(C)c(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1C ZINC000154726802 1122642891 /nfs/dbraw/zinc/64/28/91/1122642891.db2.gz OYDKLCPFYIXWRW-UHFFFAOYSA-N 1 1 353.466 4.411 20 10 FICDMO CCCn1nc(C)c(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1C ZINC000154726802 1122642895 /nfs/dbraw/zinc/64/28/95/1122642895.db2.gz OYDKLCPFYIXWRW-UHFFFAOYSA-N 1 1 353.466 4.411 20 10 FICDMO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H](c2ccccc2)O1 ZINC000920306513 1123437457 /nfs/dbraw/zinc/43/74/57/1123437457.db2.gz VZGOLZIMOSFEQG-MGPUTAFESA-N 1 1 355.478 4.357 20 10 FICDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057225 1123558485 /nfs/dbraw/zinc/55/84/85/1123558485.db2.gz VDSYYXQKPMXYAJ-FUHWJXTLSA-N 1 1 354.494 4.062 20 10 FICDMO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)c1 ZINC000180025289 1124191492 /nfs/dbraw/zinc/19/14/92/1124191492.db2.gz FQGXSZMHHCSWDV-GOSISDBHSA-N 1 1 365.433 4.178 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)c1 ZINC000180025289 1124191498 /nfs/dbraw/zinc/19/14/98/1124191498.db2.gz FQGXSZMHHCSWDV-GOSISDBHSA-N 1 1 365.433 4.178 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3ccccc3C)cc2F)CC1 ZINC000765853901 1124257083 /nfs/dbraw/zinc/25/70/83/1124257083.db2.gz WSLMILBLSLMSIJ-GOSISDBHSA-N 1 1 355.501 4.127 20 10 FICDMO CCC[N@@H+](Cc1cccc(C(=O)N2CCCCC2)c1)Cc1ccccc1O ZINC000068973528 1124433762 /nfs/dbraw/zinc/43/37/62/1124433762.db2.gz GAJIIEWVOZTMRL-UHFFFAOYSA-N 1 1 366.505 4.431 20 10 FICDMO C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cc(Br)cc(F)c1[O-] ZINC000756363513 1124842455 /nfs/dbraw/zinc/84/24/55/1124842455.db2.gz OZYDFKLDXQDKGZ-OLZOCXBDSA-N 1 1 373.310 4.209 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nc3sc(C)c(C)c3c(N)n2)c1 ZINC000182472389 1125518327 /nfs/dbraw/zinc/51/83/27/1125518327.db2.gz JPOLVROUVALZQX-WDEREUQCSA-N 1 1 372.494 4.016 20 10 FICDMO CC(C)(C)c1ncc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000160195245 1079587688 /nfs/dbraw/zinc/58/76/88/1079587688.db2.gz QMMKNXKEDRVQHV-INIZCTEOSA-N 1 1 360.523 4.327 20 10 FICDMO CN(C)c1ccc(C[N@@H+](Cc2cnn(Cc3ccccc3)c2)C2CC2)cc1 ZINC001167107841 1080552218 /nfs/dbraw/zinc/55/22/18/1080552218.db2.gz IBBYYFOWVCUQHV-UHFFFAOYSA-N 1 1 360.505 4.162 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160272972 1080703913 /nfs/dbraw/zinc/70/39/13/1080703913.db2.gz KVJWYAZLCOZTPI-XOBRGWDASA-N 1 1 359.491 4.088 20 10 FICDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001167281471 1080968097 /nfs/dbraw/zinc/96/80/97/1080968097.db2.gz BGSNDPFXSJSNAJ-QGZVFWFLSA-N 1 1 371.550 4.292 20 10 FICDMO C[N@H+](Cc1nccn1Cc1ccccc1)Cc1cc2c(cc1O)CCCC2 ZINC000160302318 1081219403 /nfs/dbraw/zinc/21/94/03/1081219403.db2.gz ZOWQWWXPXGWGMF-UHFFFAOYSA-N 1 1 361.489 4.148 20 10 FICDMO C[N@@H+](Cc1nccn1Cc1ccccc1)Cc1cc2c(cc1O)CCCC2 ZINC000160302318 1081219407 /nfs/dbraw/zinc/21/94/07/1081219407.db2.gz ZOWQWWXPXGWGMF-UHFFFAOYSA-N 1 1 361.489 4.148 20 10 FICDMO CC(C)Cc1noc(Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)n1 ZINC000558278517 1082408755 /nfs/dbraw/zinc/40/87/55/1082408755.db2.gz QDVTZJJCJUNFDF-UHFFFAOYSA-N 1 1 352.482 4.038 20 10 FICDMO Cc1ccc(CC[N@H+](Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 ZINC001167461508 1082568860 /nfs/dbraw/zinc/56/88/60/1082568860.db2.gz KRBXTNNRTXXFIQ-HSZRJFAPSA-N 1 1 352.522 4.285 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC001167473216 1082701419 /nfs/dbraw/zinc/70/14/19/1082701419.db2.gz GKWOXCFMFCYSKQ-KFKAGJAMSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC001167473216 1082701425 /nfs/dbraw/zinc/70/14/25/1082701425.db2.gz GKWOXCFMFCYSKQ-KFKAGJAMSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC001167473216 1082701430 /nfs/dbraw/zinc/70/14/30/1082701430.db2.gz GKWOXCFMFCYSKQ-KFKAGJAMSA-N 1 1 365.901 4.274 20 10 FICDMO CC1(CO)CC[NH+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000588458897 1083324856 /nfs/dbraw/zinc/32/48/56/1083324856.db2.gz YKQLOFHJMJRQGP-UHFFFAOYSA-N 1 1 366.465 4.135 20 10 FICDMO Cc1ccccc1NC(=O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000052686769 1087043623 /nfs/dbraw/zinc/04/36/23/1087043623.db2.gz QPWQVVJAMHGUGG-UHFFFAOYSA-N 1 1 351.494 4.056 20 10 FICDMO Cc1ccccc1NC(=O)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000052686769 1087043639 /nfs/dbraw/zinc/04/36/39/1087043639.db2.gz QPWQVVJAMHGUGG-UHFFFAOYSA-N 1 1 351.494 4.056 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000158834147 1087407108 /nfs/dbraw/zinc/40/71/08/1087407108.db2.gz AYXMIGIILQQSOL-UHFFFAOYSA-N 1 1 355.356 4.060 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cc1OC ZINC000158838261 1087408596 /nfs/dbraw/zinc/40/85/96/1087408596.db2.gz DRAZVGFQSSCSMU-UHFFFAOYSA-N 1 1 370.493 4.032 20 10 FICDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc(C)n(-c4ccccn4)c3C)c2C1 ZINC000066761077 1089012472 /nfs/dbraw/zinc/01/24/72/1089012472.db2.gz NVTPQFNZTXGCEL-UHFFFAOYSA-N 1 1 374.488 4.467 20 10 FICDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc(C)n(-c4ccccn4)c3C)c2C1 ZINC000066761077 1089012489 /nfs/dbraw/zinc/01/24/89/1089012489.db2.gz NVTPQFNZTXGCEL-UHFFFAOYSA-N 1 1 374.488 4.467 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000180555540 1090216100 /nfs/dbraw/zinc/21/61/00/1090216100.db2.gz WNLAIXRJFCQVFP-NSHDSACASA-N 1 1 372.412 4.256 20 10 FICDMO c1[nH]c2ccccc2c1C1=CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000180658907 1090226633 /nfs/dbraw/zinc/22/66/33/1090226633.db2.gz SNVAKPWUDIEXQZ-UHFFFAOYSA-N 1 1 373.500 4.294 20 10 FICDMO Oc1ccc2ccncc2c1C[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000728904950 1091888924 /nfs/dbraw/zinc/88/89/24/1091888924.db2.gz SVVBMGIRLJAKHN-FQEVSTJZSA-N 1 1 354.837 4.167 20 10 FICDMO Oc1ccc2ccncc2c1C[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000728904950 1091888933 /nfs/dbraw/zinc/88/89/33/1091888933.db2.gz SVVBMGIRLJAKHN-FQEVSTJZSA-N 1 1 354.837 4.167 20 10 FICDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nc(-c3cc(C)ccn3)n[nH]2)cc1 ZINC000279581570 1091935118 /nfs/dbraw/zinc/93/51/18/1091935118.db2.gz UPCPAZJYESUUQS-JKSUJKDBSA-N 1 1 364.497 4.043 20 10 FICDMO C[C@@H]1CC(NCc2ccc3c(c2)CCO3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014884 1092907115 /nfs/dbraw/zinc/90/71/15/1092907115.db2.gz MWLVROUTICONPX-QZTJIDSGSA-N 1 1 350.506 4.153 20 10 FICDMO C[C@@H]1CC([NH2+]Cc2ccc3c(c2)CCO3)C[C@@H](C)N1Cc1ccccc1 ZINC001168014884 1092907116 /nfs/dbraw/zinc/90/71/16/1092907116.db2.gz MWLVROUTICONPX-QZTJIDSGSA-N 1 1 350.506 4.153 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@@H]2CCCN(C)C2)cc1 ZINC000236965750 1093157308 /nfs/dbraw/zinc/15/73/08/1093157308.db2.gz DGZIJSDPGLBMGO-QFIPXVFZSA-N 1 1 351.538 4.145 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3c(O)ccc4ccccc43)CC2)cc1 ZINC000108219663 1093707149 /nfs/dbraw/zinc/70/71/49/1093707149.db2.gz CIBDCDMKXBZMRI-UHFFFAOYSA-N 1 1 362.473 4.266 20 10 FICDMO CC[N@@H+](Cc1cc(I)cs1)Cc1ccccc1O ZINC001141866724 1094321279 /nfs/dbraw/zinc/32/12/79/1094321279.db2.gz QVPLKFUVOSPRPO-UHFFFAOYSA-N 1 1 373.259 4.080 20 10 FICDMO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c(O)c1C ZINC000273397541 1096258822 /nfs/dbraw/zinc/25/88/22/1096258822.db2.gz MEYZTKRYEDRAMU-KXBFYZLASA-N 1 1 353.441 4.322 20 10 FICDMO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Br)cc2O)cs1 ZINC000273595064 1096277129 /nfs/dbraw/zinc/27/71/29/1096277129.db2.gz QFFIFZAOOKYDDX-VHSXEESVSA-N 1 1 371.300 4.169 20 10 FICDMO C[N@H+](Cc1cnn(-c2ccccc2)c1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000016877842 1096410429 /nfs/dbraw/zinc/41/04/29/1096410429.db2.gz HFVNJRBQDVZWSW-UHFFFAOYSA-N 1 1 365.477 4.213 20 10 FICDMO C[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000016877842 1096410439 /nfs/dbraw/zinc/41/04/39/1096410439.db2.gz HFVNJRBQDVZWSW-UHFFFAOYSA-N 1 1 365.477 4.213 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000048795273 1102846738 /nfs/dbraw/zinc/84/67/38/1102846738.db2.gz IPJCICBLRMDBSK-UHFFFAOYSA-N 1 1 358.182 4.046 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1COC2(CCCCC2)O1 ZINC001167983417 1102879879 /nfs/dbraw/zinc/87/98/79/1102879879.db2.gz LCFCYCGHAVVBGY-LJQANCHMSA-N 1 1 357.450 4.063 20 10 FICDMO C[C@H]([NH2+]C[C@@H]1c2ccccc2C(=O)N1C)c1cc(Cl)c(Cl)cc1O ZINC000528005793 1109883022 /nfs/dbraw/zinc/88/30/22/1109883022.db2.gz VLKKDVOCLGYQCM-MGPLVRAMSA-N 1 1 365.260 4.177 20 10 FICDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1cc(Cl)c(O)cc1O ZINC001232261043 1115778628 /nfs/dbraw/zinc/77/86/28/1115778628.db2.gz AHPZOGNKGDYMHU-UHFFFAOYSA-N 1 1 356.647 4.146 20 10 FICDMO CC(C)[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074944 1122068393 /nfs/dbraw/zinc/06/83/93/1122068393.db2.gz MHGKLPCEHOLNBB-RBBKRZOGSA-N 1 1 371.569 4.144 20 10 FICDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074959 1122068888 /nfs/dbraw/zinc/06/88/88/1122068888.db2.gz MTNFPNIOHFIXSE-UHFFFAOYSA-N 1 1 357.454 4.080 20 10 FICDMO CC(=O)c1ccccc1OCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074863 1122069158 /nfs/dbraw/zinc/06/91/58/1122069158.db2.gz ILWOFVAFVDPCJG-UHFFFAOYSA-N 1 1 354.494 4.245 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(O)c(C(C)(C)C)c1 ZINC000918066959 1122542362 /nfs/dbraw/zinc/54/23/62/1122542362.db2.gz POQOGLYZYPXRSC-UHFFFAOYSA-N 1 1 356.510 4.396 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601902 1122723494 /nfs/dbraw/zinc/72/34/94/1122723494.db2.gz LLDUUOVYSBMEMI-PKOBYXMFSA-N 1 1 371.912 4.104 20 10 FICDMO CC[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cc(F)ccc1O ZINC000179883607 1124133760 /nfs/dbraw/zinc/13/37/60/1124133760.db2.gz DLKNXXJOKWDUJV-UHFFFAOYSA-N 1 1 370.346 4.011 20 10 FICDMO CC[N@@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cc(F)ccc1O ZINC000179883607 1124133763 /nfs/dbraw/zinc/13/37/63/1124133763.db2.gz DLKNXXJOKWDUJV-UHFFFAOYSA-N 1 1 370.346 4.011 20 10 FICDMO CC(C)Cc1ncc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)s1 ZINC000160209375 1079610970 /nfs/dbraw/zinc/61/09/70/1079610970.db2.gz PEOQZYIWADYSRU-QGZVFWFLSA-N 1 1 360.523 4.228 20 10 FICDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](c2ccc(Br)cc2)C1 ZINC001140055205 1080740772 /nfs/dbraw/zinc/74/07/72/1080740772.db2.gz NRZWKDURYSBRPS-ZDUSSCGKSA-N 1 1 350.231 4.283 20 10 FICDMO Cc1c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1ccc(Cl)cc1 ZINC000160546985 1082016103 /nfs/dbraw/zinc/01/61/03/1082016103.db2.gz GQHGGVBZQCABSV-AWEZNQCLSA-N 1 1 369.900 4.146 20 10 FICDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)cc1C ZINC000276773814 1083209026 /nfs/dbraw/zinc/20/90/26/1083209026.db2.gz COKQGOCMLOBNNX-GOSISDBHSA-N 1 1 371.481 4.013 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)cc1C ZINC000276773814 1083209028 /nfs/dbraw/zinc/20/90/28/1083209028.db2.gz COKQGOCMLOBNNX-GOSISDBHSA-N 1 1 371.481 4.013 20 10 FICDMO C[C@@H](c1ccccc1)[N@H+](CC(=O)Nc1nccs1)Cc1ccccc1O ZINC000176676841 1086572204 /nfs/dbraw/zinc/57/22/04/1086572204.db2.gz YLASWZAJGWYAHX-HNNXBMFYSA-N 1 1 367.474 4.051 20 10 FICDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)Nc1nccs1)Cc1ccccc1O ZINC000176676841 1086572210 /nfs/dbraw/zinc/57/22/10/1086572210.db2.gz YLASWZAJGWYAHX-HNNXBMFYSA-N 1 1 367.474 4.051 20 10 FICDMO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708555146 1087445184 /nfs/dbraw/zinc/44/51/84/1087445184.db2.gz MCFWIMJEYGJZSI-LJQANCHMSA-N 1 1 360.448 4.061 20 10 FICDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708555146 1087445186 /nfs/dbraw/zinc/44/51/86/1087445186.db2.gz MCFWIMJEYGJZSI-LJQANCHMSA-N 1 1 360.448 4.061 20 10 FICDMO C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355766 1088588997 /nfs/dbraw/zinc/58/89/97/1088588997.db2.gz CSUKTBGASJQXHZ-FPOVZHCZSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355766 1088589012 /nfs/dbraw/zinc/58/90/12/1088589012.db2.gz CSUKTBGASJQXHZ-FPOVZHCZSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc2ccccc2c1[O-] ZINC000185056577 1090500823 /nfs/dbraw/zinc/50/08/23/1090500823.db2.gz SITGNVLNZGDMCB-QGZVFWFLSA-N 1 1 364.489 4.337 20 10 FICDMO C[C@@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)c1ccc(F)cc1O ZINC000185429434 1090542431 /nfs/dbraw/zinc/54/24/31/1090542431.db2.gz NCQBRHRVZRJABD-OAHLLOKOSA-N 1 1 359.441 4.078 20 10 FICDMO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310074564 1090615447 /nfs/dbraw/zinc/61/54/47/1090615447.db2.gz FTHXCTXGPMTUQX-OAHLLOKOSA-N 1 1 365.304 4.311 20 10 FICDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nc(-c3cc(C)ccn3)n[nH]2)cc1 ZINC000279581566 1091934990 /nfs/dbraw/zinc/93/49/90/1091934990.db2.gz UPCPAZJYESUUQS-HZPDHXFCSA-N 1 1 364.497 4.043 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(Cl)cc2)c1 ZINC000273426120 1096261327 /nfs/dbraw/zinc/26/13/27/1096261327.db2.gz UECBICJUFDAWHA-BFUOFWGJSA-N 1 1 371.868 4.228 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](c4ccc(F)cc4)C3)cc2)CC1 ZINC000828031652 1101831615 /nfs/dbraw/zinc/83/16/15/1101831615.db2.gz OVKACAODKBSKBE-HXUWFJFHSA-N 1 1 368.496 4.430 20 10 FICDMO COc1ccc(N2CCC[N@H+](Cc3ncc(-c4cccs4)o3)CC2)cc1 ZINC000067377681 1104779753 /nfs/dbraw/zinc/77/97/53/1104779753.db2.gz DIMYJOXZAVODDW-UHFFFAOYSA-N 1 1 369.490 4.124 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ncc(-c4cccs4)o3)CC2)cc1 ZINC000067377681 1104779759 /nfs/dbraw/zinc/77/97/59/1104779759.db2.gz DIMYJOXZAVODDW-UHFFFAOYSA-N 1 1 369.490 4.124 20 10 FICDMO C[C@@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000527930483 1109869646 /nfs/dbraw/zinc/86/96/46/1109869646.db2.gz JYHQQTDIHLZDNZ-OQPBUACISA-N 1 1 368.186 4.350 20 10 FICDMO CCOc1ccc(O)c(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1 ZINC000151116468 1114297961 /nfs/dbraw/zinc/29/79/61/1114297961.db2.gz UASUMRMEAPQCER-OAQYLSRUSA-N 1 1 353.418 4.272 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000761203592 1115622913 /nfs/dbraw/zinc/62/29/13/1115622913.db2.gz WOAFCFAOGGGRSY-ZTFGCOKTSA-N 1 1 353.890 4.080 20 10 FICDMO Cc1cccc(C)c1C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000761981129 1120614611 /nfs/dbraw/zinc/61/46/11/1120614611.db2.gz GOCCROQJHMSYRE-GOSISDBHSA-N 1 1 372.896 4.057 20 10 FICDMO Cc1cccc([C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)c2ccccn2)c1 ZINC000153558816 1120915514 /nfs/dbraw/zinc/91/55/14/1120915514.db2.gz MKJKGBZOMUZIQA-DEOSSOPVSA-N 1 1 373.500 4.106 20 10 FICDMO Cc1cccc([C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)c2ccccn2)c1 ZINC000153558913 1120920938 /nfs/dbraw/zinc/92/09/38/1120920938.db2.gz MKJKGBZOMUZIQA-XMMPIXPASA-N 1 1 373.500 4.106 20 10 FICDMO COc1cc(C[N@H+](C)CC(=O)Nc2ccc(C)cc2)c(O)c(C(C)(C)C)c1 ZINC000915795195 1121060461 /nfs/dbraw/zinc/06/04/61/1121060461.db2.gz AXFNBHBLWZTGKM-UHFFFAOYSA-N 1 1 370.493 4.077 20 10 FICDMO COc1cc(C[N@@H+](C)CC(=O)Nc2ccc(C)cc2)c(O)c(C(C)(C)C)c1 ZINC000915795195 1121060467 /nfs/dbraw/zinc/06/04/67/1121060467.db2.gz AXFNBHBLWZTGKM-UHFFFAOYSA-N 1 1 370.493 4.077 20 10 FICDMO COc1cc(C)cc(C[N@H+](C)Cc2ccccc2Br)c1O ZINC000915807931 1121065552 /nfs/dbraw/zinc/06/55/52/1121065552.db2.gz GFYLLYASMHTRSI-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccccc2Br)c1O ZINC000915807931 1121065567 /nfs/dbraw/zinc/06/55/67/1121065567.db2.gz GFYLLYASMHTRSI-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)C(C)(C)C)C1 ZINC001626060314 1121266383 /nfs/dbraw/zinc/26/63/83/1121266383.db2.gz SRYOQQFCLOCVGW-QGZVFWFLSA-N 1 1 369.553 4.206 20 10 FICDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)NC(=O)OC(C)(C)C ZINC000785441098 1121603784 /nfs/dbraw/zinc/60/37/84/1121603784.db2.gz YQTVBESZQFQGLT-KRWDZBQOSA-N 1 1 361.530 4.022 20 10 FICDMO CCOCc1cc(CNC[C@H]2CCC[N@H+]2CC2CCCCC2)ccc1OC ZINC001649095528 1121755225 /nfs/dbraw/zinc/75/52/25/1121755225.db2.gz DYYNKZYNKVIUTN-JOCHJYFZSA-N 1 1 374.569 4.366 20 10 FICDMO CCOCc1cc(C[NH2+]C[C@H]2CCCN2CC2CCCCC2)ccc1OC ZINC001649095528 1121755230 /nfs/dbraw/zinc/75/52/30/1121755230.db2.gz DYYNKZYNKVIUTN-JOCHJYFZSA-N 1 1 374.569 4.366 20 10 FICDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917020604 1122007868 /nfs/dbraw/zinc/00/78/68/1122007868.db2.gz UAYPKPDECDRXOL-UHFFFAOYSA-N 1 1 357.429 4.356 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917020604 1122007875 /nfs/dbraw/zinc/00/78/75/1122007875.db2.gz UAYPKPDECDRXOL-UHFFFAOYSA-N 1 1 357.429 4.356 20 10 FICDMO CC(C)[N@@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccc(N(C)C)cc1 ZINC000917074910 1122069345 /nfs/dbraw/zinc/06/93/45/1122069345.db2.gz KWDGEMAPEDYMQF-UHFFFAOYSA-N 1 1 357.473 4.131 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1C(C)C ZINC000918182620 1122584295 /nfs/dbraw/zinc/58/42/95/1122584295.db2.gz BSVIWPWCNPNWEF-KRWDZBQOSA-N 1 1 362.514 4.313 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1cnn(Cc2ccccc2)c1)Cc1ccco1 ZINC000154711459 1122635690 /nfs/dbraw/zinc/63/56/90/1122635690.db2.gz ZRAONLALYDSENJ-UHFFFAOYSA-N 1 1 373.456 4.432 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1cnn(Cc2ccccc2)c1)Cc1ccco1 ZINC000154711459 1122635694 /nfs/dbraw/zinc/63/56/94/1122635694.db2.gz ZRAONLALYDSENJ-UHFFFAOYSA-N 1 1 373.456 4.432 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3cccc(C)c3)cc2F)CC1 ZINC000765847242 1124147418 /nfs/dbraw/zinc/14/74/18/1124147418.db2.gz BGJZPGVVENTJCK-GOSISDBHSA-N 1 1 355.501 4.127 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccccc1 ZINC000765853898 1124257052 /nfs/dbraw/zinc/25/70/52/1124257052.db2.gz WOISEIZANIXQTA-OAQYLSRUSA-N 1 1 355.501 4.209 20 10 FICDMO COc1cc(O)c(C[N@@H+](Cc2ccccc2O)C2CCCC2)cc1OC ZINC000180183042 1124257607 /nfs/dbraw/zinc/25/76/07/1124257607.db2.gz HCCHGAIBJRZGFL-UHFFFAOYSA-N 1 1 357.450 4.060 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ncc(-c2ccccc2)o1)C[C@@H]1CCCO1 ZINC000070976377 1125751854 /nfs/dbraw/zinc/75/18/54/1125751854.db2.gz PSTKBMOFZNTYJB-IBGZPJMESA-N 1 1 364.445 4.228 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ncc(-c2ccccc2)o1)C[C@@H]1CCCO1 ZINC000070976377 1125751861 /nfs/dbraw/zinc/75/18/61/1125751861.db2.gz PSTKBMOFZNTYJB-IBGZPJMESA-N 1 1 364.445 4.228 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1coc(-c2cccs2)n1)C[C@H]1CCCO1 ZINC000070976803 1125751756 /nfs/dbraw/zinc/75/17/56/1125751756.db2.gz IQDAMFAIIBSDJV-QGZVFWFLSA-N 1 1 370.474 4.290 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1coc(-c2cccs2)n1)C[C@H]1CCCO1 ZINC000070976803 1125751763 /nfs/dbraw/zinc/75/17/63/1125751763.db2.gz IQDAMFAIIBSDJV-QGZVFWFLSA-N 1 1 370.474 4.290 20 10 FICDMO C[N@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@H]1CCCOC1 ZINC000255033053 1080442064 /nfs/dbraw/zinc/44/20/64/1080442064.db2.gz PKBPFVLKVKMMJO-QGZVFWFLSA-N 1 1 366.465 4.399 20 10 FICDMO CC(C)[N@@H+](CC(=O)NCCCC1CCCCC1)Cc1ccc(N(C)C)cc1 ZINC001167107899 1080552184 /nfs/dbraw/zinc/55/21/84/1080552184.db2.gz KESNLWLRMVYRPC-UHFFFAOYSA-N 1 1 373.585 4.440 20 10 FICDMO Cc1cc(C(=O)N2CC[N@H+](C3CC3)C[C@@H]2C)c(C)n1-c1ccc(Cl)cc1 ZINC001648854732 1081304121 /nfs/dbraw/zinc/30/41/21/1081304121.db2.gz GJLUSKZUQPKYLI-HNNXBMFYSA-N 1 1 371.912 4.056 20 10 FICDMO Cc1cc(C(=O)N2CC[N@@H+](C3CC3)C[C@@H]2C)c(C)n1-c1ccc(Cl)cc1 ZINC001648854732 1081304122 /nfs/dbraw/zinc/30/41/22/1081304122.db2.gz GJLUSKZUQPKYLI-HNNXBMFYSA-N 1 1 371.912 4.056 20 10 FICDMO CCN(CC)c1ccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)cc1F ZINC001649268268 1081340934 /nfs/dbraw/zinc/34/09/34/1081340934.db2.gz ORDWGSQBCXODLN-UHFFFAOYSA-N 1 1 354.828 4.460 20 10 FICDMO CCOc1cccc(C[NH2+][C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c1O ZINC000276700572 1083031240 /nfs/dbraw/zinc/03/12/40/1083031240.db2.gz BGMKTWZEPQUCGD-ZDUSSCGKSA-N 1 1 371.412 4.139 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(OC)c(OC(F)F)c1)c1ccc(F)cc1O ZINC000796682816 1083389005 /nfs/dbraw/zinc/38/90/05/1083389005.db2.gz LHQCCDJMDPXSLI-CQSZACIVSA-N 1 1 355.356 4.382 20 10 FICDMO CCOc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1O ZINC000151109030 1083962115 /nfs/dbraw/zinc/96/21/15/1083962115.db2.gz NIKBQFMRQIETAH-HXUWFJFHSA-N 1 1 353.418 4.272 20 10 FICDMO C[N@@H+](CCC[NH2+]Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1 ZINC000310714450 1084391679 /nfs/dbraw/zinc/39/16/79/1084391679.db2.gz OHYPRHFXWWSSFR-UHFFFAOYSA-N 1 1 351.538 4.289 20 10 FICDMO CN(CCC[NH2+]Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1 ZINC000310714450 1084391688 /nfs/dbraw/zinc/39/16/88/1084391688.db2.gz OHYPRHFXWWSSFR-UHFFFAOYSA-N 1 1 351.538 4.289 20 10 FICDMO Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000725853812 1084854512 /nfs/dbraw/zinc/85/45/12/1084854512.db2.gz XLWIWVOFGUPOHR-UHFFFAOYSA-N 1 1 367.880 4.118 20 10 FICDMO COc1ccc(N2CCC[N@H+](Cc3cc(-c4cccs4)on3)CC2)cc1 ZINC000052465568 1086857129 /nfs/dbraw/zinc/85/71/29/1086857129.db2.gz XMSNXKXBUVBHTR-UHFFFAOYSA-N 1 1 369.490 4.124 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3cc(-c4cccs4)on3)CC2)cc1 ZINC000052465568 1086857138 /nfs/dbraw/zinc/85/71/38/1086857138.db2.gz XMSNXKXBUVBHTR-UHFFFAOYSA-N 1 1 369.490 4.124 20 10 FICDMO CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708559774 1087442959 /nfs/dbraw/zinc/44/29/59/1087442959.db2.gz UQSLZPZJNWQNJH-IBGZPJMESA-N 1 1 372.456 4.090 20 10 FICDMO COc1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c(C(F)(F)F)c1 ZINC001143485136 1088962597 /nfs/dbraw/zinc/96/25/97/1088962597.db2.gz WCXCNBQMTDPYJD-UHFFFAOYSA-N 1 1 367.367 4.074 20 10 FICDMO COc1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c(C(F)(F)F)c1 ZINC001143485136 1088962601 /nfs/dbraw/zinc/96/26/01/1088962601.db2.gz WCXCNBQMTDPYJD-UHFFFAOYSA-N 1 1 367.367 4.074 20 10 FICDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)cc2Cl)c1 ZINC000756342947 1089949686 /nfs/dbraw/zinc/94/96/86/1089949686.db2.gz LWHJMFHZTMAFRI-SNVBAGLBSA-N 1 1 354.233 4.336 20 10 FICDMO Cc1cccc(CNc2ccc(C)c(NC(=O)C[NH+]3CCCCC3)c2)c1O ZINC000181001842 1090249637 /nfs/dbraw/zinc/24/96/37/1090249637.db2.gz JWEFICHVFYSSJJ-UHFFFAOYSA-N 1 1 367.493 4.046 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1C ZINC000181467215 1090281317 /nfs/dbraw/zinc/28/13/17/1090281317.db2.gz SBXHGZHQNYRRRQ-OAHLLOKOSA-N 1 1 353.388 4.061 20 10 FICDMO C[N@@H+](CCc1nccs1)Cc1ccc(OCc2ccccc2)cc1O ZINC000183116190 1090391510 /nfs/dbraw/zinc/39/15/10/1090391510.db2.gz XUWROPHNNIGCHV-UHFFFAOYSA-N 1 1 354.475 4.102 20 10 FICDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nc(-c3cc(C)ccn3)n[nH]2)cc1 ZINC000279581562 1091934889 /nfs/dbraw/zinc/93/48/89/1091934889.db2.gz UPCPAZJYESUUQS-HOTGVXAUSA-N 1 1 364.497 4.043 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccn2)c2ccccc2OC)c1 ZINC000186193117 1101757034 /nfs/dbraw/zinc/75/70/34/1101757034.db2.gz GEKOQXGQGJBNEV-NYHFZMIOSA-N 1 1 364.445 4.245 20 10 FICDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000760406024 1101961312 /nfs/dbraw/zinc/96/13/12/1101961312.db2.gz DEYAOXYQRYXMNB-MRXNPFEDSA-N 1 1 355.478 4.489 20 10 FICDMO COc1cc(C)cc(C[NH2+][C@H](C)c2nc(-c3ccc(Cl)cc3)no2)c1O ZINC000894542915 1102551738 /nfs/dbraw/zinc/55/17/38/1102551738.db2.gz MCWGNUHZNMLQMJ-GFCCVEGCSA-N 1 1 373.840 4.263 20 10 FICDMO FC(F)(F)c1cc(N2CCOCC2)ccc1CNc1cc[nH+]cc1Cl ZINC000301532736 1107059799 /nfs/dbraw/zinc/05/97/99/1107059799.db2.gz SJZQTSQUIOQCKN-UHFFFAOYSA-N 1 1 371.790 4.203 20 10 FICDMO C[C@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000527930480 1109869517 /nfs/dbraw/zinc/86/95/17/1109869517.db2.gz JYHQQTDIHLZDNZ-ISVAXAHUSA-N 1 1 368.186 4.350 20 10 FICDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(Cl)cc(OC)c1O ZINC000761182382 1115596582 /nfs/dbraw/zinc/59/65/82/1115596582.db2.gz CTHVQAQMHQCYPS-UHFFFAOYSA-N 1 1 365.857 4.094 20 10 FICDMO COc1ccc(-c2nc(C[N@H+](C)Cc3ccccc3O)cs2)cc1OC ZINC000171937135 1115892829 /nfs/dbraw/zinc/89/28/29/1115892829.db2.gz NPWPOTIFNWXOIK-UHFFFAOYSA-N 1 1 370.474 4.165 20 10 FICDMO COc1ccc(-c2nc(C[N@@H+](C)Cc3ccccc3O)cs2)cc1OC ZINC000171937135 1115892831 /nfs/dbraw/zinc/89/28/31/1115892831.db2.gz NPWPOTIFNWXOIK-UHFFFAOYSA-N 1 1 370.474 4.165 20 10 FICDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000762471066 1120912431 /nfs/dbraw/zinc/91/24/31/1120912431.db2.gz IIPXUWLPYSUCRJ-GOSISDBHSA-N 1 1 372.509 4.394 20 10 FICDMO Cc1noc(C)c1CO[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000762471026 1120912499 /nfs/dbraw/zinc/91/24/99/1120912499.db2.gz URJILFVGNAFRFZ-SFHVURJKSA-N 1 1 358.482 4.220 20 10 FICDMO CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1NC1CCC(OC)CC1)N=[N+]=[N-] ZINC001168603981 1121884562 /nfs/dbraw/zinc/88/45/62/1121884562.db2.gz WKUHPRIFOUDMLU-BOPFTXTBSA-N 1 1 373.457 4.282 20 10 FICDMO CN(C)c1ccc(C[N@@H+](CCC(=O)Nc2ccccc2Cl)C2CC2)cc1 ZINC000917075508 1122071352 /nfs/dbraw/zinc/07/13/52/1122071352.db2.gz YAFJMAUBEDAGDC-UHFFFAOYSA-N 1 1 371.912 4.399 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000917088057 1122098477 /nfs/dbraw/zinc/09/84/77/1122098477.db2.gz NDNKKFDOMRSOKC-UHFFFAOYSA-N 1 1 364.411 4.426 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(N2CCCC2)nc1 ZINC000154714097 1122629732 /nfs/dbraw/zinc/62/97/32/1122629732.db2.gz XXJAQGAXUJWRQC-UHFFFAOYSA-N 1 1 363.461 4.183 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(N2CCCC2)nc1 ZINC000154714097 1122629736 /nfs/dbraw/zinc/62/97/36/1122629736.db2.gz XXJAQGAXUJWRQC-UHFFFAOYSA-N 1 1 363.461 4.183 20 10 FICDMO CC[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@@H]1CCCO1 ZINC000919946286 1123277457 /nfs/dbraw/zinc/27/74/57/1123277457.db2.gz ZPJZALRFSZZDSW-HNNXBMFYSA-N 1 1 364.283 4.309 20 10 FICDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1c(O)ccc2ccncc21 ZINC000919949996 1123278554 /nfs/dbraw/zinc/27/85/54/1123278554.db2.gz APEVIXLFLCNCLO-UHFFFAOYSA-N 1 1 351.406 4.259 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c(C)n1-c1cccc(Cl)c1 ZINC000919981875 1123298725 /nfs/dbraw/zinc/29/87/25/1123298725.db2.gz AWDHVLSWCOANPN-UXHICEINSA-N 1 1 371.912 4.104 20 10 FICDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000179568138 1124007671 /nfs/dbraw/zinc/00/76/71/1124007671.db2.gz WFFUPCLYKCNKSP-INIZCTEOSA-N 1 1 369.852 4.475 20 10 FICDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000179737088 1124046975 /nfs/dbraw/zinc/04/69/75/1124046975.db2.gz RSLZAJXFHVTHMZ-LJQANCHMSA-N 1 1 373.541 4.024 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccccc1 ZINC000765853897 1124256774 /nfs/dbraw/zinc/25/67/74/1124256774.db2.gz WOISEIZANIXQTA-NRFANRHFSA-N 1 1 355.501 4.209 20 10 FICDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110535 1125283902 /nfs/dbraw/zinc/28/39/02/1125283902.db2.gz ILDYRGSAXBWXHC-MRXNPFEDSA-N 1 1 362.514 4.131 20 10 FICDMO Cc1ncsc1C[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000183044000 1125726032 /nfs/dbraw/zinc/72/60/32/1125726032.db2.gz PCYHWCOBUCOPME-UHFFFAOYSA-N 1 1 354.475 4.368 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1nc2ccccc2s1)C[C@H]1CCCO1 ZINC000070976799 1125751471 /nfs/dbraw/zinc/75/14/71/1125751471.db2.gz VOXXERAYYFRQQC-MRXNPFEDSA-N 1 1 354.475 4.183 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1nc2ccccc2s1)C[C@H]1CCCO1 ZINC000070976799 1125751473 /nfs/dbraw/zinc/75/14/73/1125751473.db2.gz VOXXERAYYFRQQC-MRXNPFEDSA-N 1 1 354.475 4.183 20 10 FICDMO CCOCc1cc(C[NH2+]Cc2nc3cccc(Cl)c3n2C)ccc1OC ZINC000274759594 1079937132 /nfs/dbraw/zinc/93/71/32/1079937132.db2.gz GNYKQBKXZKYAKN-UHFFFAOYSA-N 1 1 373.884 4.062 20 10 FICDMO COc1ccc(N2CCC[N@@H+](C[C@@H]3CC[C@@H](c4ccccc4)O3)CC2)cc1 ZINC001167107679 1080552598 /nfs/dbraw/zinc/55/25/98/1080552598.db2.gz GIJKPJSBNSJBSQ-GOTSBHOMSA-N 1 1 366.505 4.128 20 10 FICDMO C[C@@H]1C[C@@H]1C[N@H+]1CCc2c(Cl)c(O)c(O)cc2[C@H](c2ccc(O)cc2)C1 ZINC001209433026 1080681875 /nfs/dbraw/zinc/68/18/75/1080681875.db2.gz SNHQFYQFCDYPFA-DFHBCGBQSA-N 1 1 373.880 4.103 20 10 FICDMO Clc1ccc2c(NCc3ccc(N4CCOCC4)cc3)cc[nH+]c2c1 ZINC000064931098 1081846285 /nfs/dbraw/zinc/84/62/85/1081846285.db2.gz WAXIELOIOOGPGH-UHFFFAOYSA-N 1 1 353.853 4.337 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(OC)c(OC(F)F)c1)c1ccc(F)cc1O ZINC000796682815 1083389465 /nfs/dbraw/zinc/38/94/65/1083389465.db2.gz LHQCCDJMDPXSLI-AWEZNQCLSA-N 1 1 355.356 4.382 20 10 FICDMO COc1cc(O)c(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cc1OC ZINC000179433835 1083462276 /nfs/dbraw/zinc/46/22/76/1083462276.db2.gz OFGYHBQKTLHEMW-LBPRGKRZSA-N 1 1 358.463 4.212 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cc1OC ZINC000179433835 1083462283 /nfs/dbraw/zinc/46/22/83/1083462283.db2.gz OFGYHBQKTLHEMW-LBPRGKRZSA-N 1 1 358.463 4.212 20 10 FICDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)NC1CCCC1)Cc1ccccc1O ZINC000176674327 1085055199 /nfs/dbraw/zinc/05/51/99/1085055199.db2.gz VJIOELQKHUAUTC-QGZVFWFLSA-N 1 1 352.478 4.014 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2Cc2nc(CCC3CC3)no2)C1 ZINC000582691428 1085392555 /nfs/dbraw/zinc/39/25/55/1085392555.db2.gz DOOODJSIJNSXHN-UHFFFAOYSA-N 1 1 364.493 4.182 20 10 FICDMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@H+]1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000588564579 1086031827 /nfs/dbraw/zinc/03/18/27/1086031827.db2.gz QCFSPDUVHNLQDH-CWPLJXCYSA-N 1 1 366.465 4.274 20 10 FICDMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000588564579 1086031832 /nfs/dbraw/zinc/03/18/32/1086031832.db2.gz QCFSPDUVHNLQDH-CWPLJXCYSA-N 1 1 366.465 4.274 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2Cc2nc(-c3ccoc3)no2)C1 ZINC000685365439 1087546767 /nfs/dbraw/zinc/54/67/67/1087546767.db2.gz AZSMOCFUJZWWER-UHFFFAOYSA-N 1 1 362.433 4.099 20 10 FICDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311584330 1088737020 /nfs/dbraw/zinc/73/70/20/1088737020.db2.gz XYYXDRSDVOSWAX-CNNODRBYSA-N 1 1 351.538 4.314 20 10 FICDMO COc1cc(OC)cc(C2(F)CC[NH+](Cc3cccc(F)c3O)CC2)c1 ZINC000802659521 1089328864 /nfs/dbraw/zinc/32/88/64/1089328864.db2.gz IKVZBUVVDNMYMZ-UHFFFAOYSA-N 1 1 363.404 4.009 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)[C@H](C)C2(C)CC2)C1 ZINC000435806271 1089954506 /nfs/dbraw/zinc/95/45/06/1089954506.db2.gz CKYBIODRRJKYMP-QGZVFWFLSA-N 1 1 367.537 4.055 20 10 FICDMO C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(Br)cc1[O-] ZINC000756363458 1090127506 /nfs/dbraw/zinc/12/75/06/1090127506.db2.gz OGGASJAXGGZZRA-ZIAGYGMSSA-N 1 1 355.320 4.070 20 10 FICDMO Oc1ccc2ccncc2c1C[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000728904951 1091888418 /nfs/dbraw/zinc/88/84/18/1091888418.db2.gz SVVBMGIRLJAKHN-HXUWFJFHSA-N 1 1 354.837 4.167 20 10 FICDMO Oc1ccc2ccncc2c1C[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000728904951 1091888423 /nfs/dbraw/zinc/88/84/23/1091888423.db2.gz SVVBMGIRLJAKHN-HXUWFJFHSA-N 1 1 354.837 4.167 20 10 FICDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3cc(C)ccn3)n[nH]2)cc1 ZINC000279581558 1091935249 /nfs/dbraw/zinc/93/52/49/1091935249.db2.gz UPCPAZJYESUUQS-CVEARBPZSA-N 1 1 364.497 4.043 20 10 FICDMO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000279935156 1092653975 /nfs/dbraw/zinc/65/39/75/1092653975.db2.gz AWXAPVWEETYNDC-AZUAARDMSA-N 1 1 353.441 4.404 20 10 FICDMO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Br)c(F)c2F)cc1 ZINC001141752021 1093312215 /nfs/dbraw/zinc/31/22/15/1093312215.db2.gz SZKSEXJTKFNDFX-UHFFFAOYSA-N 1 1 369.253 4.425 20 10 FICDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Br)c(F)c2F)cc1 ZINC001141752021 1093312216 /nfs/dbraw/zinc/31/22/16/1093312216.db2.gz SZKSEXJTKFNDFX-UHFFFAOYSA-N 1 1 369.253 4.425 20 10 FICDMO COc1ccc(C)cc1C[NH2+]Cc1cc(C)cc(Br)c1O ZINC001648951321 1093965838 /nfs/dbraw/zinc/96/58/38/1093965838.db2.gz RIBCUFGAIMOOQF-UHFFFAOYSA-N 1 1 350.256 4.070 20 10 FICDMO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc(Br)ccc2O)cs1 ZINC000273368914 1096256734 /nfs/dbraw/zinc/25/67/34/1096256734.db2.gz CBGZECAFXZPXOO-NXEZZACHSA-N 1 1 371.300 4.169 20 10 FICDMO CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(C)[nH+]c3C)c2C)cc1 ZINC000760179507 1101581791 /nfs/dbraw/zinc/58/17/91/1101581791.db2.gz WSFXPGNLCROHKB-UHFFFAOYSA-N 1 1 351.450 4.189 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1 ZINC000186133097 1101756040 /nfs/dbraw/zinc/75/60/40/1101756040.db2.gz VAVLSQZZEOCZER-LHSJRXKWSA-N 1 1 353.418 4.443 20 10 FICDMO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccn1 ZINC000186193515 1101757083 /nfs/dbraw/zinc/75/70/83/1101757083.db2.gz ZTENJZSYVUHQDV-LHSJRXKWSA-N 1 1 352.409 4.375 20 10 FICDMO Oc1cc(F)c(F)cc1C[NH+]1CCC2(CC1)OCc1cc(Cl)ccc12 ZINC001142527076 1102156980 /nfs/dbraw/zinc/15/69/80/1102156980.db2.gz JUZOLOAJHJHVPR-UHFFFAOYSA-N 1 1 365.807 4.345 20 10 FICDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000729850998 1102748461 /nfs/dbraw/zinc/74/84/61/1102748461.db2.gz DVUDQKZQENFRGB-HXUWFJFHSA-N 1 1 355.478 4.359 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC001167982234 1102786189 /nfs/dbraw/zinc/78/61/89/1102786189.db2.gz ALSSIUKBCVAUQW-WMZOPIPTSA-N 1 1 369.383 4.487 20 10 FICDMO CC[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc(Br)ccc1O ZINC000840889076 1107678872 /nfs/dbraw/zinc/67/88/72/1107678872.db2.gz BBERAYWSIONYMW-LBPRGKRZSA-N 1 1 368.300 4.125 20 10 FICDMO CC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc(Br)ccc1O ZINC000840889075 1107679022 /nfs/dbraw/zinc/67/90/22/1107679022.db2.gz BBERAYWSIONYMW-GFCCVEGCSA-N 1 1 368.300 4.125 20 10 FICDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nccn2CCc2ccccc2)cc1 ZINC000164257765 1114445466 /nfs/dbraw/zinc/44/54/66/1114445466.db2.gz USWQRYFFFCUHGE-LJQANCHMSA-N 1 1 362.521 4.433 20 10 FICDMO CN(Cc1ccccc1O)C(=O)c1cccc(C[N@@H+](C)Cc2ccccc2)c1 ZINC000171258392 1115859599 /nfs/dbraw/zinc/85/95/99/1115859599.db2.gz WTWBBFVGDJFSAV-UHFFFAOYSA-N 1 1 374.484 4.296 20 10 FICDMO Cc1[nH+]ccn1CCCN(Cc1cccs1)c1ccc2c(c1)OCCO2 ZINC000762925012 1120997913 /nfs/dbraw/zinc/99/79/13/1120997913.db2.gz AUMZUAAAIKFTSM-UHFFFAOYSA-N 1 1 369.490 4.121 20 10 FICDMO CC(C)c1ccc(C[C@H]2CC[N@@H+](Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 ZINC000763392409 1121575597 /nfs/dbraw/zinc/57/55/97/1121575597.db2.gz HLDKWDUXMLCIEJ-VGSWGCGISA-N 1 1 367.489 4.006 20 10 FICDMO CC(C)[N@H+](Cc1nc(-c2ccc(F)cc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074595 1122069211 /nfs/dbraw/zinc/06/92/11/1122069211.db2.gz BOIHQGUGJBGYJN-UHFFFAOYSA-N 1 1 368.456 4.352 20 10 FICDMO CC(C)[N@@H+](Cc1nc(-c2ccc(F)cc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074595 1122069218 /nfs/dbraw/zinc/06/92/18/1122069218.db2.gz BOIHQGUGJBGYJN-UHFFFAOYSA-N 1 1 368.456 4.352 20 10 FICDMO Cc1ccc2c(C)cc(NCc3ccc(N4CCOCC4)c(F)c3)[nH+]c2c1 ZINC000917086415 1122111817 /nfs/dbraw/zinc/11/18/17/1122111817.db2.gz AZOWURLDNHYGJG-UHFFFAOYSA-N 1 1 365.452 4.439 20 10 FICDMO CCOc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1O ZINC000154722901 1122642104 /nfs/dbraw/zinc/64/21/04/1122642104.db2.gz RMFFKXPDLNPFIB-UHFFFAOYSA-N 1 1 353.418 4.292 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1ccccc1O ZINC000155016276 1123042391 /nfs/dbraw/zinc/04/23/91/1123042391.db2.gz LZLWHYFHQLJNNY-HMFYCAOWSA-N 1 1 368.521 4.242 20 10 FICDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3cc(Br)ccc32)CC(C)(C)O1 ZINC000920866216 1123532149 /nfs/dbraw/zinc/53/21/49/1123532149.db2.gz YFRREHFSGRIVLW-LBPRGKRZSA-N 1 1 364.283 4.307 20 10 FICDMO COc1ccc([C@@H]2C[C@H]([N@@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671199 1124711864 /nfs/dbraw/zinc/71/18/64/1124711864.db2.gz LXHNRUMGLBSNAS-IRLDBZIGSA-N 1 1 354.494 4.113 20 10 FICDMO Oc1c(F)cc(Br)cc1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000715739218 1125105590 /nfs/dbraw/zinc/10/55/90/1125105590.db2.gz XHVVBSQGEYTEAJ-UHFFFAOYSA-N 1 1 362.601 4.376 20 10 FICDMO COc1ccc(CC[N@@H+](C)Cc2cccc(C(C)(C)C)c2O)cc1OC ZINC001143104222 1125265517 /nfs/dbraw/zinc/26/55/17/1125265517.db2.gz QUWRDYFFIPIWQT-UHFFFAOYSA-N 1 1 357.494 4.381 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c1 ZINC000182436377 1125491982 /nfs/dbraw/zinc/49/19/82/1125491982.db2.gz JGLSNDURPOUFSO-HUUCEWRRSA-N 1 1 367.449 4.479 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1coc(-c2cccs2)n1)C[C@@H]1CCCO1 ZINC000070976800 1125751986 /nfs/dbraw/zinc/75/19/86/1125751986.db2.gz IQDAMFAIIBSDJV-KRWDZBQOSA-N 1 1 370.474 4.290 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1coc(-c2cccs2)n1)C[C@@H]1CCCO1 ZINC000070976800 1125751995 /nfs/dbraw/zinc/75/19/95/1125751995.db2.gz IQDAMFAIIBSDJV-KRWDZBQOSA-N 1 1 370.474 4.290 20 10 FICDMO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(N2CCOCC2)cc1 ZINC000154739832 1080378963 /nfs/dbraw/zinc/37/89/63/1080378963.db2.gz JOWDOXPUYUIFDP-QGZVFWFLSA-N 1 1 363.461 4.029 20 10 FICDMO COc1ccc(N2CCC[N@H+](C[C@@H](OC)c3ccc(Cl)cc3)CC2)cc1 ZINC001167107605 1080552122 /nfs/dbraw/zinc/55/21/22/1080552122.db2.gz FFOTWANEPSHKAV-OAQYLSRUSA-N 1 1 374.912 4.248 20 10 FICDMO CCN(C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1)CC(F)(F)F ZINC000177639541 1081362386 /nfs/dbraw/zinc/36/23/86/1081362386.db2.gz AZBQWRRLFXMCLK-HNNXBMFYSA-N 1 1 366.427 4.252 20 10 FICDMO Cc1c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1cccc(Cl)c1 ZINC000160528590 1081987602 /nfs/dbraw/zinc/98/76/02/1081987602.db2.gz RYWOEZJUAIPVKB-AWEZNQCLSA-N 1 1 369.900 4.146 20 10 FICDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1 ZINC000588405943 1082439852 /nfs/dbraw/zinc/43/98/52/1082439852.db2.gz JARGEPDPPCEHKM-IYCSXQJISA-N 1 1 366.461 4.124 20 10 FICDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C)C(=O)c1[nH]c(C)c(C(C)=O)c1C ZINC000157059675 1082449716 /nfs/dbraw/zinc/44/97/16/1082449716.db2.gz NPLKDDWTFALEMF-HNNXBMFYSA-N 1 1 356.466 4.023 20 10 FICDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)c1[nH]c(C)c(C(C)=O)c1C ZINC000157059675 1082449723 /nfs/dbraw/zinc/44/97/23/1082449723.db2.gz NPLKDDWTFALEMF-HNNXBMFYSA-N 1 1 356.466 4.023 20 10 FICDMO CN(C)c1ccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1 ZINC000023852668 1082664632 /nfs/dbraw/zinc/66/46/32/1082664632.db2.gz FRBFQRCWUIEOJP-UHFFFAOYSA-N 1 1 372.450 4.027 20 10 FICDMO CN(C)c1ccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1 ZINC000023852668 1082664633 /nfs/dbraw/zinc/66/46/33/1082664633.db2.gz FRBFQRCWUIEOJP-UHFFFAOYSA-N 1 1 372.450 4.027 20 10 FICDMO COc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CCC(O)CC2)c1 ZINC000092966613 1083429373 /nfs/dbraw/zinc/42/93/73/1083429373.db2.gz YFGBONDNHRGZSD-UHFFFAOYSA-N 1 1 368.521 4.067 20 10 FICDMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)cs1 ZINC000162418873 1086158119 /nfs/dbraw/zinc/15/81/19/1086158119.db2.gz BKKUQCOTGXPPID-KBPBESRZSA-N 1 1 363.502 4.093 20 10 FICDMO COc1ccc([C@@H]([NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)C2CC2)cc1 ZINC000176996375 1087729888 /nfs/dbraw/zinc/72/98/88/1087729888.db2.gz MDOYJNBADKGPGY-IBGZPJMESA-N 1 1 359.853 4.498 20 10 FICDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000782843471 1088236240 /nfs/dbraw/zinc/23/62/40/1088236240.db2.gz PWUCKWJUXRAGCC-INIZCTEOSA-N 1 1 352.409 4.123 20 10 FICDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311584331 1088737913 /nfs/dbraw/zinc/73/79/13/1088737913.db2.gz XYYXDRSDVOSWAX-IPJJNNNSSA-N 1 1 351.538 4.314 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)CC[C@@H]2C)C1 ZINC001126429927 1089140245 /nfs/dbraw/zinc/14/02/45/1089140245.db2.gz YJZBCYDYCJSOAB-MSOLQXFVSA-N 1 1 367.537 4.055 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000060942021 1091849257 /nfs/dbraw/zinc/84/92/57/1091849257.db2.gz XRTIWWZIQDGLCX-UHFFFAOYSA-N 1 1 360.173 4.463 20 10 FICDMO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000279935159 1092654207 /nfs/dbraw/zinc/65/42/07/1092654207.db2.gz AWXAPVWEETYNDC-ICSRJNTNSA-N 1 1 353.441 4.404 20 10 FICDMO COC(C)(C)C[N@@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC000758413036 1093919126 /nfs/dbraw/zinc/91/91/26/1093919126.db2.gz XMMUCFLDBOVQLM-UHFFFAOYSA-N 1 1 352.272 4.165 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC001167982231 1102787196 /nfs/dbraw/zinc/78/71/96/1102787196.db2.gz ALSSIUKBCVAUQW-FUHWJXTLSA-N 1 1 369.383 4.487 20 10 FICDMO COc1ccc2ccc(O)c(C[NH2+]C3(c4noc(C)n4)CCCCC3)c2c1 ZINC000729850845 1102798697 /nfs/dbraw/zinc/79/86/97/1102798697.db2.gz YRTZRKMSHKELRF-UHFFFAOYSA-N 1 1 367.449 4.195 20 10 FICDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000048796004 1102863243 /nfs/dbraw/zinc/86/32/43/1102863243.db2.gz SMTIDEFVXGBLEI-GFCCVEGCSA-N 1 1 350.256 4.323 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(-c2cccnc2)c1 ZINC000121304383 1107413815 /nfs/dbraw/zinc/41/38/15/1107413815.db2.gz SFFQFODZNUWCJC-UHFFFAOYSA-N 1 1 373.500 4.217 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000827986117 1108721634 /nfs/dbraw/zinc/72/16/34/1108721634.db2.gz SDSZHPHJAOAKPA-FDDCHVKYSA-N 1 1 350.506 4.495 20 10 FICDMO C[C@H](C(=O)N(c1nccs1)C1CCCCC1)[N@@H+](C)Cc1ccccc1O ZINC000111236267 1112890472 /nfs/dbraw/zinc/89/04/72/1112890472.db2.gz SMHJXBPKHMMDDL-OAHLLOKOSA-N 1 1 373.522 4.035 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc(Br)c1 ZINC000042418884 1113285340 /nfs/dbraw/zinc/28/53/40/1113285340.db2.gz SJJSKCKGWAIGHQ-UHFFFAOYSA-N 1 1 371.072 4.207 20 10 FICDMO COc1cc(C)cc(C[N@@H+](C)CCCc2cc(-c3ccccc3)no2)c1O ZINC000164258069 1114445669 /nfs/dbraw/zinc/44/56/69/1114445669.db2.gz RIYYRGNTCZXNDG-UHFFFAOYSA-N 1 1 366.461 4.429 20 10 FICDMO Oc1c(C[NH2+][C@H]2CCc3cc(F)ccc3C2)cc(Cl)c2cccnc12 ZINC001168408324 1115565302 /nfs/dbraw/zinc/56/53/02/1115565302.db2.gz UXXOEUXZQWKITK-INIZCTEOSA-N 1 1 356.828 4.380 20 10 FICDMO CN(C)c1ccc(C[NH2+]Cc2ccccc2CN(C)Cc2ccco2)cc1 ZINC000174451337 1116134921 /nfs/dbraw/zinc/13/49/21/1116134921.db2.gz XXSYEBIAAWGNCZ-UHFFFAOYSA-N 1 1 363.505 4.267 20 10 FICDMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000915793703 1121059498 /nfs/dbraw/zinc/05/94/98/1121059498.db2.gz FLPXZUBSVDTBOT-AWEZNQCLSA-N 1 1 353.418 4.067 20 10 FICDMO CC(C)(C)c1cc(C[NH+]2CCN(C(=O)C3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000915837725 1121123226 /nfs/dbraw/zinc/12/32/26/1121123226.db2.gz IMOKLGQPKXNVFL-UHFFFAOYSA-N 1 1 372.553 4.041 20 10 FICDMO CN(C)c1ccc(C[N@H+](Cc2cn3cc(Cl)ccc3n2)C2CC2)cc1 ZINC000917074298 1122067474 /nfs/dbraw/zinc/06/74/74/1122067474.db2.gz WLFPYMWLOFLCAM-UHFFFAOYSA-N 1 1 354.885 4.218 20 10 FICDMO CN(C)c1ccc(C[N@@H+](Cc2cn3cc(Cl)ccc3n2)C2CC2)cc1 ZINC000917074298 1122067486 /nfs/dbraw/zinc/06/74/86/1122067486.db2.gz WLFPYMWLOFLCAM-UHFFFAOYSA-N 1 1 354.885 4.218 20 10 FICDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000918024191 1122523320 /nfs/dbraw/zinc/52/33/20/1122523320.db2.gz YITIHTQKAHKJRY-IBGZPJMESA-N 1 1 367.537 4.021 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc3c(c2)OCO3)c(O)c(C(C)(C)C)c1 ZINC000918068840 1122537010 /nfs/dbraw/zinc/53/70/10/1122537010.db2.gz CUJXRAJIBKHXQK-UHFFFAOYSA-N 1 1 357.450 4.059 20 10 FICDMO C[N@@H+](Cc1cccc(Br)c1)Cc1c(O)ccc2ccncc21 ZINC000918180051 1122583102 /nfs/dbraw/zinc/58/31/02/1122583102.db2.gz WPLDXHCUAOAXSS-UHFFFAOYSA-N 1 1 357.251 4.335 20 10 FICDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154717547 1122631394 /nfs/dbraw/zinc/63/13/94/1122631394.db2.gz GAVVYGFAZSYVTB-UHFFFAOYSA-N 1 1 353.418 4.292 20 10 FICDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057222 1123558446 /nfs/dbraw/zinc/55/84/46/1123558446.db2.gz VDSYYXQKPMXYAJ-AEFFLSMTSA-N 1 1 354.494 4.062 20 10 FICDMO C[C@H](c1ccccc1)[N@@H+](Cc1cn2cccnc2n1)Cc1ccccc1O ZINC000179645541 1124020475 /nfs/dbraw/zinc/02/04/75/1124020475.db2.gz NHTUGKZQACUMKS-QGZVFWFLSA-N 1 1 358.445 4.198 20 10 FICDMO COc1ccc(O)c(C[N@@H+](CCc2ccccn2)Cc2ccc(F)cc2)c1 ZINC000180025398 1124191214 /nfs/dbraw/zinc/19/12/14/1124191214.db2.gz HHASQGPWTNKHEB-UHFFFAOYSA-N 1 1 366.436 4.180 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H]3CCc4c3cccc4C)cc2F)CC1 ZINC000765850700 1124215340 /nfs/dbraw/zinc/21/53/40/1124215340.db2.gz AACCLKBEOLXOOG-QFIPXVFZSA-N 1 1 367.512 4.053 20 10 FICDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000180226341 1124268561 /nfs/dbraw/zinc/26/85/61/1124268561.db2.gz HBDCBXRMPZRFJG-SNVBAGLBSA-N 1 1 360.376 4.386 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000182314479 1125399762 /nfs/dbraw/zinc/39/97/62/1125399762.db2.gz KDMZAFQXCRGHBG-CQSZACIVSA-N 1 1 367.449 4.425 20 10 FICDMO CC[N@@H+](Cc1nc2ccccc2o1)Cc1cc(Br)ccc1O ZINC000076118460 1125784489 /nfs/dbraw/zinc/78/44/89/1125784489.db2.gz PEWDTUKFIMBCEE-UHFFFAOYSA-N 1 1 361.239 4.318 20 10 FICDMO Cc1cc(C(=O)NCCn2cc[nH+]c2C)c(C)n1-c1cccc(C(C)C)c1 ZINC000748097748 1080670405 /nfs/dbraw/zinc/67/04/05/1080670405.db2.gz WAPUMDGQKNMANT-UHFFFAOYSA-N 1 1 364.493 4.152 20 10 FICDMO C[N@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@H]1CCOC1 ZINC000255052083 1080673452 /nfs/dbraw/zinc/67/34/52/1080673452.db2.gz BSQBMQZPXAXHJQ-MRXNPFEDSA-N 1 1 352.438 4.009 20 10 FICDMO COc1cc(O)c(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1OC ZINC000160309692 1081239323 /nfs/dbraw/zinc/23/93/23/1081239323.db2.gz JCFUMFDKAKVOMA-OAHLLOKOSA-N 1 1 359.491 4.024 20 10 FICDMO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167367693 1081751550 /nfs/dbraw/zinc/75/15/50/1081751550.db2.gz QIERCULOXYFWET-HSZRJFAPSA-N 1 1 350.506 4.077 20 10 FICDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1ccc(Cl)cc1 ZINC000160546863 1082015589 /nfs/dbraw/zinc/01/55/89/1082015589.db2.gz GQHGGVBZQCABSV-CQSZACIVSA-N 1 1 369.900 4.146 20 10 FICDMO Oc1ccccc1C[N@H+]1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000179568149 1083566668 /nfs/dbraw/zinc/56/66/68/1083566668.db2.gz WFFUPCLYKCNKSP-MRXNPFEDSA-N 1 1 369.852 4.475 20 10 FICDMO CC[NH+](CC)CCC[C@@H](C)N1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001167827259 1086621029 /nfs/dbraw/zinc/62/10/29/1086621029.db2.gz VHSWOIZMABPXMY-QGZVFWFLSA-N 1 1 357.542 4.056 20 10 FICDMO COc1cc(Cl)cc(C[NH2+]C[C@@]2(C)CCN(Cc3ccccc3)C2)c1O ZINC000311356681 1088590868 /nfs/dbraw/zinc/59/08/68/1088590868.db2.gz DHAPGKAEMIGRPP-OAQYLSRUSA-N 1 1 374.912 4.056 20 10 FICDMO Cc1ccccc1NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000435613968 1089798305 /nfs/dbraw/zinc/79/83/05/1089798305.db2.gz LMPPNEQBDMHMSH-UHFFFAOYSA-N 1 1 361.489 4.355 20 10 FICDMO C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc(Br)cc(F)c1[O-] ZINC000756363525 1090128470 /nfs/dbraw/zinc/12/84/70/1090128470.db2.gz OZYDFKLDXQDKGZ-STQMWFEESA-N 1 1 373.310 4.209 20 10 FICDMO C[N@@H+](CCC1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)Cc1ccccc1O ZINC001167734578 1090270193 /nfs/dbraw/zinc/27/01/93/1090270193.db2.gz OERBXGJAZCGOMH-JLYLLQBASA-N 1 1 374.525 4.392 20 10 FICDMO CCOC[C@H]1CC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000299738007 1091679021 /nfs/dbraw/zinc/67/90/21/1091679021.db2.gz MNIKTJPLFLFNNR-KRWDZBQOSA-N 1 1 366.465 4.399 20 10 FICDMO C[C@@H]1CC([NH2+]Cc2ccc(N(C)C)cc2)C[C@@H](C)N1Cc1ccccc1 ZINC001168025245 1093419877 /nfs/dbraw/zinc/41/98/77/1093419877.db2.gz JDZHRGYOZFBIQG-RTBURBONSA-N 1 1 351.538 4.284 20 10 FICDMO C[C@@H]1CC(NCc2ccc(N(C)C)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168025245 1093419880 /nfs/dbraw/zinc/41/98/80/1093419880.db2.gz JDZHRGYOZFBIQG-RTBURBONSA-N 1 1 351.538 4.284 20 10 FICDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Br)ccc2O)o1 ZINC000137064234 1093774359 /nfs/dbraw/zinc/77/43/59/1093774359.db2.gz FUJKWOFOFQUVDD-HNNXBMFYSA-N 1 1 366.255 4.231 20 10 FICDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(Br)ccc2O)o1 ZINC000137064282 1093775809 /nfs/dbraw/zinc/77/58/09/1093775809.db2.gz FUJKWOFOFQUVDD-OAHLLOKOSA-N 1 1 366.255 4.231 20 10 FICDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 ZINC000728979351 1093911277 /nfs/dbraw/zinc/91/12/77/1093911277.db2.gz UYISYAGATSNYAZ-MRXNPFEDSA-N 1 1 370.493 4.124 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186205289 1101758665 /nfs/dbraw/zinc/75/86/65/1101758665.db2.gz LFXZSSATROWGEC-SZNDQCEHSA-N 1 1 352.409 4.375 20 10 FICDMO CN(C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1)C(=O)OC(C)(C)C ZINC000729464155 1102635816 /nfs/dbraw/zinc/63/58/16/1102635816.db2.gz SCOLHRMLCRRTPJ-INIZCTEOSA-N 1 1 370.493 4.234 20 10 FICDMO Oc1c(Br)cccc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000757705458 1103702061 /nfs/dbraw/zinc/70/20/61/1103702061.db2.gz LBEIXSLBAQMMBA-ZDUSSCGKSA-N 1 1 354.631 4.031 20 10 FICDMO OCC1CCN(c2ccc(CNc3cc[nH+]c4ccsc43)cc2)CC1 ZINC000301353866 1107002944 /nfs/dbraw/zinc/00/29/44/1107002944.db2.gz LECZDFLJIYAKNL-UHFFFAOYSA-N 1 1 353.491 4.117 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000527775092 1109826504 /nfs/dbraw/zinc/82/65/04/1109826504.db2.gz YBYKHSYSMWULJW-KRWDZBQOSA-N 1 1 361.283 4.489 20 10 FICDMO C[C@H]([NH2+]C[C@H]1c2ccccc2C(=O)N1C)c1cc(Cl)c(Cl)cc1O ZINC000528005797 1109882981 /nfs/dbraw/zinc/88/29/81/1109882981.db2.gz VLKKDVOCLGYQCM-QFYYESIMSA-N 1 1 365.260 4.177 20 10 FICDMO C[C@@H]([NH2+]C[C@H]1c2ccccc2C(=O)N1C)c1cc(Cl)c(Cl)cc1O ZINC000528005788 1109883185 /nfs/dbraw/zinc/88/31/85/1109883185.db2.gz VLKKDVOCLGYQCM-HWPZZCPQSA-N 1 1 365.260 4.177 20 10 FICDMO Cc1cc(C)c(O)c(C[N@@H+](Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1 ZINC000163889454 1114406977 /nfs/dbraw/zinc/40/69/77/1114406977.db2.gz SFTSMGIUYLNPKQ-UHFFFAOYSA-N 1 1 364.489 4.066 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2N2CCCC2)c1O ZINC000761183445 1115596553 /nfs/dbraw/zinc/59/65/53/1115596553.db2.gz KFHXOSVJHZJWJP-UHFFFAOYSA-N 1 1 360.885 4.286 20 10 FICDMO COc1cc(Cl)cc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1O ZINC000761184224 1115598683 /nfs/dbraw/zinc/59/86/83/1115598683.db2.gz UEWSSISIBIZVMQ-OAHLLOKOSA-N 1 1 367.898 4.297 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000761203584 1115623056 /nfs/dbraw/zinc/62/30/56/1115623056.db2.gz WOAFCFAOGGGRSY-OLMNPRSZSA-N 1 1 353.890 4.080 20 10 FICDMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000172676998 1115972019 /nfs/dbraw/zinc/97/20/19/1115972019.db2.gz KHGOZOLDAASCMQ-MRXNPFEDSA-N 1 1 367.518 4.326 20 10 FICDMO O=C1OCCN1c1cccc2c1CC[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC000173383973 1116055870 /nfs/dbraw/zinc/05/58/70/1116055870.db2.gz LXYATFBPYKNAGS-UHFFFAOYSA-N 1 1 374.440 4.060 20 10 FICDMO CC[C@@](C)([NH2+]Cc1cccc(Br)c1O)c1nc(C)cs1 ZINC000174502077 1116137669 /nfs/dbraw/zinc/13/76/69/1116137669.db2.gz YCEBIAGBOHGKKC-OAHLLOKOSA-N 1 1 355.301 4.335 20 10 FICDMO CC[N@@H+](Cc1cccs1)Cc1cc(Br)c(OC)cc1O ZINC001233142530 1116337587 /nfs/dbraw/zinc/33/75/87/1116337587.db2.gz TVLSEGSQMDHCMD-UHFFFAOYSA-N 1 1 356.285 4.247 20 10 FICDMO CC(C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)=C1CCCC1 ZINC000761984614 1120614901 /nfs/dbraw/zinc/61/49/01/1120614901.db2.gz ZTLYWJHNLZJLFG-GOSISDBHSA-N 1 1 362.901 4.017 20 10 FICDMO COc1cc(O)c(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)cc1OC ZINC000762170060 1120755528 /nfs/dbraw/zinc/75/55/28/1120755528.db2.gz DWRMCBAYUIRZCS-LJQANCHMSA-N 1 1 353.462 4.451 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915683240 1121020306 /nfs/dbraw/zinc/02/03/06/1121020306.db2.gz YZSBFLYTDHWESZ-VWNXMTODSA-N 1 1 363.549 4.430 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000915683240 1121020315 /nfs/dbraw/zinc/02/03/15/1121020315.db2.gz YZSBFLYTDHWESZ-VWNXMTODSA-N 1 1 363.549 4.430 20 10 FICDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl)OCO2 ZINC000917474250 1122322277 /nfs/dbraw/zinc/32/22/77/1122322277.db2.gz XVDQMRPDHAZJEX-CYBMUJFWSA-N 1 1 363.816 4.121 20 10 FICDMO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1c(O)ccc2ccncc21 ZINC000917487485 1122332880 /nfs/dbraw/zinc/33/28/80/1122332880.db2.gz QEPVJCJTUOYWRN-UHFFFAOYSA-N 1 1 356.853 4.495 20 10 FICDMO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@@H](O)c2cccs2)c1 ZINC000180648812 1124381871 /nfs/dbraw/zinc/38/18/71/1124381871.db2.gz HVDHCELLMHBHHQ-HXUWFJFHSA-N 1 1 369.486 4.198 20 10 FICDMO COc1ccc([C@@H]2C[C@@H]([N@@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671201 1124711763 /nfs/dbraw/zinc/71/17/63/1124711763.db2.gz LXHNRUMGLBSNAS-UNMCSNQZSA-N 1 1 354.494 4.113 20 10 FICDMO COc1ccc(C[NH2+]Cc2cccc(Br)c2O)cc1Cl ZINC000132233591 1125489125 /nfs/dbraw/zinc/48/91/25/1125489125.db2.gz LNBUKIOAEPPCIK-UHFFFAOYSA-N 1 1 356.647 4.107 20 10 FICDMO Cc1cc(C(=O)NCCn2cc[nH+]c2C)c(C)n1-c1ccc(C(C)C)cc1 ZINC000748097144 1080676965 /nfs/dbraw/zinc/67/69/65/1080676965.db2.gz WUEROLJGPFWEBU-UHFFFAOYSA-N 1 1 364.493 4.152 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1ccccc1Br ZINC000042419291 1080720764 /nfs/dbraw/zinc/72/07/64/1080720764.db2.gz CYCDTJHVOCQRDA-UHFFFAOYSA-N 1 1 371.072 4.207 20 10 FICDMO CCOC(=O)CC[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)CC1CC1 ZINC001167261926 1080929815 /nfs/dbraw/zinc/92/98/15/1080929815.db2.gz PSKZXDGLGVNMBT-UHFFFAOYSA-N 1 1 358.526 4.151 20 10 FICDMO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167367694 1081751494 /nfs/dbraw/zinc/75/14/94/1081751494.db2.gz QIERCULOXYFWET-QHCPKHFHSA-N 1 1 350.506 4.077 20 10 FICDMO COc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)c(O)c1OC ZINC000891515288 1082909302 /nfs/dbraw/zinc/90/93/02/1082909302.db2.gz FDTWGOICTNSZPE-LBPRGKRZSA-N 1 1 358.463 4.212 20 10 FICDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)c(O)c1OC ZINC000891515288 1082909305 /nfs/dbraw/zinc/90/93/05/1082909305.db2.gz FDTWGOICTNSZPE-LBPRGKRZSA-N 1 1 358.463 4.212 20 10 FICDMO COc1ccccc1-c1noc([C@@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)n1 ZINC000276695627 1083029289 /nfs/dbraw/zinc/02/92/89/1083029289.db2.gz AASWTAPRBOHALV-GFCCVEGCSA-N 1 1 373.840 4.263 20 10 FICDMO CC[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1O ZINC000179554610 1083564581 /nfs/dbraw/zinc/56/45/81/1083564581.db2.gz QZXYPGHVFUGJQC-UHFFFAOYSA-N 1 1 353.249 4.160 20 10 FICDMO CC[N@@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cc(C)ccc1O ZINC000179605759 1083572751 /nfs/dbraw/zinc/57/27/51/1083572751.db2.gz NBILNZQCZYXMPU-UHFFFAOYSA-N 1 1 366.383 4.180 20 10 FICDMO C[C@@H]([NH2+]CCCSc1nccs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000780876837 1086304318 /nfs/dbraw/zinc/30/43/18/1086304318.db2.gz FHBBAGARDWMKBF-SJLPKXTDSA-N 1 1 361.580 4.126 20 10 FICDMO C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355768 1088589206 /nfs/dbraw/zinc/58/92/06/1088589206.db2.gz CSUKTBGASJQXHZ-TZIWHRDSSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355768 1088589208 /nfs/dbraw/zinc/58/92/08/1088589208.db2.gz CSUKTBGASJQXHZ-TZIWHRDSSA-N 1 1 351.538 4.315 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCS[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC000828025105 1091020703 /nfs/dbraw/zinc/02/07/03/1091020703.db2.gz DKSHYEYCVDBZQS-LEWJYISDSA-N 1 1 360.567 4.162 20 10 FICDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1nc3ccccc3s1)OCO2 ZINC000007091980 1101633177 /nfs/dbraw/zinc/63/31/77/1101633177.db2.gz YTKWEQDVSFHDBM-CQSZACIVSA-N 1 1 354.431 4.068 20 10 FICDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 ZINC000843758722 1102865241 /nfs/dbraw/zinc/86/52/41/1102865241.db2.gz WAEPXWDYLPVXQP-SFHVURJKSA-N 1 1 368.525 4.046 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3C[C@@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000827986121 1108743712 /nfs/dbraw/zinc/74/37/12/1108743712.db2.gz SDSZHPHJAOAKPA-JPYJTQIMSA-N 1 1 350.506 4.495 20 10 FICDMO COCCC[N@@H+](Cc1ccncc1)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164305019 1114472622 /nfs/dbraw/zinc/47/26/22/1114472622.db2.gz JDEYLJAVAVOCLH-UHFFFAOYSA-N 1 1 372.509 4.132 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C(C)C)c1O ZINC000761203693 1115620702 /nfs/dbraw/zinc/62/07/02/1115620702.db2.gz XKHKXPNHPFEUDP-SFHVURJKSA-N 1 1 363.885 4.073 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)c1O ZINC000761203545 1115622944 /nfs/dbraw/zinc/62/29/44/1115622944.db2.gz WFTHLRAPHKVXLM-KPZWWZAWSA-N 1 1 365.832 4.155 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)c1O ZINC000761203545 1115622945 /nfs/dbraw/zinc/62/29/45/1115622945.db2.gz WFTHLRAPHKVXLM-KPZWWZAWSA-N 1 1 365.832 4.155 20 10 FICDMO C[N@H+](Cc1ncc(-c2cccc(Br)c2)o1)Cc1ccccc1O ZINC000173359027 1116054860 /nfs/dbraw/zinc/05/48/60/1116054860.db2.gz KUUNWJKQSIPZMX-UHFFFAOYSA-N 1 1 373.250 4.442 20 10 FICDMO C[N@@H+](Cc1ncc(-c2cccc(Br)c2)o1)Cc1ccccc1O ZINC000173359027 1116054862 /nfs/dbraw/zinc/05/48/62/1116054862.db2.gz KUUNWJKQSIPZMX-UHFFFAOYSA-N 1 1 373.250 4.442 20 10 FICDMO CC[N@H+](Cc1noc2c1CCCC2)Cc1cc(Br)ccc1O ZINC000174426470 1116133871 /nfs/dbraw/zinc/13/38/71/1116133871.db2.gz SJKXFMGNGDCFPN-UHFFFAOYSA-N 1 1 365.271 4.044 20 10 FICDMO CC[N@@H+](Cc1noc2c1CCCC2)Cc1cc(Br)ccc1O ZINC000174426470 1116133873 /nfs/dbraw/zinc/13/38/73/1116133873.db2.gz SJKXFMGNGDCFPN-UHFFFAOYSA-N 1 1 365.271 4.044 20 10 FICDMO Cc1ccc(O)c(C[NH2+]Cc2ccccc2CN(C)Cc2ccco2)c1 ZINC000174452566 1116135235 /nfs/dbraw/zinc/13/52/35/1116135235.db2.gz PSDOSAHHHXCNRW-UHFFFAOYSA-N 1 1 350.462 4.215 20 10 FICDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000152130058 1119116831 /nfs/dbraw/zinc/11/68/31/1119116831.db2.gz AMAVNYDLUBVLFD-OAHLLOKOSA-N 1 1 367.449 4.424 20 10 FICDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000762471070 1120912530 /nfs/dbraw/zinc/91/25/30/1120912530.db2.gz IIPXUWLPYSUCRJ-SFHVURJKSA-N 1 1 372.509 4.394 20 10 FICDMO COCC[N@@H+](Cc1ccccc1)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000915808511 1121065143 /nfs/dbraw/zinc/06/51/43/1121065143.db2.gz XJUGEGXCKYSNQX-UHFFFAOYSA-N 1 1 357.494 4.347 20 10 FICDMO COc1ccc(Br)c(C[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000763378726 1121554749 /nfs/dbraw/zinc/55/47/49/1121554749.db2.gz DLSYLBFYJMOZFM-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO COc1ccc(Br)c(C[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000763378726 1121554753 /nfs/dbraw/zinc/55/47/53/1121554753.db2.gz DLSYLBFYJMOZFM-UHFFFAOYSA-N 1 1 350.256 4.104 20 10 FICDMO CN(C)c1ccc(C[N@H+](Cc2nc(-c3ccc(F)cc3)no2)C2CC2)cc1 ZINC000917074004 1122067235 /nfs/dbraw/zinc/06/72/35/1122067235.db2.gz MPCYVBACRPLKJU-UHFFFAOYSA-N 1 1 366.440 4.106 20 10 FICDMO CN(C)c1ccc(C[N@@H+](Cc2nc(-c3ccc(F)cc3)no2)C2CC2)cc1 ZINC000917074004 1122067240 /nfs/dbraw/zinc/06/72/40/1122067240.db2.gz MPCYVBACRPLKJU-UHFFFAOYSA-N 1 1 366.440 4.106 20 10 FICDMO Cc1ccc(-c2noc(C[N@@H+](Cc3ccc(N(C)C)cc3)C3CC3)n2)cc1 ZINC000917074289 1122067343 /nfs/dbraw/zinc/06/73/43/1122067343.db2.gz VWUXWTIDTWWHFW-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1ccc(-c2noc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)n2)cc1 ZINC000917074289 1122067350 /nfs/dbraw/zinc/06/73/50/1122067350.db2.gz VWUXWTIDTWWHFW-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1cccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1C ZINC000917074602 1122068928 /nfs/dbraw/zinc/06/89/28/1122068928.db2.gz CDNOCCKCLCALEW-UHFFFAOYSA-N 1 1 353.510 4.219 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccccc3OC(F)F)CC2)cc1 ZINC000917089730 1122102961 /nfs/dbraw/zinc/10/29/61/1122102961.db2.gz ISSDMTAXIRCAQE-UHFFFAOYSA-N 1 1 362.420 4.009 20 10 FICDMO Oc1ccc2cc(Br)ccc2c1C[N@H+]1CCCSCC1 ZINC000917465667 1122327223 /nfs/dbraw/zinc/32/72/23/1122327223.db2.gz PRFMRCCEJYZDHY-UHFFFAOYSA-N 1 1 352.297 4.247 20 10 FICDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000154706088 1122623500 /nfs/dbraw/zinc/62/35/00/1122623500.db2.gz YDXXDMIUYOOJHT-UHFFFAOYSA-N 1 1 363.417 4.479 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984914 1123300294 /nfs/dbraw/zinc/30/02/94/1123300294.db2.gz WGRCOWZFXGFCAD-ROUUACIJSA-N 1 1 371.912 4.104 20 10 FICDMO Cc1cc(O)c(C[NH+]2CCN(C(=O)C3CCCCC3)CC2)cc1C(C)C ZINC000921187961 1123580673 /nfs/dbraw/zinc/58/06/73/1123580673.db2.gz VYBZMZJQTLDLGP-UHFFFAOYSA-N 1 1 358.526 4.049 20 10 FICDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000180027913 1124191723 /nfs/dbraw/zinc/19/17/23/1124191723.db2.gz QVAMALHMMWYVGD-AWEZNQCLSA-N 1 1 371.387 4.100 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@H](c2cnn(C)c2)c2cccc(F)c2)cc1 ZINC000180161714 1124256546 /nfs/dbraw/zinc/25/65/46/1124256546.db2.gz SRLKYAGJODOKPI-QFIPXVFZSA-N 1 1 366.484 4.285 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000180555559 1124364814 /nfs/dbraw/zinc/36/48/14/1124364814.db2.gz WNLAIXRJFCQVFP-LLVKDONJSA-N 1 1 372.412 4.256 20 10 FICDMO COc1ccc(O)c(C[NH+](Cc2cccc(C)n2)Cc2cccc(C)n2)c1 ZINC000180698216 1124409573 /nfs/dbraw/zinc/40/95/73/1124409573.db2.gz MJLHTXDJWVHGSM-UHFFFAOYSA-N 1 1 363.461 4.010 20 10 FICDMO COc1ccc([C@H]2C[C@H]([N@@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671198 1124711644 /nfs/dbraw/zinc/71/16/44/1124711644.db2.gz LXHNRUMGLBSNAS-IFMALSPDSA-N 1 1 354.494 4.113 20 10 FICDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143103393 1125244860 /nfs/dbraw/zinc/24/48/60/1125244860.db2.gz BTMHMCKJQAQCCT-MAUKXSAKSA-N 1 1 374.525 4.131 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000182392796 1125451382 /nfs/dbraw/zinc/45/13/82/1125451382.db2.gz NCJRCNZTQKSHOR-ZIAGYGMSSA-N 1 1 353.422 4.171 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nnc(-c3ccc(C)cc3)o2)c1 ZINC000182428331 1125476235 /nfs/dbraw/zinc/47/62/35/1125476235.db2.gz OEKNDOQYKDPGTI-UONOGXRCSA-N 1 1 353.422 4.171 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc3sc(C)c(C)c3c(N)n2)c1 ZINC000182472423 1125518286 /nfs/dbraw/zinc/51/82/86/1125518286.db2.gz JPOLVROUVALZQX-GHMZBOCLSA-N 1 1 372.494 4.016 20 10 FICDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)OC(F)(F)O2 ZINC001167108325 1080553756 /nfs/dbraw/zinc/55/37/56/1080553756.db2.gz PDZVQDIBVMCDOJ-UHFFFAOYSA-N 1 1 362.420 4.485 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+]CCOc2c(C)cccc2C)c1 ZINC001648878572 1081339777 /nfs/dbraw/zinc/33/97/77/1081339777.db2.gz GLEHPJLFIBDKBR-UHFFFAOYSA-N 1 1 364.283 4.249 20 10 FICDMO Oc1ccccc1C[N@H+](C[C@@H](O)Cc1cccc(Cl)c1)C1CCCC1 ZINC001167353145 1081591831 /nfs/dbraw/zinc/59/18/31/1081591831.db2.gz FZLQTQZGHSLEAA-FQEVSTJZSA-N 1 1 359.897 4.394 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)ccc1OC(F)F ZINC000022312060 1082096271 /nfs/dbraw/zinc/09/62/71/1082096271.db2.gz BATLZHGZLLQPTA-UHFFFAOYSA-N 1 1 351.393 4.251 20 10 FICDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000177252719 1083775520 /nfs/dbraw/zinc/77/55/20/1083775520.db2.gz VKYPOOGOLZIAGY-CQSZACIVSA-N 1 1 368.408 4.255 20 10 FICDMO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)cs1 ZINC000162419130 1086157824 /nfs/dbraw/zinc/15/78/24/1086157824.db2.gz BKKUQCOTGXPPID-KGLIPLIRSA-N 1 1 363.502 4.093 20 10 FICDMO C[C@H]([NH2+]CCCSc1nccs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000780876836 1086302535 /nfs/dbraw/zinc/30/25/35/1086302535.db2.gz FHBBAGARDWMKBF-FUHWJXTLSA-N 1 1 361.580 4.126 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H]3Cc3ccccc3)cc2)CC1 ZINC000828021386 1086812564 /nfs/dbraw/zinc/81/25/64/1086812564.db2.gz WHSFTBOGGSEUKW-JOCHJYFZSA-N 1 1 350.506 4.119 20 10 FICDMO Cc1cc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc(C(F)(F)F)c1 ZINC001143458965 1087631599 /nfs/dbraw/zinc/63/15/99/1087631599.db2.gz RWHJZHVTJCLSHO-UHFFFAOYSA-N 1 1 351.368 4.373 20 10 FICDMO Cc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(C(F)(F)F)c1 ZINC001143458965 1087631602 /nfs/dbraw/zinc/63/16/02/1087631602.db2.gz RWHJZHVTJCLSHO-UHFFFAOYSA-N 1 1 351.368 4.373 20 10 FICDMO C[C@@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000311297352 1088544628 /nfs/dbraw/zinc/54/46/28/1088544628.db2.gz FZBFYTKZLUNVDV-CQSZACIVSA-N 1 1 366.477 4.219 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@@H](C)CC[C@@H]2C)C1 ZINC001126429929 1089139965 /nfs/dbraw/zinc/13/99/65/1089139965.db2.gz YJZBCYDYCJSOAB-ROUUACIJSA-N 1 1 367.537 4.055 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2ccsc2)C1 ZINC000435865361 1089983614 /nfs/dbraw/zinc/98/36/14/1089983614.db2.gz AWEGGWNQOYJYDR-UHFFFAOYSA-N 1 1 353.491 4.108 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)c1 ZINC000182345273 1090346369 /nfs/dbraw/zinc/34/63/69/1090346369.db2.gz QTUAUDLLFWSRTH-OLZOCXBDSA-N 1 1 371.412 4.310 20 10 FICDMO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(F)cc1O ZINC000756596997 1091303943 /nfs/dbraw/zinc/30/39/43/1091303943.db2.gz IOEMEKYVXQOMCO-WBMJQRKESA-N 1 1 362.832 4.031 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000108092875 1092140191 /nfs/dbraw/zinc/14/01/91/1092140191.db2.gz NGVWTIBLPVNTCT-UHFFFAOYSA-N 1 1 364.411 4.426 20 10 FICDMO C[C@H]1CC(NCc2ccc3c(c2)CCO3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168014885 1092907638 /nfs/dbraw/zinc/90/76/38/1092907638.db2.gz MWLVROUTICONPX-ROUUACIJSA-N 1 1 350.506 4.153 20 10 FICDMO C[C@H]1CC([NH2+]Cc2ccc3c(c2)CCO3)C[C@H](C)N1Cc1ccccc1 ZINC001168014885 1092907641 /nfs/dbraw/zinc/90/76/41/1092907641.db2.gz MWLVROUTICONPX-ROUUACIJSA-N 1 1 350.506 4.153 20 10 FICDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccn(-c3ccc(OC)cc3)n2)cc1 ZINC000178710831 1093144841 /nfs/dbraw/zinc/14/48/41/1093144841.db2.gz QKKIULMEQUETFO-QGZVFWFLSA-N 1 1 364.493 4.188 20 10 FICDMO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c(O)c1C ZINC000273378295 1096256850 /nfs/dbraw/zinc/25/68/50/1096256850.db2.gz HRTOZKJHOHDRJW-BEFAXECRSA-N 1 1 353.441 4.322 20 10 FICDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000760406020 1101961471 /nfs/dbraw/zinc/96/14/71/1101961471.db2.gz DEYAOXYQRYXMNB-INIZCTEOSA-N 1 1 355.478 4.489 20 10 FICDMO COc1cccc2c(NCc3ccc(N4CCOCC4)cc3)cc(C)[nH+]c12 ZINC000301648047 1107097568 /nfs/dbraw/zinc/09/75/68/1107097568.db2.gz DVEYXWHZLMSUIG-UHFFFAOYSA-N 1 1 363.461 4.001 20 10 FICDMO COc1cccc2c(NCc3ccc(N4CCOCC4)cc3)c(C)c[nH+]c12 ZINC000302639958 1107399184 /nfs/dbraw/zinc/39/91/84/1107399184.db2.gz KYZVELCCQRWLBP-UHFFFAOYSA-N 1 1 363.461 4.001 20 10 FICDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1ccc(N2CCOCC2)cc1 ZINC001168073703 1107791515 /nfs/dbraw/zinc/79/15/15/1107791515.db2.gz NNJHUNPDJWECEC-QFIPXVFZSA-N 1 1 352.522 4.366 20 10 FICDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000164008763 1114414974 /nfs/dbraw/zinc/41/49/74/1114414974.db2.gz AKZFPEMDLPPFFU-OAHLLOKOSA-N 1 1 352.434 4.230 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccc2c(c1)CCCC2 ZINC000760658487 1114427062 /nfs/dbraw/zinc/42/70/62/1114427062.db2.gz LZHJYRSDSOGHHF-LJQANCHMSA-N 1 1 363.549 4.168 20 10 FICDMO CC[N@H+](Cc1ncc(C2CC2)o1)Cc1cc(Br)ccc1O ZINC000760842073 1115108463 /nfs/dbraw/zinc/10/84/63/1115108463.db2.gz VYLXBYSVENUGFG-UHFFFAOYSA-N 1 1 351.244 4.042 20 10 FICDMO CC[N@@H+](Cc1ncc(C2CC2)o1)Cc1cc(Br)ccc1O ZINC000760842073 1115108467 /nfs/dbraw/zinc/10/84/67/1115108467.db2.gz VYLXBYSVENUGFG-UHFFFAOYSA-N 1 1 351.244 4.042 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000761201239 1115618824 /nfs/dbraw/zinc/61/88/24/1115618824.db2.gz FKZMOTLSWWSMTM-KUHUBIRLSA-N 1 1 361.869 4.325 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000761201239 1115618826 /nfs/dbraw/zinc/61/88/26/1115618826.db2.gz FKZMOTLSWWSMTM-KUHUBIRLSA-N 1 1 361.869 4.325 20 10 FICDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000152129969 1119116899 /nfs/dbraw/zinc/11/68/99/1119116899.db2.gz AMAVNYDLUBVLFD-HNNXBMFYSA-N 1 1 367.449 4.424 20 10 FICDMO COc1ccc(OC)c(C[N@@H+](Cc2c(O)ccc3ccncc32)C2CC2)c1 ZINC000914569906 1120374337 /nfs/dbraw/zinc/37/43/37/1120374337.db2.gz AXGIJTKWAXRHKX-UHFFFAOYSA-N 1 1 364.445 4.122 20 10 FICDMO CCOc1ccccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074913 1122069173 /nfs/dbraw/zinc/06/91/73/1122069173.db2.gz LBDYAXVTQKYSJG-UHFFFAOYSA-N 1 1 369.509 4.000 20 10 FICDMO Cc1ccc(C)c(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075417 1122070450 /nfs/dbraw/zinc/07/04/50/1122070450.db2.gz VMXWXSIVJPVOBA-UHFFFAOYSA-N 1 1 353.510 4.219 20 10 FICDMO CC(C)[N@@H+](Cc1nnc(-c2ccccc2)o1)Cc1ccc(N(C)C)cc1 ZINC000917075552 1122070901 /nfs/dbraw/zinc/07/09/01/1122070901.db2.gz ZQZJNVLMYLTBMJ-UHFFFAOYSA-N 1 1 350.466 4.213 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583090 1122714144 /nfs/dbraw/zinc/71/41/44/1122714144.db2.gz VCDDJEBSDMJSOH-WOJBJXKFSA-N 1 1 371.912 4.104 20 10 FICDMO COc1cc(O)c(C[N@H+](Cc2ccco2)Cc2cccs2)cc1OC ZINC000179564501 1124006818 /nfs/dbraw/zinc/00/68/18/1124006818.db2.gz IYSXDWNDFUEXCD-UHFFFAOYSA-N 1 1 359.447 4.266 20 10 FICDMO COc1cc(O)c(C[N@@H+](Cc2ccco2)Cc2cccs2)cc1OC ZINC000179564501 1124006824 /nfs/dbraw/zinc/00/68/24/1124006824.db2.gz IYSXDWNDFUEXCD-UHFFFAOYSA-N 1 1 359.447 4.266 20 10 FICDMO CCOc1cc(C[N@@H+](C)Cc2cc(OC)ccc2O)ccc1OC(F)F ZINC000179680533 1124028363 /nfs/dbraw/zinc/02/83/63/1124028363.db2.gz HHLOWJIMRJRXCG-UHFFFAOYSA-N 1 1 367.392 4.033 20 10 FICDMO Cc1cccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)c1O ZINC000179847275 1124119241 /nfs/dbraw/zinc/11/92/41/1124119241.db2.gz PQDMDXCRMKWENT-JWTNVVGKSA-N 1 1 360.498 4.063 20 10 FICDMO COc1cccc(C[N@H+]2CCc3sc(-c4csc(C)n4)cc3C2)c1O ZINC000181570382 1125026008 /nfs/dbraw/zinc/02/60/08/1125026008.db2.gz GRIHPKDFJWBOSF-UHFFFAOYSA-N 1 1 372.515 4.453 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000182392759 1125451268 /nfs/dbraw/zinc/45/12/68/1125451268.db2.gz NCJRCNZTQKSHOR-UONOGXRCSA-N 1 1 353.422 4.171 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c1 ZINC000182436339 1125491863 /nfs/dbraw/zinc/49/18/63/1125491863.db2.gz JGLSNDURPOUFSO-LSDHHAIUSA-N 1 1 367.449 4.479 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000183115297 1125750843 /nfs/dbraw/zinc/75/08/43/1125750843.db2.gz DBYYJFPDNNTPEB-JOCHJYFZSA-N 1 1 365.429 4.138 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000183115297 1125750850 /nfs/dbraw/zinc/75/08/50/1125750850.db2.gz DBYYJFPDNNTPEB-JOCHJYFZSA-N 1 1 365.429 4.138 20 10 FICDMO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(N2CCOCC2)cc1 ZINC000154739716 1080379008 /nfs/dbraw/zinc/37/90/08/1080379008.db2.gz JOWDOXPUYUIFDP-KRWDZBQOSA-N 1 1 363.461 4.029 20 10 FICDMO C[N@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)CC1CCOCC1 ZINC000255032840 1080442105 /nfs/dbraw/zinc/44/21/05/1080442105.db2.gz IQGNTROUNGKLKH-UHFFFAOYSA-N 1 1 366.465 4.399 20 10 FICDMO COc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c2ccccc21 ZINC001167107673 1080552572 /nfs/dbraw/zinc/55/25/72/1080552572.db2.gz GCDOSNWPDYGHBC-UHFFFAOYSA-N 1 1 361.489 4.474 20 10 FICDMO COc1ccc(N2CCC[N@H+](C[C@H](OC)c3ccc(Cl)cc3)CC2)cc1 ZINC001167107604 1080552585 /nfs/dbraw/zinc/55/25/85/1080552585.db2.gz FFOTWANEPSHKAV-NRFANRHFSA-N 1 1 374.912 4.248 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000155245564 1080740266 /nfs/dbraw/zinc/74/02/66/1080740266.db2.gz HHABYHQHPLAZCK-VWLOTQADSA-N 1 1 356.535 4.046 20 10 FICDMO CCOc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2OC)c1O ZINC000151108978 1083961909 /nfs/dbraw/zinc/96/19/09/1083961909.db2.gz NIKBQFMRQIETAH-FQEVSTJZSA-N 1 1 353.418 4.272 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(C(=O)N(CC)CC)cc1)c1ccc(F)cc1O ZINC000796680658 1084860898 /nfs/dbraw/zinc/86/08/98/1084860898.db2.gz XOLPELARPSUAFM-IBGZPJMESA-N 1 1 358.457 4.254 20 10 FICDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC001167567736 1084917921 /nfs/dbraw/zinc/91/79/21/1084917921.db2.gz JNBRXFQTUKNWPL-QHCPKHFHSA-N 1 1 352.522 4.366 20 10 FICDMO C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000283383329 1089523633 /nfs/dbraw/zinc/52/36/33/1089523633.db2.gz KEMPBWHIVYTTIE-NSHGMRRFSA-N 1 1 366.505 4.212 20 10 FICDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCSc3c(F)cccc32)c1 ZINC000756400727 1090322161 /nfs/dbraw/zinc/32/21/61/1090322161.db2.gz DSDPIDLXWDOIRV-BDJLRTHQSA-N 1 1 361.438 4.206 20 10 FICDMO C[C@H]([NH2+]Cc1ccc(F)cc1Br)c1cc(F)cc(F)c1O ZINC000756451268 1090452081 /nfs/dbraw/zinc/45/20/81/1090452081.db2.gz YJYULMIFTAIRCO-QMMMGPOBSA-N 1 1 360.173 4.423 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccc(Cl)cc2)c1 ZINC000273426138 1096261727 /nfs/dbraw/zinc/26/17/27/1096261727.db2.gz UECBICJUFDAWHA-YJYMSZOUSA-N 1 1 371.868 4.228 20 10 FICDMO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Br)cc2O)cs1 ZINC000273595063 1096277245 /nfs/dbraw/zinc/27/72/45/1096277245.db2.gz QFFIFZAOOKYDDX-UWVGGRQHSA-N 1 1 371.300 4.169 20 10 FICDMO c1cc(N2CCCCC2)ccc1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167964542 1101438619 /nfs/dbraw/zinc/43/86/19/1101438619.db2.gz SIAXLANRODUDPQ-BRTIRZTQSA-N 1 1 353.554 4.172 20 10 FICDMO c1cc(N2CCCCC2)ccc1CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167964542 1101438624 /nfs/dbraw/zinc/43/86/24/1101438624.db2.gz SIAXLANRODUDPQ-BRTIRZTQSA-N 1 1 353.554 4.172 20 10 FICDMO COc1cc(C)ccc1OC1CC[NH+](Cc2cc(F)c(F)cc2O)CC1 ZINC001142527148 1102157517 /nfs/dbraw/zinc/15/75/17/1102157517.db2.gz MFSYFHWDJRIFTA-UHFFFAOYSA-N 1 1 363.404 4.031 20 10 FICDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000729850997 1102780292 /nfs/dbraw/zinc/78/02/92/1102780292.db2.gz DVUDQKZQENFRGB-FQEVSTJZSA-N 1 1 355.478 4.359 20 10 FICDMO Clc1ccc2[nH+]ccc(NCc3ccc(N4CCOCC4)cc3)c2c1 ZINC000301289912 1106982325 /nfs/dbraw/zinc/98/23/25/1106982325.db2.gz PWUSNQVIYRIPII-UHFFFAOYSA-N 1 1 353.853 4.337 20 10 FICDMO Cc1cc(C[NH2+]Cc2ccc3c(c2)CCO3)c(Br)cc1F ZINC001649009835 1114308319 /nfs/dbraw/zinc/30/83/19/1114308319.db2.gz KWSROISRNNPWNX-UHFFFAOYSA-N 1 1 350.231 4.121 20 10 FICDMO C[C@H]([NH2+]Cc1nccn1CCCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000164331191 1114472741 /nfs/dbraw/zinc/47/27/41/1114472741.db2.gz BHXAUWAOGBYQCK-IBGZPJMESA-N 1 1 362.521 4.433 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1O ZINC000761192683 1115612729 /nfs/dbraw/zinc/61/27/29/1115612729.db2.gz YQUDIMITWUIOMU-KRWDZBQOSA-N 1 1 371.868 4.278 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1O ZINC000761192683 1115612732 /nfs/dbraw/zinc/61/27/32/1115612732.db2.gz YQUDIMITWUIOMU-KRWDZBQOSA-N 1 1 371.868 4.278 20 10 FICDMO COc1cc2c(cc1C[N@@H+](Cc1ccccc1O)C1CCCC1)OCO2 ZINC000761197222 1115614767 /nfs/dbraw/zinc/61/47/67/1115614767.db2.gz BJGVDFKEEVFZRJ-UHFFFAOYSA-N 1 1 355.434 4.074 20 10 FICDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761195238 1115617122 /nfs/dbraw/zinc/61/71/22/1115617122.db2.gz KZKZFKDVXGAMCW-UHFFFAOYSA-N 1 1 363.885 4.483 20 10 FICDMO CC[N@H+](Cc1cccc(F)c1)Cc1cc(Br)cc(F)c1O ZINC001235067557 1120902698 /nfs/dbraw/zinc/90/26/98/1120902698.db2.gz WFDGUHRORZPRNW-UHFFFAOYSA-N 1 1 356.210 4.455 20 10 FICDMO CC[N@@H+](Cc1cccc(F)c1)Cc1cc(Br)cc(F)c1O ZINC001235067557 1120902700 /nfs/dbraw/zinc/90/27/00/1120902700.db2.gz WFDGUHRORZPRNW-UHFFFAOYSA-N 1 1 356.210 4.455 20 10 FICDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)NC(=O)OC(C)(C)C ZINC000785441099 1121603422 /nfs/dbraw/zinc/60/34/22/1121603422.db2.gz YQTVBESZQFQGLT-QGZVFWFLSA-N 1 1 361.530 4.022 20 10 FICDMO Oc1c(CNc2[nH+]cccc2C2CCOCC2)cc(Cl)c2cccnc12 ZINC001168521768 1121885202 /nfs/dbraw/zinc/88/52/02/1121885202.db2.gz JRVATIMVLLLYEW-UHFFFAOYSA-N 1 1 369.852 4.495 20 10 FICDMO CC(C)N(C(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1)c1ccccc1 ZINC000917074188 1122067626 /nfs/dbraw/zinc/06/76/26/1122067626.db2.gz TUFCHLXXANZQTH-UHFFFAOYSA-N 1 1 365.521 4.159 20 10 FICDMO CC(C)N(C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1)c1ccccc1 ZINC000917074188 1122067631 /nfs/dbraw/zinc/06/76/31/1122067631.db2.gz TUFCHLXXANZQTH-UHFFFAOYSA-N 1 1 365.521 4.159 20 10 FICDMO COCCOc1ccccc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000154718588 1122631577 /nfs/dbraw/zinc/63/15/77/1122631577.db2.gz AZBVOPSSSFSILH-UHFFFAOYSA-N 1 1 367.445 4.213 20 10 FICDMO COCCOc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000154718588 1122631582 /nfs/dbraw/zinc/63/15/82/1122631582.db2.gz AZBVOPSSSFSILH-UHFFFAOYSA-N 1 1 367.445 4.213 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3cccc4C)cc2F)CC1 ZINC000765850699 1124214638 /nfs/dbraw/zinc/21/46/38/1124214638.db2.gz AACCLKBEOLXOOG-JOCHJYFZSA-N 1 1 367.512 4.053 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H]3CCc4ccc(C)cc43)cc2F)CC1 ZINC000765853939 1124240606 /nfs/dbraw/zinc/24/06/06/1124240606.db2.gz YPRPBXMYSYRZLE-QFIPXVFZSA-N 1 1 367.512 4.053 20 10 FICDMO CN(Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cc(F)ccc1O ZINC000180782860 1124435843 /nfs/dbraw/zinc/43/58/43/1124435843.db2.gz VEMHIFFIGPYXKI-UHFFFAOYSA-N 1 1 354.425 4.046 20 10 FICDMO COc1ccc([C@H]2C[C@@H]([N@@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671200 1124712044 /nfs/dbraw/zinc/71/20/44/1124712044.db2.gz LXHNRUMGLBSNAS-RBBKRZOGSA-N 1 1 354.494 4.113 20 10 FICDMO Cc1ncc(C[N@H+](C)Cc2ccc(OCc3ccccc3)cc2O)s1 ZINC000183009608 1125717509 /nfs/dbraw/zinc/71/75/09/1125717509.db2.gz ZTIMOQWLIOQVEX-UHFFFAOYSA-N 1 1 354.475 4.368 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1c[nH]nc1-c1cccs1)C[C@@H]1CCCO1 ZINC000160178242 1079547933 /nfs/dbraw/zinc/54/79/33/1079547933.db2.gz UISAYVIOLHFXFN-KRWDZBQOSA-N 1 1 369.490 4.025 20 10 FICDMO c1coc(C[N@H+](Cc2cccs2)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000160657404 1082180110 /nfs/dbraw/zinc/18/01/10/1082180110.db2.gz ZSXNOWKHTHRFJC-UHFFFAOYSA-N 1 1 368.502 4.380 20 10 FICDMO c1coc(C[N@@H+](Cc2cccs2)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000160657404 1082180115 /nfs/dbraw/zinc/18/01/15/1082180115.db2.gz ZSXNOWKHTHRFJC-UHFFFAOYSA-N 1 1 368.502 4.380 20 10 FICDMO CC(C)([NH2+]Cc1cccc(Br)c1O)c1ccc(F)c(F)c1 ZINC000175989263 1082403636 /nfs/dbraw/zinc/40/36/36/1082403636.db2.gz QLPVFVHYTBUMLA-UHFFFAOYSA-N 1 1 356.210 4.458 20 10 FICDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCOCC3)o2)cc1C ZINC000276773818 1083208878 /nfs/dbraw/zinc/20/88/78/1083208878.db2.gz COKQGOCMLOBNNX-SFHVURJKSA-N 1 1 371.481 4.013 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCC[C@H]2c2nnc(C3CCOCC3)o2)cc1C ZINC000276773818 1083208882 /nfs/dbraw/zinc/20/88/82/1083208882.db2.gz COKQGOCMLOBNNX-SFHVURJKSA-N 1 1 371.481 4.013 20 10 FICDMO CCC[N@@H+](CC(=O)N(CC)[C@H](C)c1ccc(F)cc1)Cc1ccccc1O ZINC001167521905 1084439751 /nfs/dbraw/zinc/43/97/51/1084439751.db2.gz MPQQTDIZRPVGIY-QGZVFWFLSA-N 1 1 372.484 4.353 20 10 FICDMO c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240034 1090434421 /nfs/dbraw/zinc/43/44/21/1090434421.db2.gz CEWIGIGFFQZYAV-QHCPKHFHSA-N 1 1 363.549 4.289 20 10 FICDMO c1ccc(CN2CC[C@@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240034 1090434426 /nfs/dbraw/zinc/43/44/26/1090434426.db2.gz CEWIGIGFFQZYAV-QHCPKHFHSA-N 1 1 363.549 4.289 20 10 FICDMO COC(=O)C[N@H+](CCCC1CCCCC1)Cc1cc(Cl)ccc1O ZINC001167741569 1090677232 /nfs/dbraw/zinc/67/72/32/1090677232.db2.gz SSYTVDLGLXSSLC-UHFFFAOYSA-N 1 1 353.890 4.381 20 10 FICDMO COC(=O)C[N@@H+](CCCC1CCCCC1)Cc1cc(Cl)ccc1O ZINC001167741569 1090677236 /nfs/dbraw/zinc/67/72/36/1090677236.db2.gz SSYTVDLGLXSSLC-UHFFFAOYSA-N 1 1 353.890 4.381 20 10 FICDMO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c(O)c1C ZINC000273397533 1096259030 /nfs/dbraw/zinc/25/90/30/1096259030.db2.gz MEYZTKRYEDRAMU-DNVCBOLYSA-N 1 1 353.441 4.322 20 10 FICDMO CC[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1ccc(F)cc1O ZINC000287435692 1099251508 /nfs/dbraw/zinc/25/15/08/1099251508.db2.gz KTJBRJLSWYGOON-AWEZNQCLSA-N 1 1 358.335 4.108 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1 ZINC000186133111 1101755610 /nfs/dbraw/zinc/75/56/10/1101755610.db2.gz VAVLSQZZEOCZER-SPLOXXLWSA-N 1 1 353.418 4.443 20 10 FICDMO COc1ccc2c(c1)CCCC[N@H+]2CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC001168245203 1102621180 /nfs/dbraw/zinc/62/11/80/1102621180.db2.gz ZAYQQYLFFXWECT-UHFFFAOYSA-N 1 1 374.525 4.485 20 10 FICDMO COc1ccc2c(c1)CCCC[N@@H+]2CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC001168245203 1102621186 /nfs/dbraw/zinc/62/11/86/1102621186.db2.gz ZAYQQYLFFXWECT-UHFFFAOYSA-N 1 1 374.525 4.485 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCc3ccccc3OC)c2c1 ZINC000729466636 1102766339 /nfs/dbraw/zinc/76/63/39/1102766339.db2.gz VZCGDCWQZVEXCD-UHFFFAOYSA-N 1 1 351.446 4.237 20 10 FICDMO CC(C)Cc1ncc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000160209230 1105123991 /nfs/dbraw/zinc/12/39/91/1105123991.db2.gz PEOQZYIWADYSRU-KRWDZBQOSA-N 1 1 360.523 4.228 20 10 FICDMO CN(Cc1ccccc1O)C(=O)C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000303922960 1107793876 /nfs/dbraw/zinc/79/38/76/1107793876.db2.gz PAFXICWAIVTRGA-UHFFFAOYSA-N 1 1 374.484 4.053 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(Br)cc1 ZINC000042411733 1113275223 /nfs/dbraw/zinc/27/52/23/1113275223.db2.gz BKAJNZRRQJKEJT-UHFFFAOYSA-N 1 1 371.072 4.207 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000913170306 1114305000 /nfs/dbraw/zinc/30/50/00/1114305000.db2.gz UJVWUSDRAISKKB-QHCPKHFHSA-N 1 1 351.538 4.460 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cn(-c3ccccc3)nn2)cc1F ZINC000760713856 1114670252 /nfs/dbraw/zinc/67/02/52/1114670252.db2.gz NKSNIDZLHAJSSH-MRXNPFEDSA-N 1 1 367.472 4.103 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1O ZINC000761191412 1115614675 /nfs/dbraw/zinc/61/46/75/1115614675.db2.gz TWEWCNZNYJPMHB-UHFFFAOYSA-N 1 1 364.829 4.373 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000761203589 1115623041 /nfs/dbraw/zinc/62/30/41/1115623041.db2.gz WOAFCFAOGGGRSY-QGTPRVQTSA-N 1 1 353.890 4.080 20 10 FICDMO C[N@H+](Cc1ncc(-c2ccc(Br)cc2)o1)Cc1ccccc1O ZINC000173358796 1116054622 /nfs/dbraw/zinc/05/46/22/1116054622.db2.gz UETDNNJWZXWVFY-UHFFFAOYSA-N 1 1 373.250 4.442 20 10 FICDMO C[N@@H+](Cc1ncc(-c2ccc(Br)cc2)o1)Cc1ccccc1O ZINC000173358796 1116054624 /nfs/dbraw/zinc/05/46/24/1116054624.db2.gz UETDNNJWZXWVFY-UHFFFAOYSA-N 1 1 373.250 4.442 20 10 FICDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cn1c(=O)oc2ccc(Cl)cc21 ZINC000917411392 1122300511 /nfs/dbraw/zinc/30/05/11/1122300511.db2.gz PTVZCCBGTJSOQH-UHFFFAOYSA-N 1 1 373.884 4.182 20 10 FICDMO CC(C)(C)OC(=O)N[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000918183823 1122584948 /nfs/dbraw/zinc/58/49/48/1122584948.db2.gz UAYJOPFSVMKPAR-INIZCTEOSA-N 1 1 356.466 4.035 20 10 FICDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057229 1123558224 /nfs/dbraw/zinc/55/82/24/1123558224.db2.gz VDSYYXQKPMXYAJ-WMZOPIPTSA-N 1 1 354.494 4.062 20 10 FICDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057441 1123558260 /nfs/dbraw/zinc/55/82/60/1123558260.db2.gz WOBKMSXDZWINQS-QZTJIDSGSA-N 1 1 360.542 4.341 20 10 FICDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057438 1123558298 /nfs/dbraw/zinc/55/82/98/1123558298.db2.gz WOBKMSXDZWINQS-MSOLQXFVSA-N 1 1 360.542 4.341 20 10 FICDMO CCC[N@@H+](Cc1coc(-c2ccc(OC)cc2)n1)Cc1ccccc1O ZINC000068973695 1124433242 /nfs/dbraw/zinc/43/32/42/1124433242.db2.gz QDYXAFMBIWUNID-UHFFFAOYSA-N 1 1 352.434 4.468 20 10 FICDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)n1 ZINC000068962176 1124437440 /nfs/dbraw/zinc/43/74/40/1124437440.db2.gz CNLPHVUYBVXTPV-CQSZACIVSA-N 1 1 367.449 4.088 20 10 FICDMO CN1CCN(c2ccc(C[NH2+]CCc3ccc(C(C)(C)C)cc3)cc2)CC1 ZINC001648789358 1080212273 /nfs/dbraw/zinc/21/22/73/1080212273.db2.gz HCHJPWFXERUYPB-UHFFFAOYSA-N 1 1 365.565 4.068 20 10 FICDMO COc1ccc(N2CCC[N@@H+](C[C@H]3CC[C@H](c4ccccc4)O3)CC2)cc1 ZINC001167107678 1080552106 /nfs/dbraw/zinc/55/21/06/1080552106.db2.gz GIJKPJSBNSJBSQ-DHIUTWEWSA-N 1 1 366.505 4.128 20 10 FICDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(Cl)c(F)c1 ZINC001167108278 1080553346 /nfs/dbraw/zinc/55/33/46/1080553346.db2.gz NLDZWFLGYFFLNH-HXUWFJFHSA-N 1 1 364.892 4.489 20 10 FICDMO CCOc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC001167108298 1080553560 /nfs/dbraw/zinc/55/35/60/1080553560.db2.gz OKHZEECCUASOMY-UHFFFAOYSA-N 1 1 371.481 4.470 20 10 FICDMO CCN(C)c1ccc(C[NH+]2CCN(C(=O)CCC3CCCCC3)CC2)cc1 ZINC001167122590 1080619671 /nfs/dbraw/zinc/61/96/71/1080619671.db2.gz JTIYCPBJBFHKBH-UHFFFAOYSA-N 1 1 371.569 4.147 20 10 FICDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccc(Br)cc2)C1 ZINC001140055203 1080740446 /nfs/dbraw/zinc/74/04/46/1080740446.db2.gz NRZWKDURYSBRPS-CYBMUJFWSA-N 1 1 350.231 4.283 20 10 FICDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(O)cccc1Br ZINC001140103944 1080904427 /nfs/dbraw/zinc/90/44/27/1080904427.db2.gz VDZNICHWKXQUIG-UHFFFAOYSA-N 1 1 350.256 4.185 20 10 FICDMO CCSCc1noc(Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)n1 ZINC000581335829 1082471625 /nfs/dbraw/zinc/47/16/25/1082471625.db2.gz GIJNUJSSEKZOFS-UHFFFAOYSA-N 1 1 370.522 4.092 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1O ZINC000155016119 1084147808 /nfs/dbraw/zinc/14/78/08/1084147808.db2.gz LZLWHYFHQLJNNY-SVMVAKDDSA-N 1 1 368.521 4.242 20 10 FICDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001167513801 1084387966 /nfs/dbraw/zinc/38/79/66/1084387966.db2.gz XQKHDSTYBQHNCR-ZOZIMZAQSA-N 1 1 360.242 4.268 20 10 FICDMO COC1CCN(c2ccc(C[N@@H+](C)[C@H](C)Cc3cccs3)cc2)CC1 ZINC001167607856 1085583659 /nfs/dbraw/zinc/58/36/59/1085583659.db2.gz CVEVRRHDTJGEHY-QGZVFWFLSA-N 1 1 358.551 4.426 20 10 FICDMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)cs1 ZINC000162419010 1086158389 /nfs/dbraw/zinc/15/83/89/1086158389.db2.gz BKKUQCOTGXPPID-ZIAGYGMSSA-N 1 1 363.502 4.093 20 10 FICDMO COc1ccc2c(c1)CCC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C2 ZINC000728563427 1086643509 /nfs/dbraw/zinc/64/35/09/1086643509.db2.gz IXILEBLXWVQWRA-UHFFFAOYSA-N 1 1 355.478 4.352 20 10 FICDMO C[C@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000311297351 1088544305 /nfs/dbraw/zinc/54/43/05/1088544305.db2.gz FZBFYTKZLUNVDV-AWEZNQCLSA-N 1 1 366.477 4.219 20 10 FICDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000311584332 1088738400 /nfs/dbraw/zinc/73/84/00/1088738400.db2.gz XYYXDRSDVOSWAX-JQVVWYNYSA-N 1 1 351.538 4.314 20 10 FICDMO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310074563 1091011198 /nfs/dbraw/zinc/01/11/98/1091011198.db2.gz FTHXCTXGPMTUQX-HNNXBMFYSA-N 1 1 365.304 4.311 20 10 FICDMO CCO[C@@H](C[NH2+]Cc1cccc(Br)c1O)c1ccccc1 ZINC000194467950 1091384336 /nfs/dbraw/zinc/38/43/36/1091384336.db2.gz IQOHOEAIGWSDGJ-INIZCTEOSA-N 1 1 350.256 4.022 20 10 FICDMO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)cs1 ZINC000273368919 1096256616 /nfs/dbraw/zinc/25/66/16/1096256616.db2.gz CBGZECAFXZPXOO-VHSXEESVSA-N 1 1 371.300 4.169 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](c4ccc(F)cc4)C3)cc2)CC1 ZINC000828031651 1101831211 /nfs/dbraw/zinc/83/12/11/1101831211.db2.gz OVKACAODKBSKBE-FQEVSTJZSA-N 1 1 368.496 4.430 20 10 FICDMO CN(C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1)C(=O)OC(C)(C)C ZINC000729464156 1102635939 /nfs/dbraw/zinc/63/59/39/1102635939.db2.gz SCOLHRMLCRRTPJ-MRXNPFEDSA-N 1 1 370.493 4.234 20 10 FICDMO Cc1cc(C[N@H+]2CCc3nc(C4CC4)ncc3C2)c(O)c(C(C)(C)C)c1 ZINC000530102801 1106828331 /nfs/dbraw/zinc/82/83/31/1106828331.db2.gz AFTVSKSUDHEDNU-UHFFFAOYSA-N 1 1 351.494 4.224 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ncc(Cl)cc2Br)c1 ZINC000529569039 1110290084 /nfs/dbraw/zinc/29/00/84/1110290084.db2.gz IQYYTZQSRWJSEH-SECBINFHSA-N 1 1 371.662 4.063 20 10 FICDMO C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)[N@@H+](C)Cc1ccccc1O ZINC000111236266 1112890113 /nfs/dbraw/zinc/89/01/13/1112890113.db2.gz SMHJXBPKHMMDDL-HNNXBMFYSA-N 1 1 373.522 4.035 20 10 FICDMO CC(C)(C)OC(=O)NC(C)(C)C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000761183912 1115596550 /nfs/dbraw/zinc/59/65/50/1115596550.db2.gz JDTYTBYDTUJWSX-UHFFFAOYSA-N 1 1 374.481 4.291 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000761201231 1115618797 /nfs/dbraw/zinc/61/87/97/1115618797.db2.gz FKZMOTLSWWSMTM-AUUYWEPGSA-N 1 1 361.869 4.325 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000761201231 1115618798 /nfs/dbraw/zinc/61/87/98/1115618798.db2.gz FKZMOTLSWWSMTM-AUUYWEPGSA-N 1 1 361.869 4.325 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](CCc3nccs3)C(C)C)c2c1 ZINC000151533473 1116357415 /nfs/dbraw/zinc/35/74/15/1116357415.db2.gz RQOFKIFEQCQTFA-UHFFFAOYSA-N 1 1 356.491 4.464 20 10 FICDMO COc1cc(O)c(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)cc1OC ZINC000762170059 1120755301 /nfs/dbraw/zinc/75/53/01/1120755301.db2.gz DWRMCBAYUIRZCS-IBGZPJMESA-N 1 1 353.462 4.451 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915683238 1121020008 /nfs/dbraw/zinc/02/00/08/1121020008.db2.gz YZSBFLYTDHWESZ-LADGPHEKSA-N 1 1 363.549 4.430 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000915683238 1121020015 /nfs/dbraw/zinc/02/00/15/1121020015.db2.gz YZSBFLYTDHWESZ-LADGPHEKSA-N 1 1 363.549 4.430 20 10 FICDMO Cc1ccc(OCCC[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1C ZINC000917020810 1122007582 /nfs/dbraw/zinc/00/75/82/1122007582.db2.gz VGSRYRQNRKBLAS-UHFFFAOYSA-N 1 1 368.521 4.041 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccccc3OC(C)C)CC2)cc1 ZINC000917831745 1122454127 /nfs/dbraw/zinc/45/41/27/1122454127.db2.gz PVUPTUJFTNWNNY-UHFFFAOYSA-N 1 1 354.494 4.195 20 10 FICDMO Cc1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)ccc1-n1cncn1 ZINC000154718351 1122631762 /nfs/dbraw/zinc/63/17/62/1122631762.db2.gz SMUAQHDAZYVXEA-UHFFFAOYSA-N 1 1 374.444 4.077 20 10 FICDMO COc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c(OC)c1 ZINC000154728563 1122650667 /nfs/dbraw/zinc/65/06/67/1122650667.db2.gz ZQFAWAFANGDHQK-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO COc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c(OC)c1 ZINC000154728563 1122650672 /nfs/dbraw/zinc/65/06/72/1122650672.db2.gz ZQFAWAFANGDHQK-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583087 1122713477 /nfs/dbraw/zinc/71/34/77/1122713477.db2.gz VCDDJEBSDMJSOH-PMACEKPBSA-N 1 1 371.912 4.104 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]C2CCN(CC)CC2)cc1 ZINC000920956584 1123541895 /nfs/dbraw/zinc/54/18/95/1123541895.db2.gz NURPMQLSPBMTJR-UHFFFAOYSA-N 1 1 351.538 4.287 20 10 FICDMO CCc1cc(C[N@H+]2CCC[C@H](c3nc(C)no3)C2)c(O)c(C(C)(C)C)c1 ZINC000921047560 1123556917 /nfs/dbraw/zinc/55/69/17/1123556917.db2.gz ABZUJSPYHVGXFP-INIZCTEOSA-N 1 1 357.498 4.323 20 10 FICDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(Br)s2)c1O ZINC000179696114 1124027736 /nfs/dbraw/zinc/02/77/36/1124027736.db2.gz INTLFCALEDFEBM-UHFFFAOYSA-N 1 1 356.285 4.247 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(C)cc3)cc2F)CC1 ZINC000765850199 1124206839 /nfs/dbraw/zinc/20/68/39/1124206839.db2.gz SFUCTVDOOSPPLJ-GOSISDBHSA-N 1 1 355.501 4.127 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000180696609 1124409653 /nfs/dbraw/zinc/40/96/53/1124409653.db2.gz GCIZNKZLVJPHOC-APWZRJJASA-N 1 1 361.507 4.331 20 10 FICDMO Cc1cc(O)c(C[N@@H+]2CCc3c(ncn3CCc3ccccc3)C2)cc1C ZINC000182144776 1125263663 /nfs/dbraw/zinc/26/36/63/1125263663.db2.gz ZSNLWFHEXSSBFE-UHFFFAOYSA-N 1 1 361.489 4.007 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCc3c(ncn3CCc3ccccc3)C2)cc1C ZINC000182144776 1125263669 /nfs/dbraw/zinc/26/36/69/1125263669.db2.gz ZSNLWFHEXSSBFE-UHFFFAOYSA-N 1 1 361.489 4.007 20 10 FICDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183075620 1125736586 /nfs/dbraw/zinc/73/65/86/1125736586.db2.gz WKBQSQDEGAHLTN-IBGZPJMESA-N 1 1 355.478 4.220 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2Cc2nc(-c3ccco3)no2)C1 ZINC000556314467 1081287950 /nfs/dbraw/zinc/28/79/50/1081287950.db2.gz JDVVTTNAKMXAAU-UHFFFAOYSA-N 1 1 362.433 4.099 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC001167473214 1082700752 /nfs/dbraw/zinc/70/07/52/1082700752.db2.gz GKWOXCFMFCYSKQ-ATZDWAIDSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC001167473214 1082700753 /nfs/dbraw/zinc/70/07/53/1082700753.db2.gz GKWOXCFMFCYSKQ-ATZDWAIDSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC001167473214 1082700758 /nfs/dbraw/zinc/70/07/58/1082700758.db2.gz GKWOXCFMFCYSKQ-ATZDWAIDSA-N 1 1 365.901 4.274 20 10 FICDMO Fc1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)ccc1N1CCOCC1 ZINC000066970517 1086613235 /nfs/dbraw/zinc/61/32/35/1086613235.db2.gz STZKRUNYFCZYPK-JOCHJYFZSA-N 1 1 366.436 4.135 20 10 FICDMO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708555142 1087445141 /nfs/dbraw/zinc/44/51/41/1087445141.db2.gz MCFWIMJEYGJZSI-IBGZPJMESA-N 1 1 360.448 4.061 20 10 FICDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708555142 1087445144 /nfs/dbraw/zinc/44/51/44/1087445144.db2.gz MCFWIMJEYGJZSI-IBGZPJMESA-N 1 1 360.448 4.061 20 10 FICDMO [O-]c1c(Cl)cccc1C[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000311048144 1088160031 /nfs/dbraw/zinc/16/00/31/1088160031.db2.gz QDGYAOOCBXTVAT-GOSISDBHSA-N 1 1 358.913 4.438 20 10 FICDMO COc1ccc([C@H](C)[NH2+]Cc2cccc(Br)c2O)c(OC)c1 ZINC000098039183 1088751659 /nfs/dbraw/zinc/75/16/59/1088751659.db2.gz NZKSHHCZBYNDSJ-NSHDSACASA-N 1 1 366.255 4.023 20 10 FICDMO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1OC(F)F ZINC000185695978 1090566367 /nfs/dbraw/zinc/56/63/67/1090566367.db2.gz SOCDCBRBUZKJRQ-NSHDSACASA-N 1 1 355.356 4.382 20 10 FICDMO CCc1noc(-c2ccc(CC[NH2+][C@H](C)c3ccc(F)cc3O)cc2)n1 ZINC000185987245 1090597203 /nfs/dbraw/zinc/59/72/03/1090597203.db2.gz YENDAHXUIGTYSG-CYBMUJFWSA-N 1 1 355.413 4.037 20 10 FICDMO CCOc1ccc(O)c(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000364009695 1090650878 /nfs/dbraw/zinc/65/08/78/1090650878.db2.gz DXFDSLMLQFRNNE-HXUWFJFHSA-N 1 1 371.868 4.057 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000060942170 1091849299 /nfs/dbraw/zinc/84/92/99/1091849299.db2.gz BAZANZVMSMZAIC-UHFFFAOYSA-N 1 1 360.173 4.463 20 10 FICDMO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000279935162 1092654497 /nfs/dbraw/zinc/65/44/97/1092654497.db2.gz AWXAPVWEETYNDC-QUCCMNQESA-N 1 1 353.441 4.404 20 10 FICDMO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000016386702 1095576634 /nfs/dbraw/zinc/57/66/34/1095576634.db2.gz QCZIXNAFCFNRHT-LJQANCHMSA-N 1 1 365.521 4.444 20 10 FICDMO COc1cccc(CNc2cc[nH+]c3ccc(Br)cc23)c1O ZINC000301986439 1107240575 /nfs/dbraw/zinc/24/05/75/1107240575.db2.gz MLVSTGHQGGSJGE-UHFFFAOYSA-N 1 1 359.223 4.324 20 10 FICDMO COc1ccc(C(C)(C)[NH2+]Cc2cccc(Br)c2O)cc1F ZINC000527780077 1109822803 /nfs/dbraw/zinc/82/28/03/1109822803.db2.gz BOKVMCSIDVPMAC-UHFFFAOYSA-N 1 1 368.246 4.327 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(Cl)cc2Br)c1 ZINC000529569040 1110290030 /nfs/dbraw/zinc/29/00/30/1110290030.db2.gz IQYYTZQSRWJSEH-VIFPVBQESA-N 1 1 371.662 4.063 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1O ZINC000761193960 1115613171 /nfs/dbraw/zinc/61/31/71/1115613171.db2.gz LMXBYHPVUKKNCS-HNNXBMFYSA-N 1 1 361.825 4.120 20 10 FICDMO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Br)cc(F)c1O ZINC001235069158 1120902386 /nfs/dbraw/zinc/90/23/86/1120902386.db2.gz PUKMQSMXZBZHRL-UHFFFAOYSA-N 1 1 356.210 4.455 20 10 FICDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(Br)cc(F)c1O ZINC001235069158 1120902388 /nfs/dbraw/zinc/90/23/88/1120902388.db2.gz PUKMQSMXZBZHRL-UHFFFAOYSA-N 1 1 356.210 4.455 20 10 FICDMO CC(C)c1ccc(C[C@@H]2CC[N@@H+](Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 ZINC000763392399 1121574764 /nfs/dbraw/zinc/57/47/64/1121574764.db2.gz HLDKWDUXMLCIEJ-HTAPYJJXSA-N 1 1 367.489 4.006 20 10 FICDMO CCN(CC)c1ccc(C[NH2+]Cc2nn(-c3ccccc3)c3c2CCC3)cc1 ZINC000916838509 1121881265 /nfs/dbraw/zinc/88/12/65/1121881265.db2.gz RQMCWFWGSXASOJ-UHFFFAOYSA-N 1 1 374.532 4.497 20 10 FICDMO Oc1ccc2ccccc2c1C[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000917451797 1122318785 /nfs/dbraw/zinc/31/87/85/1122318785.db2.gz LWVLVMDGJKALBS-UHFFFAOYSA-N 1 1 355.441 4.289 20 10 FICDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1Cc1c(F)cccc1Cl)OCO2 ZINC000917474254 1122322029 /nfs/dbraw/zinc/32/20/29/1122322029.db2.gz XVDQMRPDHAZJEX-ZDUSSCGKSA-N 1 1 363.816 4.121 20 10 FICDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000919952471 1123280163 /nfs/dbraw/zinc/28/01/63/1123280163.db2.gz WCJMKANUIDTWOV-HXUWFJFHSA-N 1 1 362.429 4.064 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)c1 ZINC000182345215 1125426073 /nfs/dbraw/zinc/42/60/73/1125426073.db2.gz QTUAUDLLFWSRTH-QWHCGFSZSA-N 1 1 371.412 4.310 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000183028676 1125722453 /nfs/dbraw/zinc/72/24/53/1125722453.db2.gz JQWFRKPYGDQATN-HXUWFJFHSA-N 1 1 363.461 4.422 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000183028676 1125722460 /nfs/dbraw/zinc/72/24/60/1125722460.db2.gz JQWFRKPYGDQATN-HXUWFJFHSA-N 1 1 363.461 4.422 20 10 FICDMO CCOc1cccc(Cl)c1C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC001167108066 1080552024 /nfs/dbraw/zinc/55/20/24/1080552024.db2.gz MGUGHFRELMOYFQ-UHFFFAOYSA-N 1 1 374.912 4.460 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1O ZINC001167107622 1080552467 /nfs/dbraw/zinc/55/24/67/1080552467.db2.gz FMZXKTAMVXLHKG-UHFFFAOYSA-N 1 1 372.896 4.479 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@]2(N(C)C)CCC[C@H](C)C2)c1 ZINC001648895200 1081352856 /nfs/dbraw/zinc/35/28/56/1081352856.db2.gz FYONUMSMIMQWJN-UGSOOPFHSA-N 1 1 369.347 4.063 20 10 FICDMO Oc1ccccc1C[N@H+](C[C@H](O)Cc1cccc(Cl)c1)C1CCCC1 ZINC001167353147 1081592351 /nfs/dbraw/zinc/59/23/51/1081592351.db2.gz FZLQTQZGHSLEAA-HXUWFJFHSA-N 1 1 359.897 4.394 20 10 FICDMO Cc1c(O)ccc(C[N@H+](C)[C@@H](C)c2cccc(Br)c2)c1O ZINC001140749776 1083906189 /nfs/dbraw/zinc/90/61/89/1083906189.db2.gz MKWWPZKUQNETQY-LBPRGKRZSA-N 1 1 350.256 4.362 20 10 FICDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000048796508 1085005982 /nfs/dbraw/zinc/00/59/82/1085005982.db2.gz DPVFVEMJBGZYCV-SNVBAGLBSA-N 1 1 354.219 4.153 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc(C(F)(F)F)c1 ZINC001143519912 1085939649 /nfs/dbraw/zinc/93/96/49/1085939649.db2.gz ZEXNHXDBDWKLCU-UHFFFAOYSA-N 1 1 352.400 4.412 20 10 FICDMO C[N@H+](CC(=O)Nc1cc(F)ccc1F)Cc1ccc(N2CCCCC2)cc1 ZINC000052686765 1087044341 /nfs/dbraw/zinc/04/43/41/1087044341.db2.gz LNLOZEHHADXTGF-UHFFFAOYSA-N 1 1 373.447 4.026 20 10 FICDMO C[N@@H+](CC(=O)Nc1cc(F)ccc1F)Cc1ccc(N2CCCCC2)cc1 ZINC000052686765 1087044352 /nfs/dbraw/zinc/04/43/52/1087044352.db2.gz LNLOZEHHADXTGF-UHFFFAOYSA-N 1 1 373.447 4.026 20 10 FICDMO CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708559776 1087443173 /nfs/dbraw/zinc/44/31/73/1087443173.db2.gz UQSLZPZJNWQNJH-LJQANCHMSA-N 1 1 372.456 4.090 20 10 FICDMO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000179946607 1090135695 /nfs/dbraw/zinc/13/56/95/1090135695.db2.gz UWZCOPGXTWKBCS-LJQANCHMSA-N 1 1 351.450 4.108 20 10 FICDMO Cc1cccc(C[NH2+]Cc2ccccc2CN(C)Cc2ccco2)c1O ZINC000182421486 1090352186 /nfs/dbraw/zinc/35/21/86/1090352186.db2.gz PAQGCOSKVJIBRY-UHFFFAOYSA-N 1 1 350.462 4.215 20 10 FICDMO CCOc1ccc(C2(C[NH2+][C@H](C)c3ccc(F)cc3O)CCOCC2)cc1 ZINC000185126946 1090511195 /nfs/dbraw/zinc/51/11/95/1090511195.db2.gz LLPOBZIDXSASOE-MRXNPFEDSA-N 1 1 373.468 4.329 20 10 FICDMO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000279935166 1092654131 /nfs/dbraw/zinc/65/41/31/1092654131.db2.gz AWXAPVWEETYNDC-UYAOXDASSA-N 1 1 353.441 4.404 20 10 FICDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000728979350 1093911134 /nfs/dbraw/zinc/91/11/34/1093911134.db2.gz UYISYAGATSNYAZ-INIZCTEOSA-N 1 1 370.493 4.124 20 10 FICDMO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c(O)c1C ZINC000273378297 1096256637 /nfs/dbraw/zinc/25/66/37/1096256637.db2.gz HRTOZKJHOHDRJW-DNVCBOLYSA-N 1 1 353.441 4.322 20 10 FICDMO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Br)cc2O)cs1 ZINC000273595062 1096276774 /nfs/dbraw/zinc/27/67/74/1096276774.db2.gz QFFIFZAOOKYDDX-NXEZZACHSA-N 1 1 371.300 4.169 20 10 FICDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccccc2OC(F)(F)F)c1O ZINC000219095721 1101366039 /nfs/dbraw/zinc/36/60/39/1101366039.db2.gz XGGIRPSDJLNKHH-UHFFFAOYSA-N 1 1 355.356 4.240 20 10 FICDMO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccn1 ZINC000186193480 1101757421 /nfs/dbraw/zinc/75/74/21/1101757421.db2.gz ZTENJZSYVUHQDV-QKKBWIMNSA-N 1 1 352.409 4.375 20 10 FICDMO [O-]c1cc(F)c(F)cc1C[N@@H+]1C[C@H]2c3ccccc3[C@@H](OCC3CC3)[C@H]2C1 ZINC001142520185 1102138034 /nfs/dbraw/zinc/13/80/34/1102138034.db2.gz CXWVOKZCJCMTCS-NPPFBWRTSA-N 1 1 371.427 4.367 20 10 FICDMO Oc1cc(F)c(F)cc1C[N@H+]1C[C@H]2c3ccccc3[C@@H](OCC3CC3)[C@H]2C1 ZINC001142520185 1102138041 /nfs/dbraw/zinc/13/80/41/1102138041.db2.gz CXWVOKZCJCMTCS-NPPFBWRTSA-N 1 1 371.427 4.367 20 10 FICDMO Oc1cc(F)c(F)cc1C[N@@H+]1C[C@H]2c3ccccc3[C@@H](OCC3CC3)[C@H]2C1 ZINC001142520185 1102138049 /nfs/dbraw/zinc/13/80/49/1102138049.db2.gz CXWVOKZCJCMTCS-NPPFBWRTSA-N 1 1 371.427 4.367 20 10 FICDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000783596610 1107693464 /nfs/dbraw/zinc/69/34/64/1107693464.db2.gz YYGAJCLOCDJXRK-NSHDSACASA-N 1 1 359.779 4.098 20 10 FICDMO COc1ccc2ccc(O)c(C[N@H+]3CCc4nc(C(C)C)ncc4C3)c2c1 ZINC000527612566 1109787425 /nfs/dbraw/zinc/78/74/25/1109787425.db2.gz ISAVRXVNUMHQOP-UHFFFAOYSA-N 1 1 363.461 4.026 20 10 FICDMO C[C@@H]([NH2+]C[C@@H]1c2ccccc2C(=O)N1C)c1cc(Cl)c(Cl)cc1O ZINC000528005802 1109883103 /nfs/dbraw/zinc/88/31/03/1109883103.db2.gz VLKKDVOCLGYQCM-QLJPJBMISA-N 1 1 365.260 4.177 20 10 FICDMO N#Cc1ccc2ncc(C[N@H+](Cc3ccccc3O)C3CCCCC3)n2c1 ZINC000156779067 1114562142 /nfs/dbraw/zinc/56/21/42/1114562142.db2.gz XFVVSMPBDULWEX-UHFFFAOYSA-N 1 1 360.461 4.246 20 10 FICDMO C[C@H](O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880905 1115120913 /nfs/dbraw/zinc/12/09/13/1115120913.db2.gz ZMGLDAFLGJPMHP-DLBZAZTESA-N 1 1 366.465 4.133 20 10 FICDMO C[C@H](O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880905 1115120917 /nfs/dbraw/zinc/12/09/17/1115120917.db2.gz ZMGLDAFLGJPMHP-DLBZAZTESA-N 1 1 366.465 4.133 20 10 FICDMO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1O ZINC000761194745 1115613132 /nfs/dbraw/zinc/61/31/32/1115613132.db2.gz HGYFTTUILYAOAG-GOSISDBHSA-N 1 1 361.869 4.235 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1O ZINC000761201235 1115618723 /nfs/dbraw/zinc/61/87/23/1115618723.db2.gz FKZMOTLSWWSMTM-IFXJQAMLSA-N 1 1 361.869 4.325 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1O ZINC000761201235 1115618725 /nfs/dbraw/zinc/61/87/25/1115618725.db2.gz FKZMOTLSWWSMTM-IFXJQAMLSA-N 1 1 361.869 4.325 20 10 FICDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000761295612 1115769142 /nfs/dbraw/zinc/76/91/42/1115769142.db2.gz ZDQSAUWHGHHUPZ-INIZCTEOSA-N 1 1 350.462 4.260 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cncc(Br)c1 ZINC000171934229 1115890484 /nfs/dbraw/zinc/89/04/84/1115890484.db2.gz FVQQSVVVIHWPSO-UHFFFAOYSA-N 1 1 373.250 4.345 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cncc(Br)c1 ZINC000171934229 1115890487 /nfs/dbraw/zinc/89/04/87/1115890487.db2.gz FVQQSVVVIHWPSO-UHFFFAOYSA-N 1 1 373.250 4.345 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1cncc(Br)c1)C1CCCC1 ZINC000171943289 1115894201 /nfs/dbraw/zinc/89/42/01/1115894201.db2.gz PAFZXJIHOBVJMM-UHFFFAOYSA-N 1 1 361.283 4.495 20 10 FICDMO COc1ccc2ccc([O-])c(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)c2c1 ZINC000153467257 1120789547 /nfs/dbraw/zinc/78/95/47/1120789547.db2.gz UMJQSECMOUBEBB-GOSISDBHSA-N 1 1 354.494 4.004 20 10 FICDMO COc1ccc2ccc([O-])c(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)c2c1 ZINC000153467257 1120789556 /nfs/dbraw/zinc/78/95/56/1120789556.db2.gz UMJQSECMOUBEBB-GOSISDBHSA-N 1 1 354.494 4.004 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc(OC)c(OC)c2)c(O)c(C(C)(C)C)c1 ZINC000915818249 1121082801 /nfs/dbraw/zinc/08/28/01/1121082801.db2.gz WAKQSOVMAQUMEY-UHFFFAOYSA-N 1 1 373.493 4.348 20 10 FICDMO C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000763217058 1121297006 /nfs/dbraw/zinc/29/70/06/1121297006.db2.gz QWXKUTFXBSIDCC-SFHVURJKSA-N 1 1 367.537 4.417 20 10 FICDMO C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000763217058 1121297011 /nfs/dbraw/zinc/29/70/11/1121297011.db2.gz QWXKUTFXBSIDCC-SFHVURJKSA-N 1 1 367.537 4.417 20 10 FICDMO CC(C)c1ccc(C[C@@H]2CC[N@@H+](Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 ZINC000763392403 1121575570 /nfs/dbraw/zinc/57/55/70/1121575570.db2.gz HLDKWDUXMLCIEJ-JTSKRJEESA-N 1 1 367.489 4.006 20 10 FICDMO CC(C)(C)OC(=O)NC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000139961000 1121586047 /nfs/dbraw/zinc/58/60/47/1121586047.db2.gz FDLQKRMUCADQIR-INIZCTEOSA-N 1 1 370.493 4.282 20 10 FICDMO FC(F)(F)CO[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000916836699 1121877720 /nfs/dbraw/zinc/87/77/20/1121877720.db2.gz KJSSRVVOUCPMRS-GOSISDBHSA-N 1 1 356.432 4.220 20 10 FICDMO COc1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-] ZINC000917019885 1122008133 /nfs/dbraw/zinc/00/81/33/1122008133.db2.gz LCRJPZFILDOCBS-UHFFFAOYSA-N 1 1 369.465 4.226 20 10 FICDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000917075451 1122070319 /nfs/dbraw/zinc/07/03/19/1122070319.db2.gz VZQOKYOACHKQKU-UHFFFAOYSA-N 1 1 357.454 4.080 20 10 FICDMO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)c2nnc3n2CCCCC3)cc1 ZINC000920177975 1123404914 /nfs/dbraw/zinc/40/49/14/1123404914.db2.gz SHKCRBFDAHKWFM-SFHVURJKSA-N 1 1 369.557 4.482 20 10 FICDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cn2cccnc2n1)Cc1ccccc1O ZINC000179645525 1124020510 /nfs/dbraw/zinc/02/05/10/1124020510.db2.gz NHTUGKZQACUMKS-KRWDZBQOSA-N 1 1 358.445 4.198 20 10 FICDMO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000238033316 1124251319 /nfs/dbraw/zinc/25/13/19/1124251319.db2.gz NLAQKFVLLPVCJK-UHFFFAOYSA-N 1 1 365.304 4.453 20 10 FICDMO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@H](O)c2cccs2)c1 ZINC000180648791 1124381283 /nfs/dbraw/zinc/38/12/83/1124381283.db2.gz HVDHCELLMHBHHQ-FQEVSTJZSA-N 1 1 369.486 4.198 20 10 FICDMO COc1ccc(N2CCC[N@H+]([C@@H](C)c3nc4ccccc4o3)CC2)cc1 ZINC000180999332 1124508270 /nfs/dbraw/zinc/50/82/70/1124508270.db2.gz XBTKBOVLRJFTSR-INIZCTEOSA-N 1 1 351.450 4.110 20 10 FICDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275324124 1080766425 /nfs/dbraw/zinc/76/64/25/1080766425.db2.gz LLVORQDPUQHWOZ-RKDXNWHRSA-N 1 1 356.289 4.035 20 10 FICDMO CC(C)N(CC1CC1)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000683440737 1080984650 /nfs/dbraw/zinc/98/46/50/1080984650.db2.gz JFQNATDODUNFPX-UHFFFAOYSA-N 1 1 367.537 4.055 20 10 FICDMO CCN(C)c1ccc(CN2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001167346413 1081542434 /nfs/dbraw/zinc/54/24/34/1081542434.db2.gz ACZPKPSAHFZMBI-UHFFFAOYSA-N 1 1 351.538 4.239 20 10 FICDMO CCN(C)c1ccc(C[N@@H+]2CCN(Cc3ccccc3)C(C)(C)C2)cc1 ZINC001167346413 1081542437 /nfs/dbraw/zinc/54/24/37/1081542437.db2.gz ACZPKPSAHFZMBI-UHFFFAOYSA-N 1 1 351.538 4.239 20 10 FICDMO CCN(C)c1ccc(C[N@H+]2CCN(Cc3ccccc3)C(C)(C)C2)cc1 ZINC001167346413 1081542442 /nfs/dbraw/zinc/54/24/42/1081542442.db2.gz ACZPKPSAHFZMBI-UHFFFAOYSA-N 1 1 351.538 4.239 20 10 FICDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469548 1082655076 /nfs/dbraw/zinc/65/50/76/1082655076.db2.gz ZGEKEZRRTKRIPZ-PZJWPPBQSA-N 1 1 350.506 4.210 20 10 FICDMO O=C(C[N@H+]1CC[C@]2(CCOC2)C1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255343735 1082762990 /nfs/dbraw/zinc/76/29/90/1082762990.db2.gz KUKXPWWZKGMCBC-NRFANRHFSA-N 1 1 364.449 4.153 20 10 FICDMO Cc1cc(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)c(O)c(C(C)(C)C)c1 ZINC000176117783 1083488679 /nfs/dbraw/zinc/48/86/79/1083488679.db2.gz NYLCWJWQAKBXIC-VWLOTQADSA-N 1 1 359.535 4.368 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc(Br)ccn1 ZINC001140766016 1084213101 /nfs/dbraw/zinc/21/31/01/1084213101.db2.gz UVDOOKUQBCFJGZ-UHFFFAOYSA-N 1 1 360.299 4.076 20 10 FICDMO Cc1ccc(C(=O)Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)c(O)c1O ZINC000177673265 1084221770 /nfs/dbraw/zinc/22/17/70/1084221770.db2.gz VFOBVLACROMWQC-UHFFFAOYSA-N 1 1 365.433 4.027 20 10 FICDMO C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355767 1088588015 /nfs/dbraw/zinc/58/80/15/1088588015.db2.gz CSUKTBGASJQXHZ-PZJWPPBQSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355767 1088588028 /nfs/dbraw/zinc/58/80/28/1088588028.db2.gz CSUKTBGASJQXHZ-PZJWPPBQSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355765 1088589404 /nfs/dbraw/zinc/58/94/04/1088589404.db2.gz CSUKTBGASJQXHZ-CTNGQTDRSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000311355765 1088589416 /nfs/dbraw/zinc/58/94/16/1088589416.db2.gz CSUKTBGASJQXHZ-CTNGQTDRSA-N 1 1 351.538 4.315 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2c1[O-] ZINC000185055051 1090500431 /nfs/dbraw/zinc/50/04/31/1090500431.db2.gz SORRPDQUVAFYAJ-QGZVFWFLSA-N 1 1 364.489 4.337 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCS[C@@H]4CCCC[C@H]43)cc2)CC1 ZINC000828025106 1091021377 /nfs/dbraw/zinc/02/13/77/1091021377.db2.gz DKSHYEYCVDBZQS-NHCUHLMSSA-N 1 1 360.567 4.162 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cn3c4ccccc4oc3=S)CC2)cc1 ZINC000108219657 1093706731 /nfs/dbraw/zinc/70/67/31/1093706731.db2.gz JNQZHEYSJHCGTA-UHFFFAOYSA-N 1 1 369.490 4.142 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000896599351 1094802230 /nfs/dbraw/zinc/80/22/30/1094802230.db2.gz PZLVDAOQIPFQSM-OAQYLSRUSA-N 1 1 361.445 4.002 20 10 FICDMO Cc1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000016386704 1095577557 /nfs/dbraw/zinc/57/75/57/1095577557.db2.gz QCZIXNAFCFNRHT-IBGZPJMESA-N 1 1 365.521 4.444 20 10 FICDMO [O-]c1c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc(Cl)c2cccnc12 ZINC001167965395 1101842249 /nfs/dbraw/zinc/84/22/49/1101842249.db2.gz DVNMWCNVAXADTE-ALOPSCKCSA-N 1 1 371.912 4.089 20 10 FICDMO CCN(CC)c1ccc(CN(C)C(=O)[C@@H](c2ccccc2)[N@@H+](C)CC)cc1 ZINC000729512910 1105025166 /nfs/dbraw/zinc/02/51/66/1105025166.db2.gz WMWOOXLGGTVCJQ-JOCHJYFZSA-N 1 1 367.537 4.184 20 10 FICDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000783596607 1107693676 /nfs/dbraw/zinc/69/36/76/1107693676.db2.gz YYGAJCLOCDJXRK-LLVKDONJSA-N 1 1 359.779 4.098 20 10 FICDMO COCCC1CC[NH+]([C@H](C)c2cc(Br)c(F)cc2O)CC1 ZINC000527931546 1109869670 /nfs/dbraw/zinc/86/96/70/1109869670.db2.gz BPSPHOJIEQEHBN-LLVKDONJSA-N 1 1 360.267 4.103 20 10 FICDMO Cc1cc(C)c(O)c(C[N@H+]2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c1 ZINC000164201799 1114443645 /nfs/dbraw/zinc/44/36/45/1114443645.db2.gz PNMJKDJELJMLOE-UHFFFAOYSA-N 1 1 372.896 4.011 20 10 FICDMO COCC1([N@H+](C)CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000761102951 1115522177 /nfs/dbraw/zinc/52/21/77/1115522177.db2.gz TWUWLPVTDRMXOJ-UHFFFAOYSA-N 1 1 352.438 4.151 20 10 FICDMO COCC1([N@@H+](C)CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000761102951 1115522181 /nfs/dbraw/zinc/52/21/81/1115522181.db2.gz TWUWLPVTDRMXOJ-UHFFFAOYSA-N 1 1 352.438 4.151 20 10 FICDMO CC[C@](C)([NH2+]Cc1cccc(Br)c1O)c1nc(C)cs1 ZINC000174502064 1116137651 /nfs/dbraw/zinc/13/76/51/1116137651.db2.gz YCEBIAGBOHGKKC-HNNXBMFYSA-N 1 1 355.301 4.335 20 10 FICDMO CCOc1ccc(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c(O)c1 ZINC000762554797 1120929826 /nfs/dbraw/zinc/92/98/26/1120929826.db2.gz HBWGMJFRFSGLSS-HXUWFJFHSA-N 1 1 371.868 4.057 20 10 FICDMO CCOc1ccc(C[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c(O)c1 ZINC000762554796 1120929964 /nfs/dbraw/zinc/92/99/64/1120929964.db2.gz HBWGMJFRFSGLSS-FQEVSTJZSA-N 1 1 371.868 4.057 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)ccc1OC(F)F ZINC000915818891 1121086234 /nfs/dbraw/zinc/08/62/34/1121086234.db2.gz DFKZKXFATAKXHP-UHFFFAOYSA-N 1 1 351.393 4.251 20 10 FICDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1c(O)ccc3ccncc31)CCC2 ZINC000763218698 1121292531 /nfs/dbraw/zinc/29/25/31/1121292531.db2.gz GZAUZMZTJAZLOK-QGZVFWFLSA-N 1 1 353.491 4.469 20 10 FICDMO Cc1c(Cl)cccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074815 1122068282 /nfs/dbraw/zinc/06/82/82/1122068282.db2.gz GWPBSYCVOPIKRZ-UHFFFAOYSA-N 1 1 371.912 4.318 20 10 FICDMO Cc1c(Cl)cccc1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074815 1122068287 /nfs/dbraw/zinc/06/82/87/1122068287.db2.gz GWPBSYCVOPIKRZ-UHFFFAOYSA-N 1 1 371.912 4.318 20 10 FICDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(F)c1 ZINC000917074802 1122068843 /nfs/dbraw/zinc/06/88/43/1122068843.db2.gz GKARWQDTRCZKRW-UHFFFAOYSA-N 1 1 357.473 4.049 20 10 FICDMO CC(C)[N@H+](Cc1nc(-c2ccsc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917075398 1122070083 /nfs/dbraw/zinc/07/00/83/1122070083.db2.gz VJSCTHVKAXURON-UHFFFAOYSA-N 1 1 356.495 4.275 20 10 FICDMO CC(C)[N@@H+](Cc1nc(-c2ccsc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917075398 1122070094 /nfs/dbraw/zinc/07/00/94/1122070094.db2.gz VJSCTHVKAXURON-UHFFFAOYSA-N 1 1 356.495 4.275 20 10 FICDMO Fc1cc(CNc2cc[nH+]c3cc(Cl)ccc23)ccc1N1CCOCC1 ZINC000917086603 1122111215 /nfs/dbraw/zinc/11/12/15/1122111215.db2.gz FSJQOFDPXSKXTE-UHFFFAOYSA-N 1 1 371.843 4.476 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCOc3ccccc3OC)c2c1 ZINC000917486107 1122328142 /nfs/dbraw/zinc/32/81/42/1122328142.db2.gz CJDUDVANUAVFNU-UHFFFAOYSA-N 1 1 367.445 4.073 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(C)ccc43)cc2F)CC1 ZINC000765852613 1124215385 /nfs/dbraw/zinc/21/53/85/1124215385.db2.gz NWNWVFHTVSMTDS-JOCHJYFZSA-N 1 1 367.512 4.053 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc3sc(C)c(C)c3c(N)n2)c1 ZINC000182472440 1125518491 /nfs/dbraw/zinc/51/84/91/1125518491.db2.gz JPOLVROUVALZQX-MNOVXSKESA-N 1 1 372.494 4.016 20 10 FICDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(Br)s2)c1O ZINC000120417233 1080042405 /nfs/dbraw/zinc/04/24/05/1080042405.db2.gz NOXYYTSZTZYYTC-UHFFFAOYSA-N 1 1 356.285 4.165 20 10 FICDMO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1Br ZINC001140103945 1080904602 /nfs/dbraw/zinc/90/46/02/1080904602.db2.gz VFLRGMXYJKRXBL-UHFFFAOYSA-N 1 1 350.256 4.185 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1O ZINC001167353218 1081592413 /nfs/dbraw/zinc/59/24/13/1081592413.db2.gz GZRXVSXVGMZVOI-UHFFFAOYSA-N 1 1 359.853 4.366 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[N@H+](Cc2cccc(O)c2)CC2CC2)c1O ZINC001167353218 1081592418 /nfs/dbraw/zinc/59/24/18/1081592418.db2.gz GZRXVSXVGMZVOI-UHFFFAOYSA-N 1 1 359.853 4.366 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC001167473217 1082700971 /nfs/dbraw/zinc/70/09/71/1082700971.db2.gz GKWOXCFMFCYSKQ-LZQZEXGQSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC001167473217 1082700973 /nfs/dbraw/zinc/70/09/73/1082700973.db2.gz GKWOXCFMFCYSKQ-LZQZEXGQSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC001167473217 1082700980 /nfs/dbraw/zinc/70/09/80/1082700980.db2.gz GKWOXCFMFCYSKQ-LZQZEXGQSA-N 1 1 365.901 4.274 20 10 FICDMO Cc1cc(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)c(O)c(C(C)(C)C)c1 ZINC000176117797 1083301353 /nfs/dbraw/zinc/30/13/53/1083301353.db2.gz NYLCWJWQAKBXIC-RUZDIDTESA-N 1 1 359.535 4.368 20 10 FICDMO CCOC[C@H]1CC[N@@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000177634952 1084183882 /nfs/dbraw/zinc/18/38/82/1084183882.db2.gz SVUKXZLBDRVQIT-ZDUSSCGKSA-N 1 1 364.283 4.166 20 10 FICDMO CCOC[C@@H]1CC[N@@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000177634937 1084184231 /nfs/dbraw/zinc/18/42/31/1084184231.db2.gz SVUKXZLBDRVQIT-CYBMUJFWSA-N 1 1 364.283 4.166 20 10 FICDMO CC[C@@H](c1ccccc1)[NH+]1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC001167508932 1084311147 /nfs/dbraw/zinc/31/11/47/1084311147.db2.gz JXZSPZYTGMFMNK-NRFANRHFSA-N 1 1 370.468 4.003 20 10 FICDMO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278985278 1086742077 /nfs/dbraw/zinc/74/20/77/1086742077.db2.gz IVNXJKOHYUDBKC-ZETCQYMHSA-N 1 1 366.792 4.380 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2Cc2nc(C3CCC3)no2)C1 ZINC000685241917 1087071271 /nfs/dbraw/zinc/07/12/71/1087071271.db2.gz CLVYZPOWESSXLT-UHFFFAOYSA-N 1 1 350.466 4.107 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@@H](C)CC[C@H]2C)C1 ZINC001126429930 1089140070 /nfs/dbraw/zinc/14/00/70/1089140070.db2.gz YJZBCYDYCJSOAB-ZWKOTPCHSA-N 1 1 367.537 4.055 20 10 FICDMO C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2c1[O-] ZINC000185055035 1090500408 /nfs/dbraw/zinc/50/04/08/1090500408.db2.gz SORRPDQUVAFYAJ-KRWDZBQOSA-N 1 1 364.489 4.337 20 10 FICDMO Oc1cc2c(cc1C[NH2+]C1(c3c(Cl)cccc3Cl)CC1)OCO2 ZINC000759829379 1091247878 /nfs/dbraw/zinc/24/78/78/1091247878.db2.gz SHMUEVJCQZDGOT-UHFFFAOYSA-N 1 1 352.217 4.207 20 10 FICDMO C[N@@H+](Cc1ccccc1NC(=O)Cc1ccc(N)cc1)C1CCCCC1 ZINC000237167091 1092466541 /nfs/dbraw/zinc/46/65/41/1092466541.db2.gz UGHWQEIABGEMRQ-UHFFFAOYSA-N 1 1 351.494 4.215 20 10 FICDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@H](C)N1Cc1ccccc1 ZINC001168025241 1093417730 /nfs/dbraw/zinc/41/77/30/1093417730.db2.gz JDZHRGYOZFBIQG-HATOLVCRSA-N 1 1 351.538 4.284 20 10 FICDMO C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025241 1093417735 /nfs/dbraw/zinc/41/77/35/1093417735.db2.gz JDZHRGYOZFBIQG-HATOLVCRSA-N 1 1 351.538 4.284 20 10 FICDMO C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168025241 1093417738 /nfs/dbraw/zinc/41/77/38/1093417738.db2.gz JDZHRGYOZFBIQG-HATOLVCRSA-N 1 1 351.538 4.284 20 10 FICDMO CN(C)c1ccc(C[N@H+](C)Cc2cc(Br)cc(F)c2F)cc1 ZINC001141805641 1093527001 /nfs/dbraw/zinc/52/70/01/1093527001.db2.gz WMCSTLLFWARQKN-UHFFFAOYSA-N 1 1 369.253 4.425 20 10 FICDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(Br)cc(F)c2F)cc1 ZINC001141805641 1093527006 /nfs/dbraw/zinc/52/70/06/1093527006.db2.gz WMCSTLLFWARQKN-UHFFFAOYSA-N 1 1 369.253 4.425 20 10 FICDMO C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1c(O)cccc1F ZINC000896636581 1094869090 /nfs/dbraw/zinc/86/90/90/1094869090.db2.gz GAIIGNYJDYXNHV-LLVKDONJSA-N 1 1 370.346 4.057 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccc4nc(C)ccc4c3)CC2)cc1 ZINC000783547313 1095649269 /nfs/dbraw/zinc/64/92/69/1095649269.db2.gz RMKFBFUOKMQEDO-UHFFFAOYSA-N 1 1 361.489 4.264 20 10 FICDMO C[C@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cc2n(n1)CCC2 ZINC000840719674 1095667439 /nfs/dbraw/zinc/66/74/39/1095667439.db2.gz IGOYSBZHHQOEIU-KRWDZBQOSA-N 1 1 352.526 4.449 20 10 FICDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ncc(Br)s1 ZINC000179219975 1099465494 /nfs/dbraw/zinc/46/54/94/1099465494.db2.gz CMFQYLYGTCCNEZ-NSHDSACASA-N 1 1 366.328 4.139 20 10 FICDMO C[C@@H]([NH2+]Cc1cccnc1-n1ccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192654498 1101966971 /nfs/dbraw/zinc/96/69/71/1101966971.db2.gz QPXPGGUQZQTTEE-LLVKDONJSA-N 1 1 363.248 4.131 20 10 FICDMO CCC[N@H+](Cc1cc(F)c(F)cc1O)[C@@H](C)C(=O)Nc1ccccc1C ZINC001142527115 1102157075 /nfs/dbraw/zinc/15/70/75/1102157075.db2.gz LDILBSKJRNEXTJ-AWEZNQCLSA-N 1 1 362.420 4.218 20 10 FICDMO CCC[N@@H+](Cc1cc(F)c(F)cc1O)[C@@H](C)C(=O)Nc1ccccc1C ZINC001142527115 1102157084 /nfs/dbraw/zinc/15/70/84/1102157084.db2.gz LDILBSKJRNEXTJ-AWEZNQCLSA-N 1 1 362.420 4.218 20 10 FICDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2nc(-c3ccc(Cl)cc3)no2)c1O ZINC000894542918 1102551606 /nfs/dbraw/zinc/55/16/06/1102551606.db2.gz MCWGNUHZNMLQMJ-LBPRGKRZSA-N 1 1 373.840 4.263 20 10 FICDMO Cc1cc(Cl)ccc1C1=CC[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)CC1 ZINC000530107530 1106829805 /nfs/dbraw/zinc/82/98/05/1106829805.db2.gz ZIFPHGJEJZUXDX-FQEVSTJZSA-N 1 1 371.864 4.069 20 10 FICDMO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1nnn(-c2ccccc2)c1C ZINC000479441765 1112023863 /nfs/dbraw/zinc/02/38/63/1112023863.db2.gz ZSQHYPPSPUHDSC-MRXNPFEDSA-N 1 1 359.477 4.227 20 10 FICDMO CC[N@@H+](Cc1ccc(OC)cc1OC)Cc1cc(Cl)cc(OC)c1O ZINC000761191749 1115614310 /nfs/dbraw/zinc/61/43/10/1115614310.db2.gz AJYWXRPLGYNMBG-UHFFFAOYSA-N 1 1 365.857 4.094 20 10 FICDMO Cc1csc(C2([NH2+]Cc3cccc(Br)c3O)CCCC2)n1 ZINC000171842497 1115877950 /nfs/dbraw/zinc/87/79/50/1115877950.db2.gz WVMYWWUGINQQKR-UHFFFAOYSA-N 1 1 367.312 4.479 20 10 FICDMO C[N@@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccc(N2CCOCC2)cc1 ZINC000762956245 1121043933 /nfs/dbraw/zinc/04/39/33/1121043933.db2.gz XURVSJFLAJBFIN-UHFFFAOYSA-N 1 1 370.440 4.236 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)C(C)(C)C)C1 ZINC001626060313 1121266240 /nfs/dbraw/zinc/26/62/40/1121266240.db2.gz SRYOQQFCLOCVGW-KRWDZBQOSA-N 1 1 369.553 4.206 20 10 FICDMO CN(C)c1ccc(C[N@H+](Cc2nc(-c3ccsc3)no2)C2CC2)cc1 ZINC000917073824 1122066638 /nfs/dbraw/zinc/06/66/38/1122066638.db2.gz BXFANXXSWRXYFO-UHFFFAOYSA-N 1 1 354.479 4.029 20 10 FICDMO CN(C)c1ccc(C[N@@H+](Cc2nc(-c3ccsc3)no2)C2CC2)cc1 ZINC000917073824 1122066644 /nfs/dbraw/zinc/06/66/44/1122066644.db2.gz BXFANXXSWRXYFO-UHFFFAOYSA-N 1 1 354.479 4.029 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601894 1122723234 /nfs/dbraw/zinc/72/32/34/1122723234.db2.gz LLDUUOVYSBMEMI-HKUYNNGSSA-N 1 1 371.912 4.104 20 10 FICDMO CC(C)[N@@H+](Cc1csc(-c2cnn(C)c2)n1)Cc1ccc(N(C)C)cc1 ZINC000919648413 1123069591 /nfs/dbraw/zinc/06/95/91/1123069591.db2.gz PYDFQYZKEOKCIO-UHFFFAOYSA-N 1 1 369.538 4.020 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984912 1123300051 /nfs/dbraw/zinc/30/00/51/1123300051.db2.gz WGRCOWZFXGFCAD-MSOLQXFVSA-N 1 1 371.912 4.104 20 10 FICDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057444 1123558623 /nfs/dbraw/zinc/55/86/23/1123558623.db2.gz WOBKMSXDZWINQS-ZWKOTPCHSA-N 1 1 360.542 4.341 20 10 FICDMO CC[N@@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cccc(C)c1O ZINC000179565285 1124007076 /nfs/dbraw/zinc/00/70/76/1124007076.db2.gz FRHSIPZIZTUVES-UHFFFAOYSA-N 1 1 366.383 4.180 20 10 FICDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000179946594 1124155853 /nfs/dbraw/zinc/15/58/53/1124155853.db2.gz UWZCOPGXTWKBCS-IBGZPJMESA-N 1 1 351.450 4.108 20 10 FICDMO Cc1cc(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c(C)n1-c1ccccc1C ZINC000068895555 1124408495 /nfs/dbraw/zinc/40/84/95/1124408495.db2.gz ZNEXVMMRNZZJBA-HXUWFJFHSA-N 1 1 365.477 4.028 20 10 FICDMO CC(C)(C)OC(=O)NCC12CC(C1)C[N@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001143103388 1125246052 /nfs/dbraw/zinc/24/60/52/1125246052.db2.gz BQYQFLHZMFCXPA-UHFFFAOYSA-N 1 1 374.525 4.179 20 10 FICDMO CC(C)(C)OC(=O)N1CC[C@@]12CC[N@@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143103386 1125246240 /nfs/dbraw/zinc/24/62/40/1125246240.db2.gz BPHQTOCZHCXHJB-JOCHJYFZSA-N 1 1 374.525 4.275 20 10 FICDMO C[N@@H+](CCC1CCOCC1)Cc1ccc(OCc2ccccc2)cc1O ZINC000183091423 1125742053 /nfs/dbraw/zinc/74/20/53/1125742053.db2.gz INAMLUOMCVSRTC-UHFFFAOYSA-N 1 1 355.478 4.220 20 10 FICDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183075596 1125736477 /nfs/dbraw/zinc/73/64/77/1125736477.db2.gz WKBQSQDEGAHLTN-LJQANCHMSA-N 1 1 355.478 4.220 20 10 FICDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001167281470 1080967871 /nfs/dbraw/zinc/96/78/71/1080967871.db2.gz BGSNDPFXSJSNAJ-KRWDZBQOSA-N 1 1 371.550 4.292 20 10 FICDMO Cc1cc(C(=O)N2CC[N@H+](C3CC3)C[C@H]2C)c(C)n1-c1ccc(Cl)cc1 ZINC001648854733 1081304379 /nfs/dbraw/zinc/30/43/79/1081304379.db2.gz GJLUSKZUQPKYLI-OAHLLOKOSA-N 1 1 371.912 4.056 20 10 FICDMO Cc1cc(C(=O)N2CC[N@@H+](C3CC3)C[C@H]2C)c(C)n1-c1ccc(Cl)cc1 ZINC001648854733 1081304385 /nfs/dbraw/zinc/30/43/85/1081304385.db2.gz GJLUSKZUQPKYLI-OAHLLOKOSA-N 1 1 371.912 4.056 20 10 FICDMO CC[C@H]([NH2+]CCOc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1O ZINC000796836348 1082766892 /nfs/dbraw/zinc/76/68/92/1082766892.db2.gz WIUDWYRTCXHCPD-AWEZNQCLSA-N 1 1 358.335 4.065 20 10 FICDMO Brc1c[nH+]ccc1N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000548479659 1083445303 /nfs/dbraw/zinc/44/53/03/1083445303.db2.gz FPIMDFMXDNKMBU-UHFFFAOYSA-N 1 1 355.239 4.014 20 10 FICDMO C[C@@H]([NH2+]CCCSc1nccs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000780876815 1086301526 /nfs/dbraw/zinc/30/15/26/1086301526.db2.gz FHBBAGARDWMKBF-AEFFLSMTSA-N 1 1 361.580 4.126 20 10 FICDMO Fc1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)ccc1N1CCOCC1 ZINC000066970516 1086613736 /nfs/dbraw/zinc/61/37/36/1086613736.db2.gz STZKRUNYFCZYPK-QFIPXVFZSA-N 1 1 366.436 4.135 20 10 FICDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000782843472 1088235791 /nfs/dbraw/zinc/23/57/91/1088235791.db2.gz PWUCKWJUXRAGCC-MRXNPFEDSA-N 1 1 352.409 4.123 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2F)C1 ZINC000435666090 1089827875 /nfs/dbraw/zinc/82/78/75/1089827875.db2.gz YZZHSQWGHKAKRD-UHFFFAOYSA-N 1 1 365.452 4.186 20 10 FICDMO C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)c1ccc(F)cc1O ZINC000756435263 1090430157 /nfs/dbraw/zinc/43/01/57/1090430157.db2.gz YUWAQSJWRBLILF-AWEZNQCLSA-N 1 1 365.408 4.029 20 10 FICDMO Cc1ccc(C)n1-c1ccc(C(=O)N2CC[N@H+](C)CC23CCCCC3)cc1 ZINC001126551868 1093408544 /nfs/dbraw/zinc/40/85/44/1093408544.db2.gz MKWMLPCSRQKYFM-UHFFFAOYSA-N 1 1 365.521 4.185 20 10 FICDMO Cc1cc(CCNC(=O)CC[C@@H]2CCCC[N@@H+]2C)c(C)n1-c1ccccc1 ZINC001648953179 1095183244 /nfs/dbraw/zinc/18/32/44/1095183244.db2.gz VGHJVOZXTQQBQG-NRFANRHFSA-N 1 1 367.537 4.017 20 10 FICDMO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c(O)c1C ZINC000273378299 1096256464 /nfs/dbraw/zinc/25/64/64/1096256464.db2.gz HRTOZKJHOHDRJW-HNAYVOBHSA-N 1 1 353.441 4.322 20 10 FICDMO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c(O)c1C ZINC000273378301 1096256861 /nfs/dbraw/zinc/25/68/61/1096256861.db2.gz HRTOZKJHOHDRJW-KXBFYZLASA-N 1 1 353.441 4.322 20 10 FICDMO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c(O)c1C ZINC000273397530 1096259181 /nfs/dbraw/zinc/25/91/81/1096259181.db2.gz MEYZTKRYEDRAMU-BEFAXECRSA-N 1 1 353.441 4.322 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccn2)c2ccccc2OC)c1 ZINC000186193169 1101757331 /nfs/dbraw/zinc/75/73/31/1101757331.db2.gz GEKOQXGQGJBNEV-IVZQSRNASA-N 1 1 364.445 4.245 20 10 FICDMO C[C@@H](COCc1ccccc1)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001167983451 1102886630 /nfs/dbraw/zinc/88/66/30/1102886630.db2.gz MBCJPUNRLUWSGX-KNQAVFIVSA-N 1 1 369.505 4.226 20 10 FICDMO COc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)cc1F ZINC000528674784 1110071951 /nfs/dbraw/zinc/07/19/51/1110071951.db2.gz GQNWDXQNRWTMCB-UHFFFAOYSA-N 1 1 365.832 4.421 20 10 FICDMO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1nnn(-c2ccccc2)c1C ZINC000479441756 1112024081 /nfs/dbraw/zinc/02/40/81/1112024081.db2.gz ZSQHYPPSPUHDSC-INIZCTEOSA-N 1 1 359.477 4.227 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCSC[C@@H]3C3CCC3)cc2)CC1 ZINC000842170527 1112422967 /nfs/dbraw/zinc/42/29/67/1112422967.db2.gz HVRNMFKGCRUBSQ-OAQYLSRUSA-N 1 1 360.567 4.019 20 10 FICDMO COc1cc(C)c(C[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)cc1OC ZINC000027529941 1113686818 /nfs/dbraw/zinc/68/68/18/1113686818.db2.gz XYECXRAIQKPHFT-UHFFFAOYSA-N 1 1 373.493 4.353 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000913170301 1114305010 /nfs/dbraw/zinc/30/50/10/1114305010.db2.gz UJVWUSDRAISKKB-HSZRJFAPSA-N 1 1 351.538 4.460 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1O ZINC000761193961 1115613086 /nfs/dbraw/zinc/61/30/86/1115613086.db2.gz LMXBYHPVUKKNCS-OAHLLOKOSA-N 1 1 361.825 4.120 20 10 FICDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000761295613 1115768926 /nfs/dbraw/zinc/76/89/26/1115768926.db2.gz ZDQSAUWHGHHUPZ-MRXNPFEDSA-N 1 1 350.462 4.260 20 10 FICDMO Cc1[nH+]ccn1-c1ccc(-c2noc(-c3ccc(-n4cccc4)cc3)n2)cn1 ZINC000761914247 1120572783 /nfs/dbraw/zinc/57/27/83/1120572783.db2.gz DBSIWQSEYKRFRE-UHFFFAOYSA-N 1 1 368.400 4.083 20 10 FICDMO CC(C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)=C1CCCC1 ZINC000761984618 1120615708 /nfs/dbraw/zinc/61/57/08/1120615708.db2.gz ZTLYWJHNLZJLFG-SFHVURJKSA-N 1 1 362.901 4.017 20 10 FICDMO Cc1noc(C)c1CO[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000762471025 1120912558 /nfs/dbraw/zinc/91/25/58/1120912558.db2.gz URJILFVGNAFRFZ-GOSISDBHSA-N 1 1 358.482 4.220 20 10 FICDMO Cc1cc(CNC2CC[NH+](CC3CC3)CC2)c(C)n1-c1cccc(C)c1 ZINC000916836829 1121879579 /nfs/dbraw/zinc/87/95/79/1121879579.db2.gz OEHJOANZBADGEX-UHFFFAOYSA-N 1 1 351.538 4.367 20 10 FICDMO C[N@@H+](CCOCCOc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000917019866 1122008037 /nfs/dbraw/zinc/00/80/37/1122008037.db2.gz JJNFDROPEGCCRW-UHFFFAOYSA-N 1 1 368.521 4.204 20 10 FICDMO CC(C)[N@H+](Cc1nc(-c2ccccc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074577 1122068546 /nfs/dbraw/zinc/06/85/46/1122068546.db2.gz APPYOWCTDWCKFF-UHFFFAOYSA-N 1 1 350.466 4.213 20 10 FICDMO CC(C)[N@@H+](Cc1nc(-c2ccccc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074577 1122068553 /nfs/dbraw/zinc/06/85/53/1122068553.db2.gz APPYOWCTDWCKFF-UHFFFAOYSA-N 1 1 350.466 4.213 20 10 FICDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1F)Cc1ccc(N(C)C)cc1 ZINC000917075378 1122070589 /nfs/dbraw/zinc/07/05/89/1122070589.db2.gz UMLQNNVHCLSMSH-UHFFFAOYSA-N 1 1 357.473 4.131 20 10 FICDMO COCCOc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000154729169 1122655518 /nfs/dbraw/zinc/65/55/18/1122655518.db2.gz PPACBNJHYVAORL-UHFFFAOYSA-N 1 1 367.445 4.213 20 10 FICDMO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H](c2ccccc2)O1 ZINC000920306512 1123437295 /nfs/dbraw/zinc/43/72/95/1123437295.db2.gz VZGOLZIMOSFEQG-FOIQADDNSA-N 1 1 355.478 4.357 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)cc1OC ZINC000180617742 1124377852 /nfs/dbraw/zinc/37/78/52/1124377852.db2.gz XKOJEGORNOHFCF-ZDUSSCGKSA-N 1 1 364.511 4.491 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)c1 ZINC000182345255 1125426290 /nfs/dbraw/zinc/42/62/90/1125426290.db2.gz QTUAUDLLFWSRTH-CHWSQXEVSA-N 1 1 371.412 4.310 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(-n2ccnc2)cc1 ZINC000070975766 1125752055 /nfs/dbraw/zinc/75/20/55/1125752055.db2.gz VCKSXGUWLOSIHP-UHFFFAOYSA-N 1 1 359.429 4.373 20 10 FICDMO O=C1O[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CN1C1CCCCC1 ZINC001167353869 1081595582 /nfs/dbraw/zinc/59/55/82/1081595582.db2.gz QQMDXIIGZCITGM-HXUWFJFHSA-N 1 1 372.509 4.290 20 10 FICDMO Cc1cc(C[N@@H+](C)CCc2ccc(Br)cc2)ccc1N(C)C ZINC001167360982 1081722660 /nfs/dbraw/zinc/72/26/60/1081722660.db2.gz XCJLMRDFYXHKNZ-UHFFFAOYSA-N 1 1 361.327 4.498 20 10 FICDMO OCC[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1c(O)cccc1Cl ZINC001140341719 1082389049 /nfs/dbraw/zinc/38/90/49/1082389049.db2.gz DNZYOVOROOFACK-UHFFFAOYSA-N 1 1 360.668 4.347 20 10 FICDMO OCC[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1c(O)cccc1Cl ZINC001140341719 1082389054 /nfs/dbraw/zinc/38/90/54/1082389054.db2.gz DNZYOVOROOFACK-UHFFFAOYSA-N 1 1 360.668 4.347 20 10 FICDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469546 1082655080 /nfs/dbraw/zinc/65/50/80/1082655080.db2.gz ZGEKEZRRTKRIPZ-CTNGQTDRSA-N 1 1 350.506 4.210 20 10 FICDMO COc1ccc(Br)cc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756689362 1085383161 /nfs/dbraw/zinc/38/31/61/1085383161.db2.gz VGHNGMOITSWBAI-VIFPVBQESA-N 1 1 372.209 4.292 20 10 FICDMO C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cc(Br)ccc1[O-] ZINC000756363430 1090132869 /nfs/dbraw/zinc/13/28/69/1090132869.db2.gz OFRUIIOACUDBIZ-UONOGXRCSA-N 1 1 355.320 4.070 20 10 FICDMO C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc(Br)ccc1[O-] ZINC000756363430 1090132876 /nfs/dbraw/zinc/13/28/76/1090132876.db2.gz OFRUIIOACUDBIZ-UONOGXRCSA-N 1 1 355.320 4.070 20 10 FICDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000181461625 1090280422 /nfs/dbraw/zinc/28/04/22/1090280422.db2.gz JCQAXEMWAXWKFK-OAHLLOKOSA-N 1 1 353.388 4.061 20 10 FICDMO COc1ccc(CC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1OC(F)F ZINC000185296434 1090531740 /nfs/dbraw/zinc/53/17/40/1090531740.db2.gz AWCHNAXSLDULEA-NSHDSACASA-N 1 1 355.356 4.035 20 10 FICDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1nnc2n1CCCCC2 ZINC000364439490 1091397819 /nfs/dbraw/zinc/39/78/19/1091397819.db2.gz FIDAQSRBLHQTNT-ZWKOTPCHSA-N 1 1 367.541 4.407 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3nc4ccccc4s3)CC2)cc1 ZINC000053772220 1091653191 /nfs/dbraw/zinc/65/31/91/1091653191.db2.gz MQWYATIFRXUVMG-UHFFFAOYSA-N 1 1 353.491 4.017 20 10 FICDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cn1nccc1-c1ccncc1 ZINC000729264912 1093954030 /nfs/dbraw/zinc/95/40/30/1093954030.db2.gz IQELPBDPPPJHTJ-UHFFFAOYSA-N 1 1 361.493 4.025 20 10 FICDMO C[C@@H](NC(=O)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 ZINC000015571673 1094399574 /nfs/dbraw/zinc/39/95/74/1094399574.db2.gz KVMVNZIENSVMBI-QGZVFWFLSA-N 1 1 371.550 4.048 20 10 FICDMO C[C@@H](NC(=O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 ZINC000015571673 1094399588 /nfs/dbraw/zinc/39/95/88/1094399588.db2.gz KVMVNZIENSVMBI-QGZVFWFLSA-N 1 1 371.550 4.048 20 10 FICDMO Cc1cc(CCNC(=O)CC[C@H]2CCCC[N@@H+]2C)c(C)n1-c1ccccc1 ZINC001648953181 1095182501 /nfs/dbraw/zinc/18/25/01/1095182501.db2.gz VGHJVOZXTQQBQG-OAQYLSRUSA-N 1 1 367.537 4.017 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(Cl)cc2)c1 ZINC000273426132 1096261709 /nfs/dbraw/zinc/26/17/09/1096261709.db2.gz UECBICJUFDAWHA-ORAYPTAESA-N 1 1 371.868 4.228 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2OC)c1 ZINC000186133081 1101755212 /nfs/dbraw/zinc/75/52/12/1101755212.db2.gz VAVLSQZZEOCZER-SZNDQCEHSA-N 1 1 353.418 4.443 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2OC)c1 ZINC000186133061 1101755638 /nfs/dbraw/zinc/75/56/38/1101755638.db2.gz VAVLSQZZEOCZER-QKKBWIMNSA-N 1 1 353.418 4.443 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1cc(Cl)nc(Cl)c1)C[C@@H]1CCCO1 ZINC000109761760 1102171999 /nfs/dbraw/zinc/17/19/99/1102171999.db2.gz KUTAKCMEXABYKM-HNNXBMFYSA-N 1 1 367.276 4.275 20 10 FICDMO Cc1cc(CN2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193585 1102274205 /nfs/dbraw/zinc/27/42/05/1102274205.db2.gz RSRQMQSGINIXCZ-WOJBJXKFSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@H+]2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193585 1102274214 /nfs/dbraw/zinc/27/42/14/1102274214.db2.gz RSRQMQSGINIXCZ-WOJBJXKFSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@@H+]2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193585 1102274224 /nfs/dbraw/zinc/27/42/24/1102274224.db2.gz RSRQMQSGINIXCZ-WOJBJXKFSA-N 1 1 351.538 4.156 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1COC2(CCCCC2)O1 ZINC001167983416 1102880492 /nfs/dbraw/zinc/88/04/92/1102880492.db2.gz LCFCYCGHAVVBGY-IBGZPJMESA-N 1 1 357.450 4.063 20 10 FICDMO Oc1ccccc1C[N@H+](C[C@H]1CC[C@H](c2ccccc2)O1)C[C@@H]1CCCO1 ZINC001167984669 1103214671 /nfs/dbraw/zinc/21/46/71/1103214671.db2.gz VNSRXORLRPDMST-QZNHQXDQSA-N 1 1 367.489 4.294 20 10 FICDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000529666567 1110302440 /nfs/dbraw/zinc/30/24/40/1110302440.db2.gz WIDZCDPNLHACMN-UHFFFAOYSA-N 1 1 357.457 4.285 20 10 FICDMO c1cc(N2CCSCC2)ccc1CNC1CC[NH+](C2CCCCC2)CC1 ZINC000163576378 1113699813 /nfs/dbraw/zinc/69/98/13/1113699813.db2.gz RPEINEZZMUDUSL-UHFFFAOYSA-N 1 1 373.610 4.127 20 10 FICDMO CCOc1ccc(O)c(C[NH2+][C@H](c2ccco2)c2ccccc2OC)c1 ZINC000151116423 1114297874 /nfs/dbraw/zinc/29/78/74/1114297874.db2.gz UASUMRMEAPQCER-NRFANRHFSA-N 1 1 353.418 4.272 20 10 FICDMO COc1cc(C)cc(C[N@@H+](C)Cc2csc(Br)c2)c1O ZINC000164211626 1114443436 /nfs/dbraw/zinc/44/34/36/1114443436.db2.gz NEQBORKHBRLIMV-UHFFFAOYSA-N 1 1 356.285 4.165 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(Br)cn1 ZINC000172536766 1115959388 /nfs/dbraw/zinc/95/93/88/1115959388.db2.gz JTAIGUSWEBJMQX-UHFFFAOYSA-N 1 1 373.250 4.345 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(Br)cn1 ZINC000172536766 1115959389 /nfs/dbraw/zinc/95/93/89/1115959389.db2.gz JTAIGUSWEBJMQX-UHFFFAOYSA-N 1 1 373.250 4.345 20 10 FICDMO Cc1cccc(C(=O)N2CCC[N@@H+](Cc3c(O)ccc4ccccc43)CC2)c1 ZINC000029889871 1118938498 /nfs/dbraw/zinc/93/84/98/1118938498.db2.gz RZVIXXNYGISNPR-UHFFFAOYSA-N 1 1 374.484 4.202 20 10 FICDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc(Br)ncc1F ZINC000762749949 1120959396 /nfs/dbraw/zinc/95/93/96/1120959396.db2.gz SZNFIMAHBHBWHM-JTQLQIEISA-N 1 1 370.241 4.039 20 10 FICDMO CC(C)c1ccccc1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074005 1122067513 /nfs/dbraw/zinc/06/75/13/1122067513.db2.gz MPIPIZHESTWQAE-UHFFFAOYSA-N 1 1 365.521 4.479 20 10 FICDMO CC(C)c1ccccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074005 1122067517 /nfs/dbraw/zinc/06/75/17/1122067517.db2.gz MPIPIZHESTWQAE-UHFFFAOYSA-N 1 1 365.521 4.479 20 10 FICDMO CC(C)[N@@H+](CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000917075100 1122069814 /nfs/dbraw/zinc/06/98/14/1122069814.db2.gz PYYLTNUYELCJLE-IBGZPJMESA-N 1 1 367.537 4.183 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3cc(Cl)ccc3OC)CC2)cc1 ZINC000917090003 1122103218 /nfs/dbraw/zinc/10/32/18/1122103218.db2.gz SNXZTUNSWIGYHJ-UHFFFAOYSA-N 1 1 360.885 4.070 20 10 FICDMO COCCOc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154727050 1122642920 /nfs/dbraw/zinc/64/29/20/1122642920.db2.gz DXIPJJOXRKHMPD-UHFFFAOYSA-N 1 1 367.445 4.213 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984913 1123300370 /nfs/dbraw/zinc/30/03/70/1123300370.db2.gz WGRCOWZFXGFCAD-QZTJIDSGSA-N 1 1 371.912 4.104 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCCCC[C@H]2C)C1 ZINC001128246768 1125123358 /nfs/dbraw/zinc/12/33/58/1125123358.db2.gz CWIPBQNEXIZQNK-GOSISDBHSA-N 1 1 367.537 4.199 20 10 FICDMO C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cc(F)cc(F)c2[O-])cc1 ZINC001648795637 1080804370 /nfs/dbraw/zinc/80/43/70/1080804370.db2.gz SITGKIBEZYGJDH-HNNXBMFYSA-N 1 1 360.448 4.335 20 10 FICDMO CC[C@H](c1ccccc1)[NH+]1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC001167508933 1084311943 /nfs/dbraw/zinc/31/19/43/1084311943.db2.gz JXZSPZYTGMFMNK-OAQYLSRUSA-N 1 1 370.468 4.003 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)c1 ZINC000312948769 1085140171 /nfs/dbraw/zinc/14/01/71/1085140171.db2.gz RHNDWCSOVIXDHB-ICSRJNTNSA-N 1 1 368.521 4.354 20 10 FICDMO C[C@@H]1CC(O)C[C@@H](C)[NH+]1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000588564581 1086031568 /nfs/dbraw/zinc/03/15/68/1086031568.db2.gz QCFSPDUVHNLQDH-HZPDHXFCSA-N 1 1 366.465 4.274 20 10 FICDMO CC[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc(F)cc1O ZINC000796705107 1086501921 /nfs/dbraw/zinc/50/19/21/1086501921.db2.gz OYJUVEFBPSWKOX-OAHLLOKOSA-N 1 1 351.805 4.197 20 10 FICDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1ccccc1O ZINC000179553239 1090080123 /nfs/dbraw/zinc/08/01/23/1090080123.db2.gz WAQRYKMJGHHWKY-UHFFFAOYSA-N 1 1 366.383 4.260 20 10 FICDMO CCOc1ccc(O)c(C[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000364009694 1090650022 /nfs/dbraw/zinc/65/00/22/1090650022.db2.gz DXFDSLMLQFRNNE-FQEVSTJZSA-N 1 1 371.868 4.057 20 10 FICDMO C[C@H]([NH2+]Cc1ncnn1-c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000279488831 1091908350 /nfs/dbraw/zinc/90/83/50/1091908350.db2.gz LNGOUKONMYOOKH-SFHVURJKSA-N 1 1 361.493 4.108 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@H]2CCCN(C)C2)cc1 ZINC000236966037 1093159059 /nfs/dbraw/zinc/15/90/59/1093159059.db2.gz DGZIJSDPGLBMGO-JOCHJYFZSA-N 1 1 351.538 4.145 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCCC2=CCCC2)C1 ZINC000435919592 1098560412 /nfs/dbraw/zinc/56/04/12/1098560412.db2.gz ZJJDMSYQAIFEHY-UHFFFAOYSA-N 1 1 365.521 4.024 20 10 FICDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1nc3ccccc3s1)OCO2 ZINC000007091977 1101633130 /nfs/dbraw/zinc/63/31/30/1101633130.db2.gz YTKWEQDVSFHDBM-AWEZNQCLSA-N 1 1 354.431 4.068 20 10 FICDMO CCC[N@H+](Cc1cc(F)c(F)cc1O)[C@H](C)C(=O)Nc1ccccc1C ZINC001142527116 1102156807 /nfs/dbraw/zinc/15/68/07/1102156807.db2.gz LDILBSKJRNEXTJ-CQSZACIVSA-N 1 1 362.420 4.218 20 10 FICDMO CCC[N@@H+](Cc1cc(F)c(F)cc1O)[C@H](C)C(=O)Nc1ccccc1C ZINC001142527116 1102156816 /nfs/dbraw/zinc/15/68/16/1102156816.db2.gz LDILBSKJRNEXTJ-CQSZACIVSA-N 1 1 362.420 4.218 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1cc(Cl)nc(Cl)c1)C[C@H]1CCCO1 ZINC000109761763 1102172225 /nfs/dbraw/zinc/17/22/25/1102172225.db2.gz KUTAKCMEXABYKM-OAHLLOKOSA-N 1 1 367.276 4.275 20 10 FICDMO C[C@H](COCc1ccccc1)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001167983452 1102887086 /nfs/dbraw/zinc/88/70/86/1102887086.db2.gz MBCJPUNRLUWSGX-SIKLNZKXSA-N 1 1 369.505 4.226 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)c1O ZINC001167990478 1104372394 /nfs/dbraw/zinc/37/23/94/1104372394.db2.gz UPUVXSJNCPOYID-HXUWFJFHSA-N 1 1 373.880 4.120 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)c1ccc(Cl)cc1 ZINC000111232806 1112890069 /nfs/dbraw/zinc/89/00/69/1112890069.db2.gz ZSZUJNJXKUDNDG-FQEVSTJZSA-N 1 1 357.837 4.374 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1O ZINC000761191823 1115613977 /nfs/dbraw/zinc/61/39/77/1115613977.db2.gz XBSDADXEXMPYCX-UHFFFAOYSA-N 1 1 369.852 4.220 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)c1O ZINC000761201245 1115618747 /nfs/dbraw/zinc/61/87/47/1115618747.db2.gz FKZMOTLSWWSMTM-LIRRHRJNSA-N 1 1 361.869 4.325 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)c1O ZINC000761201245 1115618749 /nfs/dbraw/zinc/61/87/49/1115618749.db2.gz FKZMOTLSWWSMTM-LIRRHRJNSA-N 1 1 361.869 4.325 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c1O ZINC000761203562 1115622897 /nfs/dbraw/zinc/62/28/97/1115622897.db2.gz WFTHLRAPHKVXLM-XIKOKIGWSA-N 1 1 365.832 4.155 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c1O ZINC000761203562 1115622898 /nfs/dbraw/zinc/62/28/98/1115622898.db2.gz WFTHLRAPHKVXLM-XIKOKIGWSA-N 1 1 365.832 4.155 20 10 FICDMO O=C(NC[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1)c1ccccc1 ZINC000176496806 1119540176 /nfs/dbraw/zinc/54/01/76/1119540176.db2.gz AICFVLXJBPYMRQ-GOSISDBHSA-N 1 1 374.484 4.187 20 10 FICDMO COCC[N@@H+](C)CCCNC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000915303945 1120916371 /nfs/dbraw/zinc/91/63/71/1120916371.db2.gz NCPBAJDIHVRROR-UHFFFAOYSA-N 1 1 369.469 4.192 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc(Br)ncc1F ZINC000762749950 1120959367 /nfs/dbraw/zinc/95/93/67/1120959367.db2.gz SZNFIMAHBHBWHM-SNVBAGLBSA-N 1 1 370.241 4.039 20 10 FICDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1c(O)ccc3ccncc31)CCC2 ZINC000763218693 1121292783 /nfs/dbraw/zinc/29/27/83/1121292783.db2.gz GZAUZMZTJAZLOK-KRWDZBQOSA-N 1 1 353.491 4.469 20 10 FICDMO CCc1cccc(C)c1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917075491 1122071463 /nfs/dbraw/zinc/07/14/63/1122071463.db2.gz XGEAHFUNAUVWLN-UHFFFAOYSA-N 1 1 365.521 4.227 20 10 FICDMO CCc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917075491 1122071471 /nfs/dbraw/zinc/07/14/71/1122071471.db2.gz XGEAHFUNAUVWLN-UHFFFAOYSA-N 1 1 365.521 4.227 20 10 FICDMO C[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@@H]1CCCCO1 ZINC000918735302 1122766172 /nfs/dbraw/zinc/76/61/72/1122766172.db2.gz JFASWXLCCGYLCU-HNNXBMFYSA-N 1 1 364.283 4.309 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3cc(OC)cc(OC)c3)c2c1 ZINC000919957503 1123283758 /nfs/dbraw/zinc/28/37/58/1123283758.db2.gz RIMKEEWSOKBJHB-UHFFFAOYSA-N 1 1 367.445 4.203 20 10 FICDMO COc1ccc(N2CCC[N@@H+]([C@@H](C)c3ncc(C(C)(C)C)o3)CC2)cc1 ZINC000175113133 1123734210 /nfs/dbraw/zinc/73/42/10/1123734210.db2.gz XLGBNVOHWKSGOP-INIZCTEOSA-N 1 1 357.498 4.254 20 10 FICDMO COc1ccc(N2CCC[N@H+]([C@@H](C)c3ncc(C(C)(C)C)o3)CC2)cc1 ZINC000175113133 1123734211 /nfs/dbraw/zinc/73/42/11/1123734211.db2.gz XLGBNVOHWKSGOP-INIZCTEOSA-N 1 1 357.498 4.254 20 10 FICDMO Cc1[nH+]c(N2CCOCC2)ccc1N[C@H](C)c1ccc2ccccc2c1O ZINC000186489424 1124709358 /nfs/dbraw/zinc/70/93/58/1124709358.db2.gz BZHRQNDQXXWGQM-OAHLLOKOSA-N 1 1 363.461 4.259 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)cc1OC ZINC000160271498 1080676923 /nfs/dbraw/zinc/67/69/23/1080676923.db2.gz OFYFUPMRUOQKTG-QGZVFWFLSA-N 1 1 359.491 4.008 20 10 FICDMO C[C@@H]1C[C@H]1C[N@H+]1CCc2c(Cl)c(O)c(O)cc2[C@@H](c2ccc(O)cc2)C1 ZINC001209433032 1080680252 /nfs/dbraw/zinc/68/02/52/1080680252.db2.gz SNHQFYQFCDYPFA-UVBSCNOISA-N 1 1 373.880 4.103 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000160272579 1080701086 /nfs/dbraw/zinc/70/10/86/1080701086.db2.gz KVJWYAZLCOZTPI-JLTOFOAXSA-N 1 1 359.491 4.088 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@]2(N(C)C)CCC[C@H](C)C2)c1 ZINC001648895199 1081353177 /nfs/dbraw/zinc/35/31/77/1081353177.db2.gz FYONUMSMIMQWJN-SCLBCKFNSA-N 1 1 369.347 4.063 20 10 FICDMO CCN(C)c1ccc(CN2CC[NH+]([C@H](C)c3cccc(OC)c3)CC2)cc1 ZINC001167360841 1081720717 /nfs/dbraw/zinc/72/07/17/1081720717.db2.gz SCQTVDDPXPKORH-LJQANCHMSA-N 1 1 367.537 4.030 20 10 FICDMO Cc1cccc(OC[C@H](O)C[N@@H+](Cc2ccc(N(C)C)c(C)c2)C(C)C)c1 ZINC001167487943 1082982610 /nfs/dbraw/zinc/98/26/10/1082982610.db2.gz ULRLUELQCJTGJG-OAQYLSRUSA-N 1 1 370.537 4.020 20 10 FICDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000092786067 1083413448 /nfs/dbraw/zinc/41/34/48/1083413448.db2.gz KMPCFSGXOCTSEV-INIZCTEOSA-N 1 1 367.424 4.269 20 10 FICDMO Oc1cc2c(cc1O)C[N@H+](Cc1ccc(F)c(OC(F)(F)F)c1)CCC2 ZINC001143446889 1085592089 /nfs/dbraw/zinc/59/20/89/1085592089.db2.gz JEBZUUAFIWMDQI-UHFFFAOYSA-N 1 1 371.330 4.084 20 10 FICDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccc(F)c(OC(F)(F)F)c1)CCC2 ZINC001143446889 1085592097 /nfs/dbraw/zinc/59/20/97/1085592097.db2.gz JEBZUUAFIWMDQI-UHFFFAOYSA-N 1 1 371.330 4.084 20 10 FICDMO [O-]c1c(Cl)cccc1C[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000311048147 1088160424 /nfs/dbraw/zinc/16/04/24/1088160424.db2.gz QDGYAOOCBXTVAT-SFHVURJKSA-N 1 1 358.913 4.438 20 10 FICDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1 ZINC000180937885 1090244782 /nfs/dbraw/zinc/24/47/82/1090244782.db2.gz JARGEPDPPCEHKM-RCLKMUNOSA-N 1 1 366.461 4.124 20 10 FICDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000181461601 1090280025 /nfs/dbraw/zinc/28/00/25/1090280025.db2.gz JCQAXEMWAXWKFK-HNNXBMFYSA-N 1 1 353.388 4.061 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCS[C@H]4CCCC[C@@H]43)cc2)CC1 ZINC000828025108 1091021597 /nfs/dbraw/zinc/02/15/97/1091021597.db2.gz DKSHYEYCVDBZQS-SFTDATJTSA-N 1 1 360.567 4.162 20 10 FICDMO C[C@@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1ccc(N2CCCCC2)cc1 ZINC000364439487 1091397966 /nfs/dbraw/zinc/39/79/66/1091397966.db2.gz FIDAQSRBLHQTNT-MSOLQXFVSA-N 1 1 367.541 4.407 20 10 FICDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cc(OC)c(OC)cc2O)cc1 ZINC000159519493 1093033898 /nfs/dbraw/zinc/03/38/98/1093033898.db2.gz WMTMNGYKNDTCTC-SFHVURJKSA-N 1 1 357.450 4.145 20 10 FICDMO CN(C)C(=O)c1cccc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)c1 ZINC000729266412 1093954572 /nfs/dbraw/zinc/95/45/72/1093954572.db2.gz ADHKBKSROGBALK-UHFFFAOYSA-N 1 1 366.505 4.429 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2nccn2C)c2ccc(Cl)cc2)c1 ZINC000273426126 1096261608 /nfs/dbraw/zinc/26/16/08/1096261608.db2.gz UECBICJUFDAWHA-DJJJIMSYSA-N 1 1 371.868 4.228 20 10 FICDMO Cc1cn(CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)c(C)[nH+]1 ZINC000760179062 1101578088 /nfs/dbraw/zinc/57/80/88/1101578088.db2.gz FTJGJKXKEWWQPY-UHFFFAOYSA-N 1 1 373.403 4.392 20 10 FICDMO Cc1cc(C[N@@H+]2CCc3cccc(Br)c3C2)ccc1N(C)C ZINC001168163946 1101744269 /nfs/dbraw/zinc/74/42/69/1101744269.db2.gz OTGADFJMXVBHNB-UHFFFAOYSA-N 1 1 359.311 4.382 20 10 FICDMO Cc1cc(C[N@H+]2CCc3cccc(Br)c3C2)ccc1N(C)C ZINC001168163946 1101744282 /nfs/dbraw/zinc/74/42/82/1101744282.db2.gz OTGADFJMXVBHNB-UHFFFAOYSA-N 1 1 359.311 4.382 20 10 FICDMO C[N@H+](Cc1cc(F)c(F)cc1[O-])CC1CC[NH+](Cc2ccccc2)CC1 ZINC001142527177 1102157557 /nfs/dbraw/zinc/15/75/57/1102157557.db2.gz NDNWKZUKOVCHQR-UHFFFAOYSA-N 1 1 360.448 4.014 20 10 FICDMO C[C@@H](Cc1cccc(Br)c1)[NH2+]Cc1cc(F)cc(F)c1O ZINC001648986705 1102586937 /nfs/dbraw/zinc/58/69/37/1102586937.db2.gz WBGJLXBWWLQISL-JTQLQIEISA-N 1 1 356.210 4.154 20 10 FICDMO Cc1cc(Cl)ccc1C1=CC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)CC1 ZINC000530107531 1106830697 /nfs/dbraw/zinc/83/06/97/1106830697.db2.gz ZIFPHGJEJZUXDX-HXUWFJFHSA-N 1 1 371.864 4.069 20 10 FICDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nccn2CCc2ccccc2)cc1 ZINC000164257890 1114445362 /nfs/dbraw/zinc/44/53/62/1114445362.db2.gz USWQRYFFFCUHGE-IBGZPJMESA-N 1 1 362.521 4.433 20 10 FICDMO Cc1cc(-c2nnc(C[N@@H+](Cc3ccc(N(C)C)cc3)C(C)C)o2)c(C)o1 ZINC000760816756 1115046158 /nfs/dbraw/zinc/04/61/58/1115046158.db2.gz IVGFNQRYHSGNOQ-UHFFFAOYSA-N 1 1 368.481 4.423 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1O ZINC000761203550 1115622900 /nfs/dbraw/zinc/62/29/00/1115622900.db2.gz WFTHLRAPHKVXLM-KZULUSFZSA-N 1 1 365.832 4.155 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1O ZINC000761203550 1115622901 /nfs/dbraw/zinc/62/29/01/1115622901.db2.gz WFTHLRAPHKVXLM-KZULUSFZSA-N 1 1 365.832 4.155 20 10 FICDMO C[N@H+](Cc1cscn1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000063127387 1116013630 /nfs/dbraw/zinc/01/36/30/1116013630.db2.gz BUEHJUHMNJFICZ-UHFFFAOYSA-N 1 1 363.280 4.396 20 10 FICDMO C[N@@H+](Cc1cscn1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000063127387 1116013633 /nfs/dbraw/zinc/01/36/33/1116013633.db2.gz BUEHJUHMNJFICZ-UHFFFAOYSA-N 1 1 363.280 4.396 20 10 FICDMO C[C@@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000762647967 1120944970 /nfs/dbraw/zinc/94/49/70/1120944970.db2.gz GSSKSFBKJIEIRO-LEWJYISDSA-N 1 1 373.585 4.219 20 10 FICDMO COc1ccccc1OCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000917020498 1122007028 /nfs/dbraw/zinc/00/70/28/1122007028.db2.gz QCLSDNAWRHIJAY-UHFFFAOYSA-N 1 1 354.494 4.196 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000917019867 1122007456 /nfs/dbraw/zinc/00/74/56/1122007456.db2.gz JLZYZCHUYMFBIT-UHFFFAOYSA-N 1 1 357.454 4.082 20 10 FICDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)c1 ZINC000917075413 1122070185 /nfs/dbraw/zinc/07/01/85/1122070185.db2.gz VLZKVDKIMVRLTN-UHFFFAOYSA-N 1 1 353.510 4.219 20 10 FICDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNCc2ccc3c(c2)CCO3)C1 ZINC000917395659 1122287378 /nfs/dbraw/zinc/28/73/78/1122287378.db2.gz XJLCZGOKDVKCTM-RTBURBONSA-N 1 1 364.533 4.389 20 10 FICDMO Cc1ccc(C(=O)N2CC[NH+](Cc3cc(C(C)C)c(C)cc3O)CC2)s1 ZINC000917620423 1122381506 /nfs/dbraw/zinc/38/15/06/1122381506.db2.gz ZEMAFQBKELZKDF-UHFFFAOYSA-N 1 1 372.534 4.152 20 10 FICDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000919952470 1123280482 /nfs/dbraw/zinc/28/04/82/1123280482.db2.gz WCJMKANUIDTWOV-FQEVSTJZSA-N 1 1 362.429 4.064 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c(C)n1-c1cccc(Cl)c1 ZINC000919981873 1123299039 /nfs/dbraw/zinc/29/90/39/1123299039.db2.gz AWDHVLSWCOANPN-PMACEKPBSA-N 1 1 371.912 4.104 20 10 FICDMO COc1cc(O)c(C[N@@H+](Cc2ccco2)Cc2ccccc2)cc1OC ZINC000179582637 1124008061 /nfs/dbraw/zinc/00/80/61/1124008061.db2.gz ZFFSAHBCPUPSOO-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO CC[N@@H+](CCCC1CCOCC1)Cc1cc(Br)ccc1O ZINC000765920169 1124597024 /nfs/dbraw/zinc/59/70/24/1124597024.db2.gz LDWATKDRFDWPQS-UHFFFAOYSA-N 1 1 356.304 4.183 20 10 FICDMO CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1NCCCOC(C)C)N=[N+]=[N-] ZINC001168677751 1124764429 /nfs/dbraw/zinc/76/44/29/1124764429.db2.gz VIIDKTNINCLWHQ-WJDWOHSUSA-N 1 1 361.446 4.140 20 10 FICDMO c1ccc2oc(-c3ccc(N4CC[NH+](Cc5cccnc5)CC4)cc3)nc2c1 ZINC000095588950 136151086 /nfs/dbraw/zinc/15/10/86/136151086.db2.gz XTFHFTIUFMPCEP-UHFFFAOYSA-N 1 1 370.456 4.212 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c1 ZINC000182436357 1125491830 /nfs/dbraw/zinc/49/18/30/1125491830.db2.gz JGLSNDURPOUFSO-GJZGRUSLSA-N 1 1 367.449 4.479 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000274832817 1080205077 /nfs/dbraw/zinc/20/50/77/1080205077.db2.gz MQGYAGDBIJWTEX-NEPJUHHUSA-N 1 1 357.385 4.002 20 10 FICDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275324117 1080766070 /nfs/dbraw/zinc/76/60/70/1080766070.db2.gz LLVORQDPUQHWOZ-IUCAKERBSA-N 1 1 356.289 4.035 20 10 FICDMO CN(Cc1cccs1)c1ccc(CN[C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC001648819242 1081244365 /nfs/dbraw/zinc/24/43/65/1081244365.db2.gz UFKYLXPWXKJDTB-LEWJYISDSA-N 1 1 355.551 4.101 20 10 FICDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@H]2CCN3CCCC[C@H]23)cc1 ZINC001648819242 1081244372 /nfs/dbraw/zinc/24/43/72/1081244372.db2.gz UFKYLXPWXKJDTB-LEWJYISDSA-N 1 1 355.551 4.101 20 10 FICDMO CN(Cc1cccs1)c1ccc(CN[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC001648819243 1081244960 /nfs/dbraw/zinc/24/49/60/1081244960.db2.gz UFKYLXPWXKJDTB-NHCUHLMSSA-N 1 1 355.551 4.101 20 10 FICDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@@H]2CCN3CCCC[C@H]23)cc1 ZINC001648819243 1081244974 /nfs/dbraw/zinc/24/49/74/1081244974.db2.gz UFKYLXPWXKJDTB-NHCUHLMSSA-N 1 1 355.551 4.101 20 10 FICDMO CC[NH+](CC)Cc1cccc(CNCc2cc(F)c(N(C)C)cc2F)c1 ZINC001648826381 1081258713 /nfs/dbraw/zinc/25/87/13/1081258713.db2.gz DKQLBORSRYRJSP-UHFFFAOYSA-N 1 1 361.480 4.162 20 10 FICDMO CCN(C)c1ccc(CN2CC[NH+]([C@@H](C)c3cccc(OC)c3)CC2)cc1 ZINC001167360840 1081721238 /nfs/dbraw/zinc/72/12/38/1081721238.db2.gz SCQTVDDPXPKORH-IBGZPJMESA-N 1 1 367.537 4.030 20 10 FICDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC001167567734 1084918492 /nfs/dbraw/zinc/91/84/92/1084918492.db2.gz JNBRXFQTUKNWPL-HSZRJFAPSA-N 1 1 352.522 4.366 20 10 FICDMO COC1CCN(c2ccc(C[N@@H+](CCC(F)(F)F)CC3CC3)cc2)CC1 ZINC000828020001 1085209263 /nfs/dbraw/zinc/20/92/63/1085209263.db2.gz CPDBKSCGOZLQKT-UHFFFAOYSA-N 1 1 370.459 4.466 20 10 FICDMO Cc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(OC(F)(F)F)c1 ZINC001143472611 1087939450 /nfs/dbraw/zinc/93/94/50/1087939450.db2.gz RRWCCRDNTFQUKY-UHFFFAOYSA-N 1 1 367.367 4.253 20 10 FICDMO C[C@H]([NH2+]CCOc1ccccc1)c1cc(Br)c(F)cc1O ZINC000756371447 1090200289 /nfs/dbraw/zinc/20/02/89/1090200289.db2.gz JOBBCLJLIJBCKF-NSHDSACASA-N 1 1 354.219 4.023 20 10 FICDMO CC(=O)c1cc(Cl)cc(C[NH+]2CCC3(CC2)OCc2ccccc23)c1O ZINC000759785547 1091086376 /nfs/dbraw/zinc/08/63/76/1091086376.db2.gz ZNGXZPAFWCZBJC-UHFFFAOYSA-N 1 1 371.864 4.270 20 10 FICDMO Fc1cc(CNc2cc[nH+]c3ccsc32)cc(F)c1N1CCOCC1 ZINC000840327624 1093785431 /nfs/dbraw/zinc/78/54/31/1093785431.db2.gz UMSRHQQTPGZIEY-UHFFFAOYSA-N 1 1 361.417 4.023 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186205307 1101759146 /nfs/dbraw/zinc/75/91/46/1101759146.db2.gz LFXZSSATROWGEC-LHSJRXKWSA-N 1 1 352.409 4.375 20 10 FICDMO [O-]c1cc(F)c(F)cc1C[N@@H+]1C[C@H]2c3ccccc3[C@H](OCC3CC3)[C@H]2C1 ZINC001142520186 1102137773 /nfs/dbraw/zinc/13/77/73/1102137773.db2.gz CXWVOKZCJCMTCS-SPEDKVCISA-N 1 1 371.427 4.367 20 10 FICDMO Oc1cc(F)c(F)cc1C[N@H+]1C[C@H]2c3ccccc3[C@H](OCC3CC3)[C@H]2C1 ZINC001142520186 1102137777 /nfs/dbraw/zinc/13/77/77/1102137777.db2.gz CXWVOKZCJCMTCS-SPEDKVCISA-N 1 1 371.427 4.367 20 10 FICDMO Oc1cc(F)c(F)cc1C[N@@H+]1C[C@H]2c3ccccc3[C@H](OCC3CC3)[C@H]2C1 ZINC001142520186 1102137786 /nfs/dbraw/zinc/13/77/86/1102137786.db2.gz CXWVOKZCJCMTCS-SPEDKVCISA-N 1 1 371.427 4.367 20 10 FICDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c1O ZINC000894543500 1102553179 /nfs/dbraw/zinc/55/31/79/1102553179.db2.gz RZSCOMRHISYJRS-ZDUSSCGKSA-N 1 1 371.412 4.058 20 10 FICDMO CCOC(=O)c1c[nH+]ccc1N1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000479361742 1112006233 /nfs/dbraw/zinc/00/62/33/1112006233.db2.gz CMAIHYPINDMSSX-UHFFFAOYSA-N 1 1 365.408 4.172 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1C ZINC000057104721 1114875785 /nfs/dbraw/zinc/87/57/85/1114875785.db2.gz BJWHSHWYCWDOSM-UHFFFAOYSA-N 1 1 372.896 4.011 20 10 FICDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)c1O ZINC000761203555 1115623033 /nfs/dbraw/zinc/62/30/33/1115623033.db2.gz WFTHLRAPHKVXLM-SGTLLEGYSA-N 1 1 365.832 4.155 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)c1O ZINC000761203555 1115623034 /nfs/dbraw/zinc/62/30/34/1115623034.db2.gz WFTHLRAPHKVXLM-SGTLLEGYSA-N 1 1 365.832 4.155 20 10 FICDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(C(C)=O)c1O ZINC001168414836 1115795113 /nfs/dbraw/zinc/79/51/13/1115795113.db2.gz UNCAWFGEQBXMJK-SFHVURJKSA-N 1 1 361.869 4.021 20 10 FICDMO C[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000762647982 1120945046 /nfs/dbraw/zinc/94/50/46/1120945046.db2.gz GSSKSFBKJIEIRO-RTWAWAEBSA-N 1 1 373.585 4.219 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cn(-c2ccccc2)nn1 ZINC000154113163 1121597123 /nfs/dbraw/zinc/59/71/23/1121597123.db2.gz JHYBOKBIRPDNCR-GOSISDBHSA-N 1 1 361.493 4.108 20 10 FICDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cn(-c2ccccc2)nn1 ZINC000154113031 1121597345 /nfs/dbraw/zinc/59/73/45/1121597345.db2.gz JHYBOKBIRPDNCR-SFHVURJKSA-N 1 1 361.493 4.108 20 10 FICDMO CC(C)[N@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074914 1122068951 /nfs/dbraw/zinc/06/89/51/1122068951.db2.gz LGKLEQCWXVMWMW-UHFFFAOYSA-N 1 1 364.493 4.137 20 10 FICDMO CC(C)[N@@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074914 1122068959 /nfs/dbraw/zinc/06/89/59/1122068959.db2.gz LGKLEQCWXVMWMW-UHFFFAOYSA-N 1 1 364.493 4.137 20 10 FICDMO COc1ccc(N2CCC[N@@H+](CCSc3ccccc3F)CC2)cc1 ZINC000917088512 1122100180 /nfs/dbraw/zinc/10/01/80/1122100180.db2.gz ZXUMZWMVYPADDN-UHFFFAOYSA-N 1 1 360.498 4.139 20 10 FICDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNCc2ccc3c(c2)CCO3)C1 ZINC000917395656 1122287498 /nfs/dbraw/zinc/28/74/98/1122287498.db2.gz XJLCZGOKDVKCTM-KDURUIRLSA-N 1 1 364.533 4.389 20 10 FICDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNCc2ccc3c(c2)CCO3)C1 ZINC000917395656 1122287502 /nfs/dbraw/zinc/28/75/02/1122287502.db2.gz XJLCZGOKDVKCTM-KDURUIRLSA-N 1 1 364.533 4.389 20 10 FICDMO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1c(O)ccc2ccncc21 ZINC000917487161 1122332731 /nfs/dbraw/zinc/33/27/31/1122332731.db2.gz SRGTZZRDPZQMPF-UHFFFAOYSA-N 1 1 356.853 4.495 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583088 1122713764 /nfs/dbraw/zinc/71/37/64/1122713764.db2.gz VCDDJEBSDMJSOH-UXHICEINSA-N 1 1 371.912 4.104 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583089 1122714109 /nfs/dbraw/zinc/71/41/09/1122714109.db2.gz VCDDJEBSDMJSOH-VQTJNVASSA-N 1 1 371.912 4.104 20 10 FICDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601900 1122723246 /nfs/dbraw/zinc/72/32/46/1122723246.db2.gz LLDUUOVYSBMEMI-MJGOQNOKSA-N 1 1 371.912 4.104 20 10 FICDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057443 1123558553 /nfs/dbraw/zinc/55/85/53/1123558553.db2.gz WOBKMSXDZWINQS-ROUUACIJSA-N 1 1 360.542 4.341 20 10 FICDMO CCC[N@@H+](Cc1cn(C)nc1-c1ccc(C#N)cc1)Cc1ccccc1O ZINC000180016015 1124198678 /nfs/dbraw/zinc/19/86/78/1124198678.db2.gz AMPWIESZXNIMBE-UHFFFAOYSA-N 1 1 360.461 4.077 20 10 FICDMO Cc1noc([C@H]2CCC[N@@H+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)n1 ZINC000068962179 1124437163 /nfs/dbraw/zinc/43/71/63/1124437163.db2.gz CNLPHVUYBVXTPV-AWEZNQCLSA-N 1 1 367.449 4.088 20 10 FICDMO CCC[N@@H+](CC)Cc1ccc(-c2nc(Cc3ccc(N)cc3)no2)cc1 ZINC000843160148 1124957976 /nfs/dbraw/zinc/95/79/76/1124957976.db2.gz DYCQOLWJUCVWMT-UHFFFAOYSA-N 1 1 350.466 4.142 20 10 FICDMO Oc1ccccc1CN1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019361792 211217703 /nfs/dbraw/zinc/21/77/03/211217703.db2.gz WWXZPNJGLCBJPZ-UHFFFAOYSA-N 1 1 358.485 4.299 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000183007556 1125717543 /nfs/dbraw/zinc/71/75/43/1125717543.db2.gz DVRVETHXPAZGFI-GOSISDBHSA-N 1 1 363.461 4.074 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000183007535 1125717622 /nfs/dbraw/zinc/71/76/22/1125717622.db2.gz DVRVETHXPAZGFI-SFHVURJKSA-N 1 1 363.461 4.074 20 10 FICDMO Cc1noc(C)c1C[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000183002493 1125720495 /nfs/dbraw/zinc/72/04/95/1125720495.db2.gz RYZBXUZCMZTZHQ-UHFFFAOYSA-N 1 1 352.434 4.208 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1nc2ccccc2s1)C[C@@H]1CCCO1 ZINC000070976798 1125751640 /nfs/dbraw/zinc/75/16/40/1125751640.db2.gz VOXXERAYYFRQQC-INIZCTEOSA-N 1 1 354.475 4.183 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1nc2ccccc2s1)C[C@@H]1CCCO1 ZINC000070976798 1125751647 /nfs/dbraw/zinc/75/16/47/1125751647.db2.gz VOXXERAYYFRQQC-INIZCTEOSA-N 1 1 354.475 4.183 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000274832821 1080205589 /nfs/dbraw/zinc/20/55/89/1080205589.db2.gz MQGYAGDBIJWTEX-NWDGAFQWSA-N 1 1 357.385 4.002 20 10 FICDMO COc1ccc(N2CCC[N@@H+](C[C@@H]3CC[C@H](c4ccccc4)O3)CC2)cc1 ZINC001167107681 1080552326 /nfs/dbraw/zinc/55/23/26/1080552326.db2.gz GIJKPJSBNSJBSQ-XZOQPEGZSA-N 1 1 366.505 4.128 20 10 FICDMO C[C@@H]1C[C@@H]1C[N@H+]1CCc2c(Cl)c(O)c(O)cc2[C@@H](c2ccc(O)cc2)C1 ZINC001209433030 1080680411 /nfs/dbraw/zinc/68/04/11/1080680411.db2.gz SNHQFYQFCDYPFA-RVZJWNSFSA-N 1 1 373.880 4.103 20 10 FICDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cc(F)cc(F)c2[O-])cc1 ZINC001648795638 1080805206 /nfs/dbraw/zinc/80/52/06/1080805206.db2.gz SITGKIBEZYGJDH-OAHLLOKOSA-N 1 1 360.448 4.335 20 10 FICDMO Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])cc1F ZINC001648903808 1081359573 /nfs/dbraw/zinc/35/95/73/1081359573.db2.gz ZFWXHAFWJVVQAZ-UHFFFAOYSA-N 1 1 363.795 4.108 20 10 FICDMO CC[C@H]([NH2+][C@H](Cc1ccccc1)C(=O)N(CC)CC)c1ccc(F)cc1O ZINC000796664542 1083555494 /nfs/dbraw/zinc/55/54/94/1083555494.db2.gz YQVVHBFEEOJIAW-VQTJNVASSA-N 1 1 372.484 4.052 20 10 FICDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000179737079 1083612209 /nfs/dbraw/zinc/61/22/09/1083612209.db2.gz RSLZAJXFHVTHMZ-IBGZPJMESA-N 1 1 373.541 4.024 20 10 FICDMO CCC[N@@H+](CCOc1ccccc1Br)Cc1ccccc1O ZINC001167521852 1084439002 /nfs/dbraw/zinc/43/90/02/1084439002.db2.gz KPJXVUVYXWPDBT-UHFFFAOYSA-N 1 1 364.283 4.446 20 10 FICDMO C[N@H+](Cc1nccs1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000074724128 1084600967 /nfs/dbraw/zinc/60/09/67/1084600967.db2.gz NQIMKFDYLLRCMN-UHFFFAOYSA-N 1 1 363.280 4.396 20 10 FICDMO C[N@@H+](Cc1nccs1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000074724128 1084600978 /nfs/dbraw/zinc/60/09/78/1084600978.db2.gz NQIMKFDYLLRCMN-UHFFFAOYSA-N 1 1 363.280 4.396 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(C(=O)N(CC)CC)cc1)c1ccc(F)cc1O ZINC000796680660 1084859027 /nfs/dbraw/zinc/85/90/27/1084859027.db2.gz XOLPELARPSUAFM-LJQANCHMSA-N 1 1 358.457 4.254 20 10 FICDMO COc1ccc(C)cc1C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000756672798 1085255274 /nfs/dbraw/zinc/25/52/74/1085255274.db2.gz RSWVIBUSSRQGOT-NSHDSACASA-N 1 1 368.246 4.462 20 10 FICDMO CCC[N@H+]1CCC[C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 ZINC001625905087 1085944649 /nfs/dbraw/zinc/94/46/49/1085944649.db2.gz GXCLVGQNEBDICC-HXUWFJFHSA-N 1 1 371.569 4.194 20 10 FICDMO C[C@H]1CC(O)C[C@H](C)[NH+]1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000588564580 1086031944 /nfs/dbraw/zinc/03/19/44/1086031944.db2.gz QCFSPDUVHNLQDH-HOTGVXAUSA-N 1 1 366.465 4.274 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1nnc(C2CC2)n1C1CC1)C1CCCC1 ZINC000782929030 1088658395 /nfs/dbraw/zinc/65/83/95/1088658395.db2.gz ADTUQNHXSKMSQK-UHFFFAOYSA-N 1 1 352.482 4.141 20 10 FICDMO CC(C)N(C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2)C(C)C ZINC000435855117 1089975729 /nfs/dbraw/zinc/97/57/29/1089975729.db2.gz IHKRQAMVWMGRSN-UHFFFAOYSA-N 1 1 355.526 4.053 20 10 FICDMO CCCCc1nc(C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)cs1 ZINC000108094043 1092140437 /nfs/dbraw/zinc/14/04/37/1092140437.db2.gz NKDUSMXIJSYAJP-UHFFFAOYSA-N 1 1 359.539 4.207 20 10 FICDMO CCCCc1nc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)cs1 ZINC000108094043 1092140441 /nfs/dbraw/zinc/14/04/41/1092140441.db2.gz NKDUSMXIJSYAJP-UHFFFAOYSA-N 1 1 359.539 4.207 20 10 FICDMO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc(Br)ccc2O)cs1 ZINC000273368921 1096256575 /nfs/dbraw/zinc/25/65/75/1096256575.db2.gz CBGZECAFXZPXOO-ZJUUUORDSA-N 1 1 371.300 4.169 20 10 FICDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001168179544 1102022675 /nfs/dbraw/zinc/02/26/75/1102022675.db2.gz KYQFPZPWSYMRRF-KRWDZBQOSA-N 1 1 358.913 4.240 20 10 FICDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2Cl)o1)Cc1ccccc1O ZINC000109772508 1102177627 /nfs/dbraw/zinc/17/76/27/1102177627.db2.gz ZQYDSBHYYWWLIH-UHFFFAOYSA-N 1 1 364.232 4.381 20 10 FICDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2Cl)o1)Cc1ccccc1O ZINC000109772508 1102177637 /nfs/dbraw/zinc/17/76/37/1102177637.db2.gz ZQYDSBHYYWWLIH-UHFFFAOYSA-N 1 1 364.232 4.381 20 10 FICDMO Cc1cc(CN2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193583 1102273222 /nfs/dbraw/zinc/27/32/22/1102273222.db2.gz RSRQMQSGINIXCZ-UXHICEINSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@H+]2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193583 1102273236 /nfs/dbraw/zinc/27/32/36/1102273236.db2.gz RSRQMQSGINIXCZ-UXHICEINSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@@H+]2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193583 1102273249 /nfs/dbraw/zinc/27/32/49/1102273249.db2.gz RSRQMQSGINIXCZ-UXHICEINSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(CN2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193584 1102273439 /nfs/dbraw/zinc/27/34/39/1102273439.db2.gz RSRQMQSGINIXCZ-VQTJNVASSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@H+]2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193584 1102273450 /nfs/dbraw/zinc/27/34/50/1102273450.db2.gz RSRQMQSGINIXCZ-VQTJNVASSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@@H+]2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193584 1102273460 /nfs/dbraw/zinc/27/34/60/1102273460.db2.gz RSRQMQSGINIXCZ-VQTJNVASSA-N 1 1 351.538 4.156 20 10 FICDMO C[C@@H](COCc1ccccc1)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001167983450 1102885132 /nfs/dbraw/zinc/88/51/32/1102885132.db2.gz MBCJPUNRLUWSGX-DENIHFKCSA-N 1 1 369.505 4.226 20 10 FICDMO C[C@H]([NH2+]C[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1ccc(F)cc1O ZINC000760036240 1104894513 /nfs/dbraw/zinc/89/45/13/1104894513.db2.gz DTUIMZXMMUAHTQ-DLPLYFIVSA-N 1 1 361.432 4.095 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3C[C@@H](C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000827986278 1107515173 /nfs/dbraw/zinc/51/51/73/1107515173.db2.gz SDSZHPHJAOAKPA-WZONZLPQSA-N 1 1 350.506 4.495 20 10 FICDMO C[C@@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000527930478 1109869873 /nfs/dbraw/zinc/86/98/73/1109869873.db2.gz JYHQQTDIHLZDNZ-AMIZOPFISA-N 1 1 368.186 4.350 20 10 FICDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)Cc1c(O)ccc2ccncc21 ZINC000027533692 1113690841 /nfs/dbraw/zinc/69/08/41/1113690841.db2.gz IKHCLYTUMQTBCE-UHFFFAOYSA-N 1 1 357.797 4.134 20 10 FICDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)Cc1c(O)ccc2ccncc21 ZINC000027533692 1113690844 /nfs/dbraw/zinc/69/08/44/1113690844.db2.gz IKHCLYTUMQTBCE-UHFFFAOYSA-N 1 1 357.797 4.134 20 10 FICDMO CC(C)[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074942 1122068985 /nfs/dbraw/zinc/06/89/85/1122068985.db2.gz MHGKLPCEHOLNBB-IFMALSPDSA-N 1 1 371.569 4.144 20 10 FICDMO CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000917470184 1122327975 /nfs/dbraw/zinc/32/79/75/1122327975.db2.gz QRHWPFARVHBODM-SFHVURJKSA-N 1 1 360.542 4.088 20 10 FICDMO CCN(CC)c1ccc(C[N@H+](C)Cc2csc(-c3cnn(C)c3)n2)cc1 ZINC000919647815 1123069858 /nfs/dbraw/zinc/06/98/58/1123069858.db2.gz SWUFNJISUVRQRA-UHFFFAOYSA-N 1 1 369.538 4.022 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2csc(-c3cnn(C)c3)n2)cc1 ZINC000919647815 1123069864 /nfs/dbraw/zinc/06/98/64/1123069864.db2.gz SWUFNJISUVRQRA-UHFFFAOYSA-N 1 1 369.538 4.022 20 10 FICDMO COc1ccc(N2CCC[N@@H+]([C@H](C)c3ncc(C(C)(C)C)o3)CC2)cc1 ZINC000175113149 1123734156 /nfs/dbraw/zinc/73/41/56/1123734156.db2.gz XLGBNVOHWKSGOP-MRXNPFEDSA-N 1 1 357.498 4.254 20 10 FICDMO COc1ccc(N2CCC[N@H+]([C@H](C)c3ncc(C(C)(C)C)o3)CC2)cc1 ZINC000175113149 1123734160 /nfs/dbraw/zinc/73/41/60/1123734160.db2.gz XLGBNVOHWKSGOP-MRXNPFEDSA-N 1 1 357.498 4.254 20 10 FICDMO Cc1cccc(C[N@H+]2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1O ZINC000179958048 1124163051 /nfs/dbraw/zinc/16/30/51/1124163051.db2.gz CJPJHGRHKKPZBD-QGZVFWFLSA-N 1 1 367.424 4.269 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(C)cc3)cc2F)CC1 ZINC000765850202 1124206488 /nfs/dbraw/zinc/20/64/88/1124206488.db2.gz SFUCTVDOOSPPLJ-SFHVURJKSA-N 1 1 355.501 4.127 20 10 FICDMO CCN(C)c1ccc([C@@H](C)NCC2([NH+]3CCC(OC)CC3)CCCC2)cc1 ZINC000765859872 1124292128 /nfs/dbraw/zinc/29/21/28/1124292128.db2.gz LZECTRNPYUTHEH-LJQANCHMSA-N 1 1 373.585 4.217 20 10 FICDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275322823 1080758836 /nfs/dbraw/zinc/75/88/36/1080758836.db2.gz LLVORQDPUQHWOZ-DTWKUNHWSA-N 1 1 356.289 4.035 20 10 FICDMO Cc1cccc(OC[C@@H](O)C[N@@H+](Cc2ccc(N(C)C)c(C)c2)C(C)C)c1 ZINC001167487940 1082982466 /nfs/dbraw/zinc/98/24/66/1082982466.db2.gz ULRLUELQCJTGJG-NRFANRHFSA-N 1 1 370.537 4.020 20 10 FICDMO COc1ccccc1-c1noc([C@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)n1 ZINC000276695630 1083029331 /nfs/dbraw/zinc/02/93/31/1083029331.db2.gz AASWTAPRBOHALV-LBPRGKRZSA-N 1 1 373.840 4.263 20 10 FICDMO CCC[N@@H+](CC(=O)N(C1CC1)C1CCC(C)CC1)Cc1ccccc1O ZINC001167521753 1084439412 /nfs/dbraw/zinc/43/94/12/1084439412.db2.gz ILFBWHBYFCJSOC-UHFFFAOYSA-N 1 1 358.526 4.174 20 10 FICDMO C[C@H](c1ccccc1)[N@H+](CC(=O)Nc1nccs1)Cc1ccccc1O ZINC000176676855 1085070132 /nfs/dbraw/zinc/07/01/32/1085070132.db2.gz YLASWZAJGWYAHX-OAHLLOKOSA-N 1 1 367.474 4.051 20 10 FICDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)Nc1nccs1)Cc1ccccc1O ZINC000176676855 1085070143 /nfs/dbraw/zinc/07/01/43/1085070143.db2.gz YLASWZAJGWYAHX-OAHLLOKOSA-N 1 1 367.474 4.051 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)c1 ZINC000312948771 1085140694 /nfs/dbraw/zinc/14/06/94/1085140694.db2.gz RHNDWCSOVIXDHB-UYAOXDASSA-N 1 1 368.521 4.354 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC2(C)CCCC2)C1 ZINC001126053513 1085484149 /nfs/dbraw/zinc/48/41/49/1085484149.db2.gz CYULJTRPUISJHS-UHFFFAOYSA-N 1 1 367.537 4.104 20 10 FICDMO COc1cc(Cl)cc(C[NH2+]C[C@]2(C)CCN(Cc3ccccc3)C2)c1O ZINC000311356678 1088591525 /nfs/dbraw/zinc/59/15/25/1088591525.db2.gz DHAPGKAEMIGRPP-NRFANRHFSA-N 1 1 374.912 4.056 20 10 FICDMO C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc2ccccc2c1[O-] ZINC000185056557 1090501151 /nfs/dbraw/zinc/50/11/51/1090501151.db2.gz SITGNVLNZGDMCB-KRWDZBQOSA-N 1 1 364.489 4.337 20 10 FICDMO CCOc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1OC(F)F ZINC000185695992 1090566313 /nfs/dbraw/zinc/56/63/13/1090566313.db2.gz SOCDCBRBUZKJRQ-LLVKDONJSA-N 1 1 355.356 4.382 20 10 FICDMO Cn1c(Cl)nc(Cl)c1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000124086750 1091699144 /nfs/dbraw/zinc/69/91/44/1091699144.db2.gz GHMFMEIJYDKGSQ-UHFFFAOYSA-N 1 1 354.281 4.377 20 10 FICDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccn(-c3ccc(OC)cc3)n2)cc1 ZINC000178710846 1093144805 /nfs/dbraw/zinc/14/48/05/1093144805.db2.gz QKKIULMEQUETFO-KRWDZBQOSA-N 1 1 364.493 4.188 20 10 FICDMO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCNC2=O)cc1)c1ccc(F)cc1O ZINC000291164434 1100248347 /nfs/dbraw/zinc/24/83/47/1100248347.db2.gz IZDKPEKFGKAONS-KUHUBIRLSA-N 1 1 371.456 4.253 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186205325 1101758574 /nfs/dbraw/zinc/75/85/74/1101758574.db2.gz LFXZSSATROWGEC-SPLOXXLWSA-N 1 1 352.409 4.375 20 10 FICDMO COc1cc(C)cc(C[NH2+][C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c1O ZINC000894543499 1102553199 /nfs/dbraw/zinc/55/31/99/1102553199.db2.gz RZSCOMRHISYJRS-CYBMUJFWSA-N 1 1 371.412 4.058 20 10 FICDMO C[C@H](Cc1cccc(Br)c1)[NH2+]Cc1cc(F)cc(F)c1O ZINC001648986706 1102586585 /nfs/dbraw/zinc/58/65/85/1102586585.db2.gz WBGJLXBWWLQISL-SNVBAGLBSA-N 1 1 356.210 4.154 20 10 FICDMO C[C@@H]([NH2+][C@@H](C)c1ncc(Br)cn1)c1ccc(Cl)cc1O ZINC000841753244 1103249876 /nfs/dbraw/zinc/24/98/76/1103249876.db2.gz FQVYFNYLIBIKCW-BDAKNGLRSA-N 1 1 356.651 4.010 20 10 FICDMO CN(Cc1ccc(N2CCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995697 1104542037 /nfs/dbraw/zinc/54/20/37/1104542037.db2.gz OHRKDXGVABXHJL-AIZNXBIQSA-N 1 1 353.554 4.124 20 10 FICDMO CN(Cc1ccc(N2CCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995697 1104542045 /nfs/dbraw/zinc/54/20/45/1104542045.db2.gz OHRKDXGVABXHJL-AIZNXBIQSA-N 1 1 353.554 4.124 20 10 FICDMO C[C@H]([NH2+]C[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1ccc(F)cc1O ZINC000760036243 1104894279 /nfs/dbraw/zinc/89/42/79/1104894279.db2.gz DTUIMZXMMUAHTQ-WVFSVQOHSA-N 1 1 361.432 4.095 20 10 FICDMO C[N@@H+](Cc1cc2cc(F)ccc2o1)Cc1ccc(N2CCOCC2)cc1 ZINC000121294256 1106854218 /nfs/dbraw/zinc/85/42/18/1106854218.db2.gz NNGQSMXSJYNCRJ-UHFFFAOYSA-N 1 1 354.425 4.041 20 10 FICDMO Cc1cc(O)c(C[N@H+](C)C2CCN(CCC(F)(F)F)CC2)c(Cl)c1 ZINC000840952557 1107919693 /nfs/dbraw/zinc/91/96/93/1107919693.db2.gz FASBFAXOFUXXCX-UHFFFAOYSA-N 1 1 364.839 4.203 20 10 FICDMO Cc1cc(C[N@@H+](Cc2ccccc2)CC2(O)CCCC2)ccc1N(C)C ZINC001168114551 1110223743 /nfs/dbraw/zinc/22/37/43/1110223743.db2.gz PEAGTXABRSPXKR-UHFFFAOYSA-N 1 1 352.522 4.368 20 10 FICDMO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000479434742 1112021792 /nfs/dbraw/zinc/02/17/92/1112021792.db2.gz FFOTUGSVBNYXSR-JOCHJYFZSA-N 1 1 362.452 4.239 20 10 FICDMO Cc1cc(-c2nnc(C[N@@H+](Cc3ccc(N(C)C)cc3)C3CC3)o2)c(C)o1 ZINC000760815440 1115047200 /nfs/dbraw/zinc/04/72/00/1115047200.db2.gz AYGDNXILRYGBAZ-UHFFFAOYSA-N 1 1 366.465 4.177 20 10 FICDMO Cc1cc(-c2nnc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)o2)c(C)o1 ZINC000760815440 1115047204 /nfs/dbraw/zinc/04/72/04/1115047204.db2.gz AYGDNXILRYGBAZ-UHFFFAOYSA-N 1 1 366.465 4.177 20 10 FICDMO Cc1cc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c(C)n1-c1ccccc1C ZINC000761147142 1115568936 /nfs/dbraw/zinc/56/89/36/1115568936.db2.gz XQTFMPNLOWASRS-UHFFFAOYSA-N 1 1 365.521 4.103 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](CCCO)Cc2cccc(Cl)c2)c1O ZINC000761206301 1115622189 /nfs/dbraw/zinc/62/21/89/1115622189.db2.gz VRCVLOSEWFVWCO-UHFFFAOYSA-N 1 1 370.276 4.092 20 10 FICDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)Nc2c(C)cccc2C)cc1 ZINC000172876104 1115995788 /nfs/dbraw/zinc/99/57/88/1115995788.db2.gz LVKQCTDXAKQPRJ-UHFFFAOYSA-N 1 1 353.510 4.220 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2C)cc1 ZINC000172876104 1115995790 /nfs/dbraw/zinc/99/57/90/1115995790.db2.gz LVKQCTDXAKQPRJ-UHFFFAOYSA-N 1 1 353.510 4.220 20 10 FICDMO CN(C)c1ccc(C[N@H+](Cc2nc(-c3cccs3)no2)C2CC2)cc1 ZINC000917074046 1122067081 /nfs/dbraw/zinc/06/70/81/1122067081.db2.gz NZZWCXFTEXDFST-UHFFFAOYSA-N 1 1 354.479 4.029 20 10 FICDMO CN(C)c1ccc(C[N@@H+](Cc2nc(-c3cccs3)no2)C2CC2)cc1 ZINC000917074046 1122067085 /nfs/dbraw/zinc/06/70/85/1122067085.db2.gz NZZWCXFTEXDFST-UHFFFAOYSA-N 1 1 354.479 4.029 20 10 FICDMO CCN(C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)c1ccccc1 ZINC000917075414 1122070259 /nfs/dbraw/zinc/07/02/59/1122070259.db2.gz VMHPRJWGCBTDAM-UHFFFAOYSA-N 1 1 353.510 4.016 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2ccc(OC)c(F)c2)c(O)c(C(C)(C)C)c1 ZINC000917358038 1122279744 /nfs/dbraw/zinc/27/97/44/1122279744.db2.gz SIHUSCCAQPVHDQ-UHFFFAOYSA-N 1 1 361.457 4.478 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCN(C(=O)OC(C)(C)C)CC2)cc1C(C)C ZINC000917488178 1122333741 /nfs/dbraw/zinc/33/37/41/1122333741.db2.gz MRVUJAGHSZGXAK-UHFFFAOYSA-N 1 1 362.514 4.267 20 10 FICDMO COc1ccc(CCC[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)cc1 ZINC000918733047 1122765656 /nfs/dbraw/zinc/76/56/56/1122765656.db2.gz UVXCJQFAJKNOOK-UHFFFAOYSA-N 1 1 357.494 4.469 20 10 FICDMO Oc1cc2c(cc1C[N@@H+]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CCC2 ZINC000918736716 1122766974 /nfs/dbraw/zinc/76/69/74/1122766974.db2.gz XNGKWZTUONXOKC-OKILXGFUSA-N 1 1 367.333 4.444 20 10 FICDMO CCC[N@@H+](Cc1cccc(C)c1O)C1CCN(C(=O)c2ccccc2)CC1 ZINC000179935568 1124147912 /nfs/dbraw/zinc/14/79/12/1124147912.db2.gz YHNZFJWDPQEQSC-UHFFFAOYSA-N 1 1 366.505 4.217 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(C)cc43)cc2F)CC1 ZINC000765853938 1124240917 /nfs/dbraw/zinc/24/09/17/1124240917.db2.gz YPRPBXMYSYRZLE-JOCHJYFZSA-N 1 1 367.512 4.053 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2sc(C(C)C)nc2C)cc1OC ZINC000180617724 1124379057 /nfs/dbraw/zinc/37/90/57/1124379057.db2.gz XKOJEGORNOHFCF-CYBMUJFWSA-N 1 1 364.511 4.491 20 10 FICDMO C[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@@]1(O)C(F)(F)F ZINC001143104390 1125263020 /nfs/dbraw/zinc/26/30/20/1125263020.db2.gz SSDSUDYFIATKSY-ACJLOTCBSA-N 1 1 359.432 4.215 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000183028698 1125722433 /nfs/dbraw/zinc/72/24/33/1125722433.db2.gz JQWFRKPYGDQATN-FQEVSTJZSA-N 1 1 363.461 4.422 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000183028698 1125722439 /nfs/dbraw/zinc/72/24/39/1125722439.db2.gz JQWFRKPYGDQATN-FQEVSTJZSA-N 1 1 363.461 4.422 20 10 FICDMO CC(C)(C)c1ncc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)s1 ZINC000160195385 1079586944 /nfs/dbraw/zinc/58/69/44/1079586944.db2.gz QMMKNXKEDRVQHV-MRXNPFEDSA-N 1 1 360.523 4.327 20 10 FICDMO COc1cc(O)c(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000160272704 1080701195 /nfs/dbraw/zinc/70/11/95/1080701195.db2.gz KVJWYAZLCOZTPI-VBKZILBWSA-N 1 1 359.491 4.088 20 10 FICDMO CN(Cc1cccs1)c1ccc(CN[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC001648819245 1081244522 /nfs/dbraw/zinc/24/45/22/1081244522.db2.gz UFKYLXPWXKJDTB-SFTDATJTSA-N 1 1 355.551 4.101 20 10 FICDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@H]2CCN3CCCC[C@@H]23)cc1 ZINC001648819245 1081244534 /nfs/dbraw/zinc/24/45/34/1081244534.db2.gz UFKYLXPWXKJDTB-SFTDATJTSA-N 1 1 355.551 4.101 20 10 FICDMO CC[C@@H]([NH2+]Cc1ccc(OC(F)F)c(OC)c1)c1ccc(F)cc1O ZINC000796675294 1081623138 /nfs/dbraw/zinc/62/31/38/1081623138.db2.gz LRGJOEMAKJHPLN-CQSZACIVSA-N 1 1 355.356 4.382 20 10 FICDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1 ZINC000588405944 1082439832 /nfs/dbraw/zinc/43/98/32/1082439832.db2.gz JARGEPDPPCEHKM-LJEUOOAZSA-N 1 1 366.461 4.124 20 10 FICDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469549 1082654748 /nfs/dbraw/zinc/65/47/48/1082654748.db2.gz ZGEKEZRRTKRIPZ-TZIWHRDSSA-N 1 1 350.506 4.210 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC001167473215 1082701166 /nfs/dbraw/zinc/70/11/66/1082701166.db2.gz GKWOXCFMFCYSKQ-IPELMVKDSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC001167473215 1082701170 /nfs/dbraw/zinc/70/11/70/1082701170.db2.gz GKWOXCFMFCYSKQ-IPELMVKDSA-N 1 1 365.901 4.274 20 10 FICDMO CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC001167473215 1082701175 /nfs/dbraw/zinc/70/11/75/1082701175.db2.gz GKWOXCFMFCYSKQ-IPELMVKDSA-N 1 1 365.901 4.274 20 10 FICDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H](C)c1cccc(OC)c1 ZINC000179470095 1083472121 /nfs/dbraw/zinc/47/21/21/1083472121.db2.gz FVECRKGGPWRFSN-GOSISDBHSA-N 1 1 354.494 4.115 20 10 FICDMO CC[NH+](CC)CCC[C@H](C)N1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001167827257 1086620562 /nfs/dbraw/zinc/62/05/62/1086620562.db2.gz VHSWOIZMABPXMY-KRWDZBQOSA-N 1 1 357.542 4.056 20 10 FICDMO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278929954 1086639976 /nfs/dbraw/zinc/63/99/76/1086639976.db2.gz MKVSVJJRLIZLDK-ZETCQYMHSA-N 1 1 362.348 4.060 20 10 FICDMO Cc1nn(C(C)(C)C)c(C)c1C[NH2+]Cc1cccc(Br)c1O ZINC000278413170 1086954264 /nfs/dbraw/zinc/95/42/64/1086954264.db2.gz QHJJQXPWPNMWLS-UHFFFAOYSA-N 1 1 366.303 4.013 20 10 FICDMO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1[O-] ZINC000756342560 1089958151 /nfs/dbraw/zinc/95/81/51/1089958151.db2.gz SJJAUSKHHBMIFO-KGLIPLIRSA-N 1 1 357.336 4.316 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CCS[C@H]4CCCC[C@H]43)cc2)CC1 ZINC000828025107 1091021869 /nfs/dbraw/zinc/02/18/69/1091021869.db2.gz DKSHYEYCVDBZQS-RTWAWAEBSA-N 1 1 360.567 4.162 20 10 FICDMO C[C@@H]([NH2+]Cc1ncnn1-c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000279488828 1091908296 /nfs/dbraw/zinc/90/82/96/1091908296.db2.gz LNGOUKONMYOOKH-GOSISDBHSA-N 1 1 361.493 4.108 20 10 FICDMO C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1c(O)cccc1F ZINC000896636582 1094868672 /nfs/dbraw/zinc/86/86/72/1094868672.db2.gz GAIIGNYJDYXNHV-NSHDSACASA-N 1 1 370.346 4.057 20 10 FICDMO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Br)cc2O)cs1 ZINC000273595065 1096276928 /nfs/dbraw/zinc/27/69/28/1096276928.db2.gz QFFIFZAOOKYDDX-ZJUUUORDSA-N 1 1 371.300 4.169 20 10 FICDMO CC(C)CCOC1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000179332834 1099833604 /nfs/dbraw/zinc/83/36/04/1099833604.db2.gz UATBNHGBAYHFKD-UHFFFAOYSA-N 1 1 356.304 4.182 20 10 FICDMO COc1ccccc1[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccccn1 ZINC000186193500 1101757666 /nfs/dbraw/zinc/75/76/66/1101757666.db2.gz ZTENJZSYVUHQDV-SZNDQCEHSA-N 1 1 352.409 4.375 20 10 FICDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000048796007 1102865634 /nfs/dbraw/zinc/86/56/34/1102865634.db2.gz SMTIDEFVXGBLEI-LBPRGKRZSA-N 1 1 350.256 4.323 20 10 FICDMO C[C@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000527930486 1109869790 /nfs/dbraw/zinc/86/97/90/1109869790.db2.gz JYHQQTDIHLZDNZ-SDBXPKJASA-N 1 1 368.186 4.350 20 10 FICDMO CCOC(=O)c1c[nH+]ccc1N1CC=C(c2c[nH]c3cc(C)ccc32)CC1 ZINC000479364965 1112001504 /nfs/dbraw/zinc/00/15/04/1112001504.db2.gz JPGDNTFMOXVFSL-UHFFFAOYSA-N 1 1 361.445 4.342 20 10 FICDMO Cc1cc(C)c(O)c(C[N@H+]2CCCN(C(=O)c3cccc(Cl)c3)CC2)c1 ZINC000164201930 1114443588 /nfs/dbraw/zinc/44/35/88/1114443588.db2.gz ZKNCOMXEHDVBHG-UHFFFAOYSA-N 1 1 372.896 4.011 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@H]4[C@H](CCCN4C4CC4)C3)c2c1 ZINC000157960341 1115412613 /nfs/dbraw/zinc/41/26/13/1115412613.db2.gz DGLPFROKKJJKPK-VGSWGCGISA-N 1 1 366.505 4.003 20 10 FICDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H]4[C@H](CCCN4C4CC4)C3)c2c1 ZINC000157960341 1115412615 /nfs/dbraw/zinc/41/26/15/1115412615.db2.gz DGLPFROKKJJKPK-VGSWGCGISA-N 1 1 366.505 4.003 20 10 FICDMO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1O ZINC000761194747 1115613210 /nfs/dbraw/zinc/61/32/10/1115613210.db2.gz HGYFTTUILYAOAG-SFHVURJKSA-N 1 1 361.869 4.235 20 10 FICDMO CCOC(=O)CC[N@@H+](Cc1cccnc1)Cc1cc(C(C)C)c(C)cc1O ZINC000060320093 1115616032 /nfs/dbraw/zinc/61/60/32/1115616032.db2.gz ULJWDHQUEIOKOA-UHFFFAOYSA-N 1 1 370.493 4.174 20 10 FICDMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000172676992 1115972016 /nfs/dbraw/zinc/97/20/16/1115972016.db2.gz KHGOZOLDAASCMQ-INIZCTEOSA-N 1 1 367.518 4.326 20 10 FICDMO COc1cccc(C[N@@H+]2CC=C(c3cccc(Br)c3)CC2)c1O ZINC000762792032 1120963438 /nfs/dbraw/zinc/96/34/38/1120963438.db2.gz ZUYHJYNEHWDEBO-UHFFFAOYSA-N 1 1 374.278 4.453 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915683237 1121020334 /nfs/dbraw/zinc/02/03/34/1121020334.db2.gz YZSBFLYTDHWESZ-ISKFKSNPSA-N 1 1 363.549 4.430 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000915683237 1121020341 /nfs/dbraw/zinc/02/03/41/1121020341.db2.gz YZSBFLYTDHWESZ-ISKFKSNPSA-N 1 1 363.549 4.430 20 10 FICDMO FC(F)(F)CO[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000916836701 1121876721 /nfs/dbraw/zinc/87/67/21/1121876721.db2.gz KJSSRVVOUCPMRS-SFHVURJKSA-N 1 1 356.432 4.220 20 10 FICDMO CCN(Cc1ccccc1)C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074827 1122068350 /nfs/dbraw/zinc/06/83/50/1122068350.db2.gz HIFXVNNQGMYQSP-UHFFFAOYSA-N 1 1 367.537 4.012 20 10 FICDMO CCc1ccccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074867 1122069261 /nfs/dbraw/zinc/06/92/61/1122069261.db2.gz IXTXDVZBXJEEFD-UHFFFAOYSA-N 1 1 353.510 4.164 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccc(-n2cccn2)c1 ZINC000154710407 1122634511 /nfs/dbraw/zinc/63/45/11/1122634511.db2.gz QWPUHWFLUJYWFX-UHFFFAOYSA-N 1 1 359.429 4.373 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H]3CCCc4sccc43)cc2F)CC1 ZINC000765853010 1124224969 /nfs/dbraw/zinc/22/49/69/1124224969.db2.gz OCHRMVFEBSAYEG-IBGZPJMESA-N 1 1 373.541 4.196 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nnc(-c3ccc(C)cc3)o2)c1 ZINC000182428369 1125476042 /nfs/dbraw/zinc/47/60/42/1125476042.db2.gz OEKNDOQYKDPGTI-ZIAGYGMSSA-N 1 1 353.422 4.171 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1cnc(C2CCC2)s1)C[C@H]1CCCO1 ZINC000160203704 1079603614 /nfs/dbraw/zinc/60/36/14/1079603614.db2.gz DYLZAQAAKVTFQE-QGZVFWFLSA-N 1 1 358.507 4.297 20 10 FICDMO C[N@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@@H]1CCCOC1 ZINC000255033051 1080441950 /nfs/dbraw/zinc/44/19/50/1080441950.db2.gz PKBPFVLKVKMMJO-KRWDZBQOSA-N 1 1 366.465 4.399 20 10 FICDMO C[N@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@@H]1CCOC1 ZINC000255052082 1080673156 /nfs/dbraw/zinc/67/31/56/1080673156.db2.gz BSQBMQZPXAXHJQ-INIZCTEOSA-N 1 1 352.438 4.009 20 10 FICDMO CN(Cc1cccs1)c1ccc(CN[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC001648819244 1081244815 /nfs/dbraw/zinc/24/48/15/1081244815.db2.gz UFKYLXPWXKJDTB-RTWAWAEBSA-N 1 1 355.551 4.101 20 10 FICDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@@H]2CCN3CCCC[C@@H]23)cc1 ZINC001648819244 1081244841 /nfs/dbraw/zinc/24/48/41/1081244841.db2.gz UFKYLXPWXKJDTB-RTWAWAEBSA-N 1 1 355.551 4.101 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@]2(N(C)C)CCC[C@@H](C)C2)c1 ZINC001648895197 1081352971 /nfs/dbraw/zinc/35/29/71/1081352971.db2.gz FYONUMSMIMQWJN-ACJLOTCBSA-N 1 1 369.347 4.063 20 10 FICDMO COc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)c(O)c1OC ZINC000891515287 1082909136 /nfs/dbraw/zinc/90/91/36/1082909136.db2.gz FDTWGOICTNSZPE-GFCCVEGCSA-N 1 1 358.463 4.212 20 10 FICDMO COc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)c(O)c1OC ZINC000891515287 1082909138 /nfs/dbraw/zinc/90/91/38/1082909138.db2.gz FDTWGOICTNSZPE-GFCCVEGCSA-N 1 1 358.463 4.212 20 10 FICDMO Cc1ccc(C)n1-c1ccc(C(=O)N2CC[N@@H+](C)Cc3ccccc32)cc1 ZINC000728833850 1086012846 /nfs/dbraw/zinc/01/28/46/1086012846.db2.gz LIXADIWAWSQNTG-UHFFFAOYSA-N 1 1 359.473 4.186 20 10 FICDMO Cc1ccc(C)n1-c1ccc(C(=O)N2CC[N@H+](C)Cc3ccccc32)cc1 ZINC000728833850 1086012857 /nfs/dbraw/zinc/01/28/57/1086012857.db2.gz LIXADIWAWSQNTG-UHFFFAOYSA-N 1 1 359.473 4.186 20 10 FICDMO C[C@@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1cc(Cl)c(Cl)cc1O ZINC000278227063 1086631189 /nfs/dbraw/zinc/63/11/89/1086631189.db2.gz JSMHJUMQLHXTCN-LLVKDONJSA-N 1 1 367.276 4.252 20 10 FICDMO CC(C)N(C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2)C1CCC1 ZINC000435853223 1089974376 /nfs/dbraw/zinc/97/43/76/1089974376.db2.gz BOPNKYQTNYPFJI-UHFFFAOYSA-N 1 1 367.537 4.197 20 10 FICDMO Cc1cscc1NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000435905224 1089995985 /nfs/dbraw/zinc/99/59/85/1089995985.db2.gz DOISWUWGCXLDQW-UHFFFAOYSA-N 1 1 367.518 4.416 20 10 FICDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ncc(Br)s1 ZINC000179219990 1099466035 /nfs/dbraw/zinc/46/60/35/1099466035.db2.gz CMFQYLYGTCCNEZ-LLVKDONJSA-N 1 1 366.328 4.139 20 10 FICDMO Cn1cccc1C[N@@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC000760408837 1101961122 /nfs/dbraw/zinc/96/11/22/1101961122.db2.gz UXQNQKAEVURBHX-UHFFFAOYSA-N 1 1 359.267 4.278 20 10 FICDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001168179551 1102022040 /nfs/dbraw/zinc/02/20/40/1102022040.db2.gz KYQFPZPWSYMRRF-QGZVFWFLSA-N 1 1 358.913 4.240 20 10 FICDMO C[N@@H+](CCC(=O)Nc1ccccc1F)Cc1ccc(N2CCCCC2)cc1 ZINC000054428416 1102236135 /nfs/dbraw/zinc/23/61/35/1102236135.db2.gz YPWCYERTQKGEHU-UHFFFAOYSA-N 1 1 369.484 4.277 20 10 FICDMO Cc1cc(CN2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193582 1102274339 /nfs/dbraw/zinc/27/43/39/1102274339.db2.gz RSRQMQSGINIXCZ-PMACEKPBSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@H+]2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193582 1102274348 /nfs/dbraw/zinc/27/43/48/1102274348.db2.gz RSRQMQSGINIXCZ-PMACEKPBSA-N 1 1 351.538 4.156 20 10 FICDMO Cc1cc(C[N@@H+]2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193582 1102274359 /nfs/dbraw/zinc/27/43/59/1102274359.db2.gz RSRQMQSGINIXCZ-PMACEKPBSA-N 1 1 351.538 4.156 20 10 FICDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001167984667 1103214244 /nfs/dbraw/zinc/21/42/44/1103214244.db2.gz VNSRXORLRPDMST-QNWVGRARSA-N 1 1 367.489 4.294 20 10 FICDMO C[N@@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(N2CCOCC2)cc1 ZINC000121299692 1107008216 /nfs/dbraw/zinc/00/82/16/1107008216.db2.gz HAVILTHFKLFMKU-UHFFFAOYSA-N 1 1 371.550 4.269 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(-c2ccccn2)c1 ZINC000121314651 1107692866 /nfs/dbraw/zinc/69/28/66/1107692866.db2.gz GLBDVQRJDQSKON-UHFFFAOYSA-N 1 1 373.500 4.217 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000527775095 1109826455 /nfs/dbraw/zinc/82/64/55/1109826455.db2.gz YBYKHSYSMWULJW-QGZVFWFLSA-N 1 1 361.283 4.489 20 10 FICDMO CCC[N@@H+](Cc1ccccc1O)Cc1ncc(Br)cc1F ZINC000529525971 1110283751 /nfs/dbraw/zinc/28/37/51/1110283751.db2.gz OMBGGWPUMUMGAP-UHFFFAOYSA-N 1 1 353.235 4.101 20 10 FICDMO Cc1cccc(C)c1C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000761981131 1120614050 /nfs/dbraw/zinc/61/40/50/1120614050.db2.gz GOCCROQJHMSYRE-SFHVURJKSA-N 1 1 372.896 4.057 20 10 FICDMO CCc1nnc([C@H](C)[NH2+]Cc2ccc(N(CC)Cc3ccccc3)cc2)[nH]1 ZINC000762626745 1120941131 /nfs/dbraw/zinc/94/11/31/1120941131.db2.gz HXINRAYQEFTBOJ-KRWDZBQOSA-N 1 1 363.509 4.244 20 10 FICDMO COc1cc(C)cc(C[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c1O ZINC000916567691 1121551356 /nfs/dbraw/zinc/55/13/56/1121551356.db2.gz NCGRCECEPKYQFS-UHFFFAOYSA-N 1 1 369.461 4.383 20 10 FICDMO C[N@H+](CC(=O)Nc1cc(F)cc(F)c1)Cc1ccc(N2CCCCC2)cc1 ZINC000917019400 1122007798 /nfs/dbraw/zinc/00/77/98/1122007798.db2.gz DWGSZXIXJDOHTP-UHFFFAOYSA-N 1 1 373.447 4.026 20 10 FICDMO C[N@@H+](CC(=O)Nc1cc(F)cc(F)c1)Cc1ccc(N2CCCCC2)cc1 ZINC000917019400 1122007804 /nfs/dbraw/zinc/00/78/04/1122007804.db2.gz DWGSZXIXJDOHTP-UHFFFAOYSA-N 1 1 373.447 4.026 20 10 FICDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1F ZINC000917074648 1122068640 /nfs/dbraw/zinc/06/86/40/1122068640.db2.gz FITTVWVWOQSHHN-UHFFFAOYSA-N 1 1 357.473 4.049 20 10 FICDMO CC(C)[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074945 1122069117 /nfs/dbraw/zinc/06/91/17/1122069117.db2.gz MHGKLPCEHOLNBB-UNMCSNQZSA-N 1 1 371.569 4.144 20 10 FICDMO COc1ccc2ccc(O)c(C[N@H+](C)Cc3ccn(-c4ccccc4)n3)c2c1 ZINC000917480969 1122324442 /nfs/dbraw/zinc/32/44/42/1122324442.db2.gz SPKUHQWGQKRXTP-UHFFFAOYSA-N 1 1 373.456 4.372 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3ccn(-c4ccccc4)n3)c2c1 ZINC000917480969 1122324445 /nfs/dbraw/zinc/32/44/45/1122324445.db2.gz SPKUHQWGQKRXTP-UHFFFAOYSA-N 1 1 373.456 4.372 20 10 FICDMO COc1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cc(OC)c1 ZINC000154716560 1122631647 /nfs/dbraw/zinc/63/16/47/1122631647.db2.gz POGKTLVJZDRIHY-UHFFFAOYSA-N 1 1 353.418 4.205 20 10 FICDMO CC(=O)Nc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000154730287 1122656322 /nfs/dbraw/zinc/65/63/22/1122656322.db2.gz RHAYRIFZBFZFFF-UHFFFAOYSA-N 1 1 350.418 4.146 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)cc(OC)c1 ZINC000919957651 1123284162 /nfs/dbraw/zinc/28/41/62/1123284162.db2.gz UJLVDZUNIYPIDN-UHFFFAOYSA-N 1 1 359.466 4.045 20 10 FICDMO CCc1cc(C[N@H+]2CCC[C@@H](c3nc(C)no3)C2)c(O)c(C(C)(C)C)c1 ZINC000921047564 1123557011 /nfs/dbraw/zinc/55/70/11/1123557011.db2.gz ABZUJSPYHVGXFP-MRXNPFEDSA-N 1 1 357.498 4.323 20 10 FICDMO Cc1cc(C[NH+]2CCN(C(=O)C3CCCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000921187881 1123580801 /nfs/dbraw/zinc/58/08/01/1123580801.db2.gz RXHQNTWMXODZKA-UHFFFAOYSA-N 1 1 372.553 4.223 20 10 FICDMO CC(=O)Nc1cccc2c1CC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000179529554 1123998787 /nfs/dbraw/zinc/99/87/87/1123998787.db2.gz VAJPISVCDLMNBS-UHFFFAOYSA-N 1 1 363.505 4.194 20 10 FICDMO Cc1cc([NH+]2CCCC2)ccc1NCc1ccc(N2CCOCC2)cc1 ZINC000237673253 1124015296 /nfs/dbraw/zinc/01/52/96/1124015296.db2.gz JIAJNLIXQBHMEH-UHFFFAOYSA-N 1 1 351.494 4.044 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H]3CCCc4sccc43)cc2F)CC1 ZINC000765853011 1124225117 /nfs/dbraw/zinc/22/51/17/1124225117.db2.gz OCHRMVFEBSAYEG-LJQANCHMSA-N 1 1 373.541 4.196 20 10 FICDMO CC[N@@H+](Cc1ccc(-c2nc(Cc3ccc(N)cc3)no2)cc1)C(C)C ZINC000843160139 1124957473 /nfs/dbraw/zinc/95/74/73/1124957473.db2.gz DTDHPNCFGDJHNX-UHFFFAOYSA-N 1 1 350.466 4.140 20 10 FICDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+](Cc3cccc(C(C)(C)C)c3O)[C@@H]2C1 ZINC001143103383 1125245867 /nfs/dbraw/zinc/24/58/67/1125245867.db2.gz BNDGTRQKCLKZDE-MAUKXSAKSA-N 1 1 374.525 4.131 20 10 FICDMO CC(C)(C)OC(=O)N1CC[C@]12CC[N@@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143103387 1125245914 /nfs/dbraw/zinc/24/59/14/1125245914.db2.gz BPHQTOCZHCXHJB-QFIPXVFZSA-N 1 1 374.525 4.275 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc(C)cc3)o2)c1 ZINC000182428392 1125475883 /nfs/dbraw/zinc/47/58/83/1125475883.db2.gz OEKNDOQYKDPGTI-KGLIPLIRSA-N 1 1 353.422 4.171 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000274832825 1080205112 /nfs/dbraw/zinc/20/51/12/1080205112.db2.gz MQGYAGDBIJWTEX-RYUDHWBXSA-N 1 1 357.385 4.002 20 10 FICDMO C[C@@H]1C[C@H]1C[N@H+]1CCc2c(Cl)c(O)c(O)cc2[C@H](c2ccc(O)cc2)C1 ZINC001209433028 1080681734 /nfs/dbraw/zinc/68/17/34/1080681734.db2.gz SNHQFYQFCDYPFA-IAISJRAMSA-N 1 1 373.880 4.103 20 10 FICDMO COc1cc(O)c(C[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1OC ZINC000160309553 1081239384 /nfs/dbraw/zinc/23/93/84/1081239384.db2.gz JCFUMFDKAKVOMA-HNNXBMFYSA-N 1 1 359.491 4.024 20 10 FICDMO Cc1ccc(CC[N@H+](Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 ZINC001167461509 1082569159 /nfs/dbraw/zinc/56/91/59/1082569159.db2.gz KRBXTNNRTXXFIQ-QHCPKHFHSA-N 1 1 352.522 4.285 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000180286429 1085000707 /nfs/dbraw/zinc/00/07/07/1085000707.db2.gz AGQSTLUVZPJYDG-GKVSMKOHSA-N 1 1 358.551 4.463 20 10 FICDMO CC(C)[C@@H](C)NC(=O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000255953981 1088242951 /nfs/dbraw/zinc/24/29/51/1088242951.db2.gz ZTUOPFWBSHUNAD-QZTJIDSGSA-N 1 1 354.494 4.116 20 10 FICDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000756571465 1091149632 /nfs/dbraw/zinc/14/96/32/1091149632.db2.gz FGPJLMZQJWSVNJ-YUMQZZPRSA-N 1 1 357.223 4.310 20 10 FICDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000756571451 1091150181 /nfs/dbraw/zinc/15/01/81/1091150181.db2.gz FGPJLMZQJWSVNJ-HTQZYQBOSA-N 1 1 357.223 4.310 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])c2c1 ZINC000025479188 1091187991 /nfs/dbraw/zinc/18/79/91/1091187991.db2.gz QMYLAALOXIODPA-UHFFFAOYSA-N 1 1 352.390 4.094 20 10 FICDMO C[C@@H]([NH2+]CCOCc1ccccc1)c1cc(Br)c(F)cc1O ZINC000756638097 1091672411 /nfs/dbraw/zinc/67/24/11/1091672411.db2.gz ROGIQXLSDYDCEU-GFCCVEGCSA-N 1 1 368.246 4.161 20 10 FICDMO CCOC[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000299738008 1091678773 /nfs/dbraw/zinc/67/87/73/1091678773.db2.gz MNIKTJPLFLFNNR-QGZVFWFLSA-N 1 1 366.465 4.399 20 10 FICDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc(OC)c(OC)cc2O)cc1 ZINC000159519619 1093033663 /nfs/dbraw/zinc/03/36/63/1093033663.db2.gz WMTMNGYKNDTCTC-GOSISDBHSA-N 1 1 357.450 4.145 20 10 FICDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)c(O)c1 ZINC000248528430 1093266498 /nfs/dbraw/zinc/26/64/98/1093266498.db2.gz WBOYFOSHLSMJFB-FHWLQOOXSA-N 1 1 368.521 4.161 20 10 FICDMO C[N@@H+](Cc1coc2ccc(F)cc12)Cc1ccc(N2CCOCC2)cc1 ZINC001141852650 1093773755 /nfs/dbraw/zinc/77/37/55/1093773755.db2.gz LWOOWVIMXMKCDQ-UHFFFAOYSA-N 1 1 354.425 4.041 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186205273 1101758847 /nfs/dbraw/zinc/75/88/47/1101758847.db2.gz LFXZSSATROWGEC-QKKBWIMNSA-N 1 1 352.409 4.375 20 10 FICDMO CCN(CC)C(=O)[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC000481569313 1112985181 /nfs/dbraw/zinc/98/51/81/1112985181.db2.gz UBVWSDFDKFJUHW-QFIPXVFZSA-N 1 1 363.505 4.186 20 10 FICDMO CCN(CC)C(=O)[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC000481569290 1112985226 /nfs/dbraw/zinc/98/52/26/1112985226.db2.gz UBVWSDFDKFJUHW-JOCHJYFZSA-N 1 1 363.505 4.186 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1O ZINC000761191399 1115614690 /nfs/dbraw/zinc/61/46/90/1115614690.db2.gz SJEJJTCLKJNLQG-UHFFFAOYSA-N 1 1 362.813 4.127 20 10 FICDMO COc1ccc(OC)c(C[N@@H+](Cc2cc3c(cc2O)CCC3)C2CC2)c1 ZINC000914570225 1120375074 /nfs/dbraw/zinc/37/50/74/1120375074.db2.gz SSCHYMHVUVYKAH-UHFFFAOYSA-N 1 1 353.462 4.063 20 10 FICDMO C[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000762647977 1120945004 /nfs/dbraw/zinc/94/50/04/1120945004.db2.gz GSSKSFBKJIEIRO-NHCUHLMSSA-N 1 1 373.585 4.219 20 10 FICDMO COc1ccc(C[N@@H+](C)Cc2cc(OC)cc(C(C)(C)C)c2O)c(OC)c1 ZINC000915818299 1121083234 /nfs/dbraw/zinc/08/32/34/1121083234.db2.gz NAZPLTHWSYUIPP-UHFFFAOYSA-N 1 1 373.493 4.348 20 10 FICDMO CC(C)c1ccc(C[C@H]2CC[N@@H+](Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 ZINC000763392405 1121575211 /nfs/dbraw/zinc/57/52/11/1121575211.db2.gz HLDKWDUXMLCIEJ-VGOFRKELSA-N 1 1 367.489 4.006 20 10 FICDMO CCc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075241 1122070009 /nfs/dbraw/zinc/07/00/09/1122070009.db2.gz SMOUSCYKMFPOIJ-UHFFFAOYSA-N 1 1 367.537 4.473 20 10 FICDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cn1c(=O)oc2cc(Cl)ccc21 ZINC000917410958 1122299492 /nfs/dbraw/zinc/29/94/92/1122299492.db2.gz AMNYHYSQCDRFFG-UHFFFAOYSA-N 1 1 373.884 4.182 20 10 FICDMO CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000917470183 1122328097 /nfs/dbraw/zinc/32/80/97/1122328097.db2.gz QRHWPFARVHBODM-GOSISDBHSA-N 1 1 360.542 4.088 20 10 FICDMO COc1ccc2ccc(O)c(C[N@H+]3CCCN(c4ccccc4)CC3)c2c1 ZINC000917486329 1122332498 /nfs/dbraw/zinc/33/24/98/1122332498.db2.gz XNQAWQQAMUNNAW-UHFFFAOYSA-N 1 1 362.473 4.266 20 10 FICDMO Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984915 1123300162 /nfs/dbraw/zinc/30/01/62/1123300162.db2.gz WGRCOWZFXGFCAD-ZWKOTPCHSA-N 1 1 371.912 4.104 20 10 FICDMO Cc1cc(C(=O)NCCCn2cc[nH+]c2C)c(C)n1-c1cccc(Cl)c1 ZINC000919988893 1123301918 /nfs/dbraw/zinc/30/19/18/1123301918.db2.gz VGEMDLUGCPOAHJ-UHFFFAOYSA-N 1 1 370.884 4.073 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3cccc(C)c3)cc2F)CC1 ZINC000765847274 1124142985 /nfs/dbraw/zinc/14/29/85/1124142985.db2.gz BGJZPGVVENTJCK-SFHVURJKSA-N 1 1 355.501 4.127 20 10 FICDMO Cc1ccc(NC(=O)NC[C@H]2CCC[N@@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179932593 1124144633 /nfs/dbraw/zinc/14/46/33/1124144633.db2.gz PBYMGHALTBIAAW-GOSISDBHSA-N 1 1 367.493 4.043 20 10 FICDMO Cc1cccc(C[N@H+]2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1O ZINC000179958032 1124163073 /nfs/dbraw/zinc/16/30/73/1124163073.db2.gz CJPJHGRHKKPZBD-KRWDZBQOSA-N 1 1 367.424 4.269 20 10 FICDMO CCC[N@@H+](Cc1cc(F)ccc1O)C1CCN(C(=O)c2ccccc2)CC1 ZINC000180019081 1124199690 /nfs/dbraw/zinc/19/96/90/1124199690.db2.gz UDWQMXHHPZDPRI-UHFFFAOYSA-N 1 1 370.468 4.048 20 10 FICDMO Cn1cc([C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2cccc(F)c2)cn1 ZINC000180101282 1124223879 /nfs/dbraw/zinc/22/38/79/1124223879.db2.gz UMZGSWGGMVTREP-JOCHJYFZSA-N 1 1 364.468 4.039 20 10 FICDMO CCN(CC)c1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2cccc(F)c2)cc1 ZINC000180161733 1124256912 /nfs/dbraw/zinc/25/69/12/1124256912.db2.gz SRLKYAGJODOKPI-JOCHJYFZSA-N 1 1 366.484 4.285 20 10 FICDMO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@H](O)c2ccsc2)c1 ZINC000180711143 1124415175 /nfs/dbraw/zinc/41/51/75/1124415175.db2.gz ZCYKWONQIQLOGB-NRFANRHFSA-N 1 1 369.486 4.198 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000182392776 1125451671 /nfs/dbraw/zinc/45/16/71/1125451671.db2.gz NCJRCNZTQKSHOR-KBPBESRZSA-N 1 1 353.422 4.171 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1cnc(C2CCC2)s1)C[C@@H]1CCCO1 ZINC000160203576 1079603988 /nfs/dbraw/zinc/60/39/88/1079603988.db2.gz DYLZAQAAKVTFQE-KRWDZBQOSA-N 1 1 358.507 4.297 20 10 FICDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1C ZINC001167107846 1080552343 /nfs/dbraw/zinc/55/23/43/1080552343.db2.gz IGDXUPJWBUFHLT-UHFFFAOYSA-N 1 1 353.510 4.219 20 10 FICDMO Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC001648826923 1081262508 /nfs/dbraw/zinc/26/25/08/1081262508.db2.gz VTVUMKLZFZREOG-UHFFFAOYSA-N 1 1 362.876 4.247 20 10 FICDMO C[C@@H](NC(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1)c1ccccc1 ZINC001167353139 1081591293 /nfs/dbraw/zinc/59/12/93/1081591293.db2.gz FVELAKREJSLDJM-QGZVFWFLSA-N 1 1 352.478 4.014 20 10 FICDMO Clc1cc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)c(Cl)s1 ZINC000312770713 1081820703 /nfs/dbraw/zinc/82/07/03/1081820703.db2.gz XHECUXRCLKJJEJ-UHFFFAOYSA-N 1 1 357.306 4.181 20 10 FICDMO CC[C@@H]([NH2+]CCOc1ncccc1C(F)(F)F)c1ccc(F)cc1O ZINC000796837908 1084261686 /nfs/dbraw/zinc/26/16/86/1084261686.db2.gz SYZISJACTPMFHN-CQSZACIVSA-N 1 1 358.335 4.065 20 10 FICDMO COc1cccc(-c2nc(C[N@H+](C)Cc3ccccc3O)cs2)c1OC ZINC000111235903 1084995490 /nfs/dbraw/zinc/99/54/90/1084995490.db2.gz PLHVDBSFKNOVRH-UHFFFAOYSA-N 1 1 370.474 4.165 20 10 FICDMO COc1cccc(-c2nc(C[N@@H+](C)Cc3ccccc3O)cs2)c1OC ZINC000111235903 1084995496 /nfs/dbraw/zinc/99/54/96/1084995496.db2.gz PLHVDBSFKNOVRH-UHFFFAOYSA-N 1 1 370.474 4.165 20 10 FICDMO COC1CCN(c2ccc(C[N@@H+](C)[C@@H](C)Cc3cccs3)cc2)CC1 ZINC001167607855 1085583348 /nfs/dbraw/zinc/58/33/48/1085583348.db2.gz CVEVRRHDTJGEHY-KRWDZBQOSA-N 1 1 358.551 4.426 20 10 FICDMO CC[C@@H]([NH2+]CCOc1cccc(C(F)(F)F)n1)c1ccc(F)cc1O ZINC000796846357 1086175524 /nfs/dbraw/zinc/17/55/24/1086175524.db2.gz OXUQHTWERSPLBY-CYBMUJFWSA-N 1 1 358.335 4.065 20 10 FICDMO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278929951 1086640317 /nfs/dbraw/zinc/64/03/17/1086640317.db2.gz MKVSVJJRLIZLDK-SSDOTTSWSA-N 1 1 362.348 4.060 20 10 FICDMO COc1cc(C[NH2+]Cc2cccc(Br)c2O)ccc1SC ZINC000278428429 1086970039 /nfs/dbraw/zinc/97/00/39/1086970039.db2.gz SUGFLAPCFDREAT-UHFFFAOYSA-N 1 1 368.296 4.175 20 10 FICDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000108091157 1092134291 /nfs/dbraw/zinc/13/42/91/1092134291.db2.gz DAYWXCFQMAPYRB-UHFFFAOYSA-N 1 1 364.411 4.426 20 10 FICDMO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)cs1 ZINC000273368917 1096256531 /nfs/dbraw/zinc/25/65/31/1096256531.db2.gz CBGZECAFXZPXOO-UWVGGRQHSA-N 1 1 371.300 4.169 20 10 FICDMO C[C@H]([NH2+]Cc1cccnc1-n1ccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192654480 1101966345 /nfs/dbraw/zinc/96/63/45/1101966345.db2.gz QPXPGGUQZQTTEE-NSHDSACASA-N 1 1 363.248 4.131 20 10 FICDMO C[C@H](COCc1ccccc1)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001167983453 1102887890 /nfs/dbraw/zinc/88/78/90/1102887890.db2.gz MBCJPUNRLUWSGX-UGKGYDQZSA-N 1 1 369.505 4.226 20 10 FICDMO C[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1ccc(F)cc1O ZINC000760036241 1104893901 /nfs/dbraw/zinc/89/39/01/1104893901.db2.gz DTUIMZXMMUAHTQ-LVXYXVKQSA-N 1 1 361.432 4.095 20 10 FICDMO COc1cccc(CNc2cc[nH+]c3cc(Br)ccc23)c1O ZINC000302003112 1107248461 /nfs/dbraw/zinc/24/84/61/1107248461.db2.gz YCNRVEDRNNPRLG-UHFFFAOYSA-N 1 1 359.223 4.324 20 10 FICDMO CCC[N@@H+](CC(=O)N[C@H](C)c1ccccc1Cl)Cc1ccccc1O ZINC000303133766 1107574818 /nfs/dbraw/zinc/57/48/18/1107574818.db2.gz PTXVAWCMPDVLOD-OAHLLOKOSA-N 1 1 360.885 4.135 20 10 FICDMO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000479434744 1112021566 /nfs/dbraw/zinc/02/15/66/1112021566.db2.gz FFOTUGSVBNYXSR-QFIPXVFZSA-N 1 1 362.452 4.239 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)c1ccccc1Cl ZINC000111232802 1112891857 /nfs/dbraw/zinc/89/18/57/1112891857.db2.gz OBIHUPXVQAWTRN-FQEVSTJZSA-N 1 1 357.837 4.374 20 10 FICDMO Oc1c(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)cc(Cl)c2cccnc12 ZINC001168408325 1115565461 /nfs/dbraw/zinc/56/54/61/1115565461.db2.gz UXXOEUXZQWKITK-MRXNPFEDSA-N 1 1 356.828 4.380 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)c1O ZINC000761183468 1115596497 /nfs/dbraw/zinc/59/64/97/1115596497.db2.gz LHDLEHZKSIDPBP-UHFFFAOYSA-N 1 1 357.784 4.288 20 10 FICDMO COc1ccc2ccc([O-])c(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)c2c1 ZINC000153467148 1120790077 /nfs/dbraw/zinc/79/00/77/1120790077.db2.gz UMJQSECMOUBEBB-SFHVURJKSA-N 1 1 354.494 4.004 20 10 FICDMO COc1ccc2ccc([O-])c(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)c2c1 ZINC000153467148 1120790082 /nfs/dbraw/zinc/79/00/82/1120790082.db2.gz UMJQSECMOUBEBB-SFHVURJKSA-N 1 1 354.494 4.004 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915683239 1121020849 /nfs/dbraw/zinc/02/08/49/1121020849.db2.gz YZSBFLYTDHWESZ-UPVQGACJSA-N 1 1 363.549 4.430 20 10 FICDMO CCN(Cc1ccccc1)c1ccc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000915683239 1121020859 /nfs/dbraw/zinc/02/08/59/1121020859.db2.gz YZSBFLYTDHWESZ-UPVQGACJSA-N 1 1 363.549 4.430 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1nc2ccc(F)cc2s1)C[C@@H]1CCCO1 ZINC000762946551 1121030859 /nfs/dbraw/zinc/03/08/59/1121030859.db2.gz RCHQCTABSZZVHV-INIZCTEOSA-N 1 1 372.465 4.322 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1nc2ccc(F)cc2s1)C[C@@H]1CCCO1 ZINC000762946551 1121030867 /nfs/dbraw/zinc/03/08/67/1121030867.db2.gz RCHQCTABSZZVHV-INIZCTEOSA-N 1 1 372.465 4.322 20 10 FICDMO Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)cc1 ZINC000916660811 1121598980 /nfs/dbraw/zinc/59/89/80/1121598980.db2.gz CGANODUUHODBKE-UHFFFAOYSA-N 1 1 371.444 4.236 20 10 FICDMO Cc1ccc(-c2nnc(C[N@@H+](Cc3ccc(N(C)C)cc3)C3CC3)o2)cc1 ZINC000917074020 1122067942 /nfs/dbraw/zinc/06/79/42/1122067942.db2.gz NFRIZCDTGKIRHK-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1ccc(-c2nnc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)o2)cc1 ZINC000917074020 1122067950 /nfs/dbraw/zinc/06/79/50/1122067950.db2.gz NFRIZCDTGKIRHK-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO CC(C)[N@@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccc(N(C)C)cc1 ZINC000917074653 1122069047 /nfs/dbraw/zinc/06/90/47/1122069047.db2.gz FMPRKFYADDNTKZ-UHFFFAOYSA-N 1 1 356.901 4.464 20 10 FICDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)cc2c1OCOC2 ZINC000917074952 1122069237 /nfs/dbraw/zinc/06/92/37/1122069237.db2.gz MLVXGTDJRMNLTM-UHFFFAOYSA-N 1 1 358.457 4.169 20 10 FICDMO CSc1cccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075353 1122070482 /nfs/dbraw/zinc/07/04/82/1122070482.db2.gz UAXOSBCVXYJFNP-UHFFFAOYSA-N 1 1 371.550 4.324 20 10 FICDMO Cc1ccc(C(=O)N2CC[NH+](Cc3cc(C(C)C)c(C)cc3O)CC2)cc1 ZINC000917452697 1122318914 /nfs/dbraw/zinc/31/89/14/1122318914.db2.gz KHHSECNMWQXFTG-UHFFFAOYSA-N 1 1 366.505 4.090 20 10 FICDMO Cc1ccc(C)n1-c1ccc(C(=O)Nc2cccnc2-n2cc[nH+]c2C)cc1 ZINC000919982743 1123299029 /nfs/dbraw/zinc/29/90/29/1123299029.db2.gz LYVBMTNRJGRRCP-UHFFFAOYSA-N 1 1 371.444 4.236 20 10 FICDMO CCCN(CCC)c1ccc(C[NH2+][C@H](C)c2nnc3n2CCCCC3)cc1 ZINC000920177973 1123404773 /nfs/dbraw/zinc/40/47/73/1123404773.db2.gz SHKCRBFDAHKWFM-GOSISDBHSA-N 1 1 369.557 4.482 20 10 FICDMO COc1cc(O)c(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)cc1OC ZINC000179439326 1123976112 /nfs/dbraw/zinc/97/61/12/1123976112.db2.gz WERLOPVFRUXXPZ-UHFFFAOYSA-N 1 1 355.356 4.060 20 10 FICDMO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1 ZINC000180025304 1124191402 /nfs/dbraw/zinc/19/14/02/1124191402.db2.gz FQGXSZMHHCSWDV-SFHVURJKSA-N 1 1 365.433 4.178 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1 ZINC000180025304 1124191411 /nfs/dbraw/zinc/19/14/11/1124191411.db2.gz FQGXSZMHHCSWDV-SFHVURJKSA-N 1 1 365.433 4.178 20 10 FICDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(F)cc1 ZINC000765852035 1124219770 /nfs/dbraw/zinc/21/97/70/1124219770.db2.gz JEEJQNXRXAWOSL-NRFANRHFSA-N 1 1 373.491 4.348 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3ccccc3C)cc2F)CC1 ZINC000765853902 1124257247 /nfs/dbraw/zinc/25/72/47/1124257247.db2.gz WSLMILBLSLMSIJ-SFHVURJKSA-N 1 1 355.501 4.127 20 10 FICDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000180226321 1124268466 /nfs/dbraw/zinc/26/84/66/1124268466.db2.gz HBDCBXRMPZRFJG-JTQLQIEISA-N 1 1 360.376 4.386 20 10 FICDMO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@@H](O)c2ccsc2)c1 ZINC000180711167 1124414741 /nfs/dbraw/zinc/41/47/41/1124414741.db2.gz ZCYKWONQIQLOGB-OAQYLSRUSA-N 1 1 369.486 4.198 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCCCC[C@@H]2C)C1 ZINC001128246770 1125123605 /nfs/dbraw/zinc/12/36/05/1125123605.db2.gz CWIPBQNEXIZQNK-SFHVURJKSA-N 1 1 367.537 4.199 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000182392814 1125451426 /nfs/dbraw/zinc/45/14/26/1125451426.db2.gz NCJRCNZTQKSHOR-KGLIPLIRSA-N 1 1 353.422 4.171 20 10 FICDMO CCOc1cccc(C[NH2+][C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)c1O ZINC000276700566 1083031274 /nfs/dbraw/zinc/03/12/74/1083031274.db2.gz BGMKTWZEPQUCGD-CYBMUJFWSA-N 1 1 371.412 4.139 20 10 FICDMO CC[C@@H]([NH2+][C@H](Cc1ccccc1)C(=O)N(CC)CC)c1ccc(F)cc1O ZINC000796664543 1083555818 /nfs/dbraw/zinc/55/58/18/1083555818.db2.gz YQVVHBFEEOJIAW-WOJBJXKFSA-N 1 1 372.484 4.052 20 10 FICDMO CCOc1ccccc1C[N@@H+](CCCn1ccnc1)Cc1ccccc1O ZINC000179553634 1083563853 /nfs/dbraw/zinc/56/38/53/1083563853.db2.gz IEHAHRBZLQXOMF-UHFFFAOYSA-N 1 1 365.477 4.080 20 10 FICDMO COc1cccc([C@@H](O)C[N@@H+](Cc2ccccc2)Cc2ccccc2O)c1 ZINC000179584478 1083571552 /nfs/dbraw/zinc/57/15/52/1083571552.db2.gz YDHMHXYKFFVNOP-QHCPKHFHSA-N 1 1 363.457 4.137 20 10 FICDMO CCN(C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1)CC(F)(F)F ZINC000177639561 1084185476 /nfs/dbraw/zinc/18/54/76/1084185476.db2.gz AZBQWRRLFXMCLK-OAHLLOKOSA-N 1 1 366.427 4.252 20 10 FICDMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)cs1 ZINC000162418738 1086157730 /nfs/dbraw/zinc/15/77/30/1086157730.db2.gz BKKUQCOTGXPPID-UONOGXRCSA-N 1 1 363.502 4.093 20 10 FICDMO COc1cc(Cl)cc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278985274 1086742490 /nfs/dbraw/zinc/74/24/90/1086742490.db2.gz IVNXJKOHYUDBKC-SSDOTTSWSA-N 1 1 366.792 4.380 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H]3Cc3ccccc3)cc2)CC1 ZINC000828021388 1086814753 /nfs/dbraw/zinc/81/47/53/1086814753.db2.gz WHSFTBOGGSEUKW-QFIPXVFZSA-N 1 1 350.506 4.119 20 10 FICDMO C[N@H+](Cc1nnc(-c2ccccc2)o1)Cc1ccc(N2CCCCC2)cc1 ZINC000052686817 1087044281 /nfs/dbraw/zinc/04/42/81/1087044281.db2.gz PKWBHYJJOBWYMD-UHFFFAOYSA-N 1 1 362.477 4.359 20 10 FICDMO C[N@@H+](Cc1nnc(-c2ccccc2)o1)Cc1ccc(N2CCCCC2)cc1 ZINC000052686817 1087044290 /nfs/dbraw/zinc/04/42/90/1087044290.db2.gz PKWBHYJJOBWYMD-UHFFFAOYSA-N 1 1 362.477 4.359 20 10 FICDMO CC(C)(C)OC(=O)Nc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000708536004 1087336291 /nfs/dbraw/zinc/33/62/91/1087336291.db2.gz SOPRBJJKLOLCCY-UHFFFAOYSA-N 1 1 364.392 4.307 20 10 FICDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)c2ccccc2)C1 ZINC000435666465 1089850897 /nfs/dbraw/zinc/85/08/97/1089850897.db2.gz YNJGGISCLMPDGS-UHFFFAOYSA-N 1 1 361.489 4.071 20 10 FICDMO c1ccc(C[N@@H+]2CC[C@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240032 1090434604 /nfs/dbraw/zinc/43/46/04/1090434604.db2.gz CEWIGIGFFQZYAV-HSZRJFAPSA-N 1 1 363.549 4.289 20 10 FICDMO c1ccc(CN2CC[C@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240032 1090434607 /nfs/dbraw/zinc/43/46/07/1090434607.db2.gz CEWIGIGFFQZYAV-HSZRJFAPSA-N 1 1 363.549 4.289 20 10 FICDMO C[C@H]1CC([NH2+]Cc2ccc(N(C)C)cc2)C[C@H](C)N1Cc1ccccc1 ZINC001168025244 1093419301 /nfs/dbraw/zinc/41/93/01/1093419301.db2.gz JDZHRGYOZFBIQG-OALUTQOASA-N 1 1 351.538 4.284 20 10 FICDMO C[C@H]1CC(NCc2ccc(N(C)C)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168025244 1093419315 /nfs/dbraw/zinc/41/93/15/1093419315.db2.gz JDZHRGYOZFBIQG-OALUTQOASA-N 1 1 351.538 4.284 20 10 FICDMO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c(O)c1C ZINC000273397537 1096259121 /nfs/dbraw/zinc/25/91/21/1096259121.db2.gz MEYZTKRYEDRAMU-HNAYVOBHSA-N 1 1 353.441 4.322 20 10 FICDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000048794681 1102813937 /nfs/dbraw/zinc/81/39/37/1102813937.db2.gz REEIFYGSYBOBOR-UHFFFAOYSA-N 1 1 360.173 4.463 20 10 FICDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000827986274 1107523574 /nfs/dbraw/zinc/52/35/74/1107523574.db2.gz SDSZHPHJAOAKPA-MBSDFSHPSA-N 1 1 350.506 4.495 20 10 FICDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1ccc(N2CCOCC2)cc1 ZINC001168073700 1107789865 /nfs/dbraw/zinc/78/98/65/1107789865.db2.gz NNJHUNPDJWECEC-JOCHJYFZSA-N 1 1 352.522 4.366 20 10 FICDMO C[N@@H+](Cc1ccc(Br)s1)Cc1c(O)ccc2ccncc21 ZINC000021970086 1109054428 /nfs/dbraw/zinc/05/44/28/1109054428.db2.gz YFODQWAHQXTWEE-UHFFFAOYSA-N 1 1 363.280 4.396 20 10 FICDMO Cc1cc(O)c(C[N@H+]2CCCN(C(=O)c3ccc(Cl)cc3)CC2)cc1C ZINC000057104683 1114875814 /nfs/dbraw/zinc/87/58/14/1114875814.db2.gz HOZGETOIZQQLIY-UHFFFAOYSA-N 1 1 372.896 4.011 20 10 FICDMO C[C@H](O)[C@H]1CCC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880910 1115121310 /nfs/dbraw/zinc/12/13/10/1115121310.db2.gz ZMGLDAFLGJPMHP-IRXDYDNUSA-N 1 1 366.465 4.133 20 10 FICDMO C[C@H](O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000760880910 1115121315 /nfs/dbraw/zinc/12/13/15/1115121315.db2.gz ZMGLDAFLGJPMHP-IRXDYDNUSA-N 1 1 366.465 4.133 20 10 FICDMO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H]4[C@H](CCCN4C4CC4)C3)c2c1 ZINC000157960182 1115412893 /nfs/dbraw/zinc/41/28/93/1115412893.db2.gz DGLPFROKKJJKPK-VGOFRKELSA-N 1 1 366.505 4.003 20 10 FICDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]4[C@H](CCCN4C4CC4)C3)c2c1 ZINC000157960182 1115412895 /nfs/dbraw/zinc/41/28/95/1115412895.db2.gz DGLPFROKKJJKPK-VGOFRKELSA-N 1 1 366.505 4.003 20 10 FICDMO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1O ZINC000761191780 1115614352 /nfs/dbraw/zinc/61/43/52/1115614352.db2.gz VQCFHEURCBBFTI-UHFFFAOYSA-N 1 1 362.813 4.127 20 10 FICDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1O ZINC000761191780 1115614353 /nfs/dbraw/zinc/61/43/53/1115614353.db2.gz VQCFHEURCBBFTI-UHFFFAOYSA-N 1 1 362.813 4.127 20 10 FICDMO COc1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc1OC(F)F ZINC000914784285 1120535135 /nfs/dbraw/zinc/53/51/35/1120535135.db2.gz LGPFGJKNYNUYLJ-UHFFFAOYSA-N 1 1 363.404 4.123 20 10 FICDMO Cc1cc(O)c(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)cc1C ZINC000762557134 1120930154 /nfs/dbraw/zinc/93/01/54/1120930154.db2.gz RDOMDMZKJAHMQS-HXUWFJFHSA-N 1 1 355.869 4.275 20 10 FICDMO Cc1cccc(-c2noc(C[N@@H+](Cc3ccc(N(C)C)cc3)C3CC3)n2)c1 ZINC000917075499 1122071067 /nfs/dbraw/zinc/07/10/67/1122071067.db2.gz XUEDUJJIKVJFDY-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1cccc(-c2noc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)n2)c1 ZINC000917075499 1122071076 /nfs/dbraw/zinc/07/10/76/1122071076.db2.gz XUEDUJJIKVJFDY-UHFFFAOYSA-N 1 1 362.477 4.276 20 10 FICDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000918024195 1122523349 /nfs/dbraw/zinc/52/33/49/1122523349.db2.gz YITIHTQKAHKJRY-LJQANCHMSA-N 1 1 367.537 4.021 20 10 FICDMO CC[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1cc(C)ccc1O ZINC000179795961 1124082784 /nfs/dbraw/zinc/08/27/84/1124082784.db2.gz RTTAGMSZZLTZCD-UHFFFAOYSA-N 1 1 367.276 4.468 20 10 FICDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000180286451 1124283822 /nfs/dbraw/zinc/28/38/22/1124283822.db2.gz AGQSTLUVZPJYDG-NSYGIPOTSA-N 1 1 358.551 4.463 20 10 FICDMO CCN(C)c1ccc([C@H](C)NCC2([NH+]3CCC(OC)CC3)CCCC2)cc1 ZINC000765859870 1124292202 /nfs/dbraw/zinc/29/22/02/1124292202.db2.gz LZECTRNPYUTHEH-IBGZPJMESA-N 1 1 373.585 4.217 20 10 FICDMO Cc1cc(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c(C)n1-c1ccccc1C ZINC000068895552 1124408593 /nfs/dbraw/zinc/40/85/93/1124408593.db2.gz ZNEXVMMRNZZJBA-FQEVSTJZSA-N 1 1 365.477 4.028 20 10 FICDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000180696627 1124409543 /nfs/dbraw/zinc/40/95/43/1124409543.db2.gz GCIZNKZLVJPHOC-LPHOPBHVSA-N 1 1 361.507 4.331 20 10 FICDMO C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(Br)cc1[O-] ZINC000756363456 1124843816 /nfs/dbraw/zinc/84/38/16/1124843816.db2.gz OGGASJAXGGZZRA-UONOGXRCSA-N 1 1 355.320 4.070 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000182314454 1125399493 /nfs/dbraw/zinc/39/94/93/1125399493.db2.gz KDMZAFQXCRGHBG-AWEZNQCLSA-N 1 1 367.449 4.425 20 10 FICDMO Oc1ccccc1C[N@@H+](Cc1ncc(-c2ccccc2)o1)C[C@H]1CCCO1 ZINC000070976378 1125751378 /nfs/dbraw/zinc/75/13/78/1125751378.db2.gz PSTKBMOFZNTYJB-LJQANCHMSA-N 1 1 364.445 4.228 20 10 FICDMO Oc1ccccc1C[N@H+](Cc1ncc(-c2ccccc2)o1)C[C@H]1CCCO1 ZINC000070976378 1125751383 /nfs/dbraw/zinc/75/13/83/1125751383.db2.gz PSTKBMOFZNTYJB-LJQANCHMSA-N 1 1 364.445 4.228 20 10 FICDMO CCOCc1cc(C[NH2+]Cc2nc3cc(Cl)ccc3n2C)ccc1OC ZINC000275074650 1080479058 /nfs/dbraw/zinc/47/90/58/1080479058.db2.gz YJMMWWPGIWTUTP-UHFFFAOYSA-N 1 1 373.884 4.062 20 10 FICDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1ccc(Cl)c(F)c1 ZINC001167108277 1080553908 /nfs/dbraw/zinc/55/39/08/1080553908.db2.gz NLDZWFLGYFFLNH-FQEVSTJZSA-N 1 1 364.892 4.489 20 10 FICDMO CC(=O)Nc1ccccc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000155224371 1080723608 /nfs/dbraw/zinc/72/36/08/1080723608.db2.gz XVPGXQANQHAZKP-UHFFFAOYSA-N 1 1 351.494 4.267 20 10 FICDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc([S@](C)=O)cc1 ZINC000155245442 1080740155 /nfs/dbraw/zinc/74/01/55/1080740155.db2.gz HHABYHQHPLAZCK-RUZDIDTESA-N 1 1 356.535 4.046 20 10 FICDMO CC(=O)c1cc(F)cc(C[NH+]2CCC(Oc3cc(C)ccc3C)CC2)c1O ZINC001167178838 1080798683 /nfs/dbraw/zinc/79/86/83/1080798683.db2.gz MHFVESDYNPAHHJ-UHFFFAOYSA-N 1 1 371.452 4.394 20 10 FICDMO CCCCOc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC001648802628 1080953197 /nfs/dbraw/zinc/95/31/97/1080953197.db2.gz NPCKCOYWDAVGKX-UHFFFAOYSA-N 1 1 351.393 4.148 20 10 FICDMO CCN(CC)c1ccc(C[NH2+]Cc2nccc(C)c2Br)cc1 ZINC001648832654 1081272032 /nfs/dbraw/zinc/27/20/32/1081272032.db2.gz GPQQKCWNJMSWRG-UHFFFAOYSA-N 1 1 362.315 4.289 20 10 FICDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@]2(N(C)C)CCC[C@@H](C)C2)c1 ZINC001648895198 1081353741 /nfs/dbraw/zinc/35/37/41/1081353741.db2.gz FYONUMSMIMQWJN-FZKQIMNGSA-N 1 1 369.347 4.063 20 10 FICDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469547 1082655006 /nfs/dbraw/zinc/65/50/06/1082655006.db2.gz ZGEKEZRRTKRIPZ-FPOVZHCZSA-N 1 1 350.506 4.210 20 10 FICDMO COc1cccc([C@H](O)C[N@@H+](Cc2ccccc2)Cc2ccccc2O)c1 ZINC000179584469 1083570414 /nfs/dbraw/zinc/57/04/14/1083570414.db2.gz YDHMHXYKFFVNOP-HSZRJFAPSA-N 1 1 363.457 4.137 20 10 FICDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1O ZINC000177252697 1083775143 /nfs/dbraw/zinc/77/51/43/1083775143.db2.gz VKYPOOGOLZIAGY-AWEZNQCLSA-N 1 1 368.408 4.255 20 10 FICDMO CCC[N@H+]1CCC[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 ZINC001625905086 1085943270 /nfs/dbraw/zinc/94/32/70/1085943270.db2.gz GXCLVGQNEBDICC-FQEVSTJZSA-N 1 1 371.569 4.194 20 10 FICDMO CCC[N@@H+](Cc1cc(C)ccc1O)Cc1nc2cc(Cl)ccc2c(=O)[nH]1 ZINC000162314340 1090416446 /nfs/dbraw/zinc/41/64/46/1090416446.db2.gz RQYFSUIXRPNOCW-UHFFFAOYSA-N 1 1 371.868 4.003 20 10 FICDMO CCC[N@H+](Cc1cc(C)ccc1O)Cc1nc2cc(Cl)ccc2c(=O)[nH]1 ZINC000162314340 1090416452 /nfs/dbraw/zinc/41/64/52/1090416452.db2.gz RQYFSUIXRPNOCW-UHFFFAOYSA-N 1 1 371.868 4.003 20 10 FICDMO C[C@H](NC(=O)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 ZINC000015571674 1094399829 /nfs/dbraw/zinc/39/98/29/1094399829.db2.gz KVMVNZIENSVMBI-KRWDZBQOSA-N 1 1 371.550 4.048 20 10 FICDMO C[C@H](NC(=O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 ZINC000015571674 1094399842 /nfs/dbraw/zinc/39/98/42/1094399842.db2.gz KVMVNZIENSVMBI-KRWDZBQOSA-N 1 1 371.550 4.048 20 10 FICDMO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@H](c1ncccn1)C1CC1 ZINC000896599350 1094803123 /nfs/dbraw/zinc/80/31/23/1094803123.db2.gz PZLVDAOQIPFQSM-NRFANRHFSA-N 1 1 361.445 4.002 20 10 FICDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1ccc(OC(F)F)cc1 ZINC000760179424 1101576822 /nfs/dbraw/zinc/57/68/22/1101576822.db2.gz PBAISTBMVSESQN-UHFFFAOYSA-N 1 1 359.376 4.083 20 10 FICDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccn2)c2ccccc2OC)c1 ZINC000186193155 1101756739 /nfs/dbraw/zinc/75/67/39/1101756739.db2.gz GEKOQXGQGJBNEV-OYHNWAKOSA-N 1 1 364.445 4.245 20 10 FICDMO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccccn1 ZINC000186193534 1101756904 /nfs/dbraw/zinc/75/69/04/1101756904.db2.gz ZTENJZSYVUHQDV-SPLOXXLWSA-N 1 1 352.409 4.375 20 10 FICDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccccn2)c2ccccc2OC)c1 ZINC000186193136 1101756967 /nfs/dbraw/zinc/75/69/67/1101756967.db2.gz GEKOQXGQGJBNEV-QRQCRPRQSA-N 1 1 364.445 4.245 20 10 FICDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)CCN1Cc1ccccc1 ZINC000729469941 1102823438 /nfs/dbraw/zinc/82/34/38/1102823438.db2.gz ICIMVKMPOCJIFT-UHFFFAOYSA-N 1 1 361.489 4.037 20 10 FICDMO COc1cc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)ccc1OC(F)F ZINC000021965128 1109054226 /nfs/dbraw/zinc/05/42/26/1109054226.db2.gz QJEPCMOGFVNRAQ-UHFFFAOYSA-N 1 1 374.387 4.182 20 10 FICDMO O=C(NC[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1)c1ccccc1 ZINC000176496790 1119540243 /nfs/dbraw/zinc/54/02/43/1119540243.db2.gz AICFVLXJBPYMRQ-SFHVURJKSA-N 1 1 374.484 4.187 20 10 FICDMO Cn1c2ccccc2[nH+]c1NC1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000762520660 1120922358 /nfs/dbraw/zinc/92/23/58/1120922358.db2.gz HKHWRPRBFDLLQS-UHFFFAOYSA-N 1 1 372.419 4.256 20 10 FICDMO CC(C)[N@H+](Cc1nc(-c2cccs2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074610 1122068447 /nfs/dbraw/zinc/06/84/47/1122068447.db2.gz CLKIRJLUOOUGCY-UHFFFAOYSA-N 1 1 356.495 4.275 20 10 FICDMO CC(C)[N@@H+](Cc1nc(-c2cccs2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074610 1122068456 /nfs/dbraw/zinc/06/84/56/1122068456.db2.gz CLKIRJLUOOUGCY-UHFFFAOYSA-N 1 1 356.495 4.275 20 10 FICDMO C[N@H+](CC(=O)Nc1ccccc1Cl)Cc1ccc(N2CCCCC2)cc1 ZINC000131575659 1122099774 /nfs/dbraw/zinc/09/97/74/1122099774.db2.gz HOXBTMKDLZIBJC-UHFFFAOYSA-N 1 1 371.912 4.401 20 10 FICDMO C[N@@H+](CC(=O)Nc1ccccc1Cl)Cc1ccc(N2CCCCC2)cc1 ZINC000131575659 1122099782 /nfs/dbraw/zinc/09/97/82/1122099782.db2.gz HOXBTMKDLZIBJC-UHFFFAOYSA-N 1 1 371.912 4.401 20 10 FICDMO Cc1ccc(N2CCC[N@@H+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)cc1 ZINC000917484867 1122326821 /nfs/dbraw/zinc/32/68/21/1122326821.db2.gz IJJIUNGCNCTJJW-UHFFFAOYSA-N 1 1 368.521 4.416 20 10 FICDMO CCOC1CC[NH+](CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)CC1 ZINC000918738704 1122768488 /nfs/dbraw/zinc/76/84/88/1122768488.db2.gz JXSLRTHCPLUEPB-UHFFFAOYSA-N 1 1 372.484 4.225 20 10 FICDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057226 1123558609 /nfs/dbraw/zinc/55/86/09/1123558609.db2.gz VDSYYXQKPMXYAJ-SJLPKXTDSA-N 1 1 354.494 4.062 20 10 FICDMO COc1cc(O)c(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cc1OC ZINC000180045431 1124202036 /nfs/dbraw/zinc/20/20/36/1124202036.db2.gz DNNMINQPNNHFQZ-UHFFFAOYSA-N 1 1 364.445 4.180 20 10 FICDMO CCN1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(C)ccc43)cc2F)CC1 ZINC000765852616 1124214979 /nfs/dbraw/zinc/21/49/79/1124214979.db2.gz NWNWVFHTVSMTDS-QFIPXVFZSA-N 1 1 367.512 4.053 20 10 FICDMO