smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000122308459 1017261169 /nfs/dbraw/zinc/26/11/69/1017261169.db2.gz QWCQPIBGHXCKPN-HNNXBMFYSA-N 1 1 346.421 3.994 20 10 EHCDMO COc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c(O)cc1C ZINC000160325428 1018003560 /nfs/dbraw/zinc/00/35/60/1018003560.db2.gz LJJHWSKKZOSXKW-CRAIPNDOSA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c(O)cc1C ZINC000160325428 1018003575 /nfs/dbraw/zinc/00/35/75/1018003575.db2.gz LJJHWSKKZOSXKW-CRAIPNDOSA-N 1 1 327.424 3.671 20 10 EHCDMO CC[C@@H]([NH2+]CCc1ccc2c(c1)OCCO2)c1ccc(F)cc1O ZINC000796674894 1019081272 /nfs/dbraw/zinc/08/12/72/1019081272.db2.gz XXAALIPVYMVBPT-MRXNPFEDSA-N 1 1 331.387 3.586 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)cc1OC ZINC000160513905 1019449225 /nfs/dbraw/zinc/44/92/25/1019449225.db2.gz CALHYHMCIMEXBU-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO C[C@H]1CC([NH2+]Cc2ccc(O)cc2O)C[C@H](C)N1Cc1ccccc1 ZINC001168024041 1024299195 /nfs/dbraw/zinc/29/91/95/1024299195.db2.gz ZLKBUOVKJJUBJL-HOTGVXAUSA-N 1 1 340.467 3.629 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(O)cc2O)C[C@H](C)N1Cc1ccccc1 ZINC001168024040 1024300441 /nfs/dbraw/zinc/30/04/41/1024300441.db2.gz ZLKBUOVKJJUBJL-HGKCTWBKSA-N 1 1 340.467 3.629 20 10 EHCDMO CCc1cccc(C[N@H+]2CC3(CC(OC)(OC)C3)[C@H]2C(C)C)c1O ZINC000895990352 1025032667 /nfs/dbraw/zinc/03/26/67/1025032667.db2.gz VENMEYZMUOCUPZ-GOSISDBHSA-N 1 1 333.472 3.564 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)c(O)c1 ZINC000896532057 1025547663 /nfs/dbraw/zinc/54/76/63/1025547663.db2.gz SNSXWYZNCZJIJR-CQSZACIVSA-N 1 1 332.469 3.702 20 10 EHCDMO CCn1nc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)n1 ZINC000925010337 1026000964 /nfs/dbraw/zinc/00/09/64/1026000964.db2.gz FNIBHWPYGJKMOE-MRXNPFEDSA-N 1 1 341.503 3.694 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1ccc(F)cc1O ZINC000273467859 1027442507 /nfs/dbraw/zinc/44/25/07/1027442507.db2.gz JGOHQMYZXQVLEH-TZMCWYRMSA-N 1 1 325.449 3.627 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1N1CCCCC1 ZINC000827972822 1031915600 /nfs/dbraw/zinc/91/56/00/1031915600.db2.gz COCXHWWVIYZVJF-AZUAARDMSA-N 1 1 329.532 3.900 20 10 EHCDMO COc1cccc(C[N@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)c1O ZINC000091963162 1034491898 /nfs/dbraw/zinc/49/18/98/1034491898.db2.gz CPLMVHJQFLRMQZ-SJORKVTESA-N 1 1 345.439 3.862 20 10 EHCDMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000186652716 1035679031 /nfs/dbraw/zinc/67/90/31/1035679031.db2.gz DQUVSJOJWCLNBF-HXPMCKFVSA-N 1 1 343.377 3.844 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCc2n[nH]cc2C1)c1cc(Cl)c(Cl)cc1O ZINC000193023941 1036576265 /nfs/dbraw/zinc/57/62/65/1036576265.db2.gz SCQXRTSDGDGSQX-SCZZXKLOSA-N 1 1 326.227 3.630 20 10 EHCDMO CCOC1(C[NH2+]Cc2cccc(Br)c2O)CCCC1 ZINC000311763211 1037380747 /nfs/dbraw/zinc/38/07/47/1037380747.db2.gz WGXQBPPOMDRAOW-UHFFFAOYSA-N 1 1 328.250 3.594 20 10 EHCDMO C[C@H](O)c1ncc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000278824118 1038389750 /nfs/dbraw/zinc/38/97/50/1038389750.db2.gz CBZOGKCSXIQCRK-HNNXBMFYSA-N 1 1 345.512 3.819 20 10 EHCDMO C[C@H](O)c1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000278824118 1038389761 /nfs/dbraw/zinc/38/97/61/1038389761.db2.gz CBZOGKCSXIQCRK-HNNXBMFYSA-N 1 1 345.512 3.819 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@@]3(C)COC(=O)N3)C2)cc1C(C)C ZINC000905707661 1039045607 /nfs/dbraw/zinc/04/56/07/1039045607.db2.gz LBAFMEJAWIKPDI-OXJNMPFZSA-N 1 1 346.471 3.535 20 10 EHCDMO Oc1cccc2c1C[N@@H+](Cc1cc(OC(F)(F)F)ccc1F)CC2 ZINC001143544758 1039854593 /nfs/dbraw/zinc/85/45/93/1039854593.db2.gz IZSDIDGRIPYKHZ-UHFFFAOYSA-N 1 1 341.304 3.988 20 10 EHCDMO CC[N@@H+](Cc1[nH]nc(C)c1C)Cc1cc(Br)ccc1O ZINC000894084170 1040040427 /nfs/dbraw/zinc/04/04/27/1040040427.db2.gz JUILIBLYEMKCKC-UHFFFAOYSA-N 1 1 338.249 3.517 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1CCC=CO1 ZINC000194052453 1041201935 /nfs/dbraw/zinc/20/19/35/1041201935.db2.gz YRBXVCNVXIZHKQ-CQSZACIVSA-N 1 1 326.234 3.669 20 10 EHCDMO CC[C@@H]([NH2+][C@H](Cc1ccccc1)CN(C)C)c1ccc(F)cc1O ZINC000796703168 1042509241 /nfs/dbraw/zinc/50/92/41/1042509241.db2.gz SWCQBXFJODLAAC-IEBWSBKVSA-N 1 1 330.447 3.745 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](O)COc1c(C)cccc1C)c1ccc(F)cc1O ZINC000796702959 1042510832 /nfs/dbraw/zinc/51/08/32/1042510832.db2.gz FLJUGRWCFSXYIX-AEFFLSMTSA-N 1 1 347.430 3.629 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2O)sc1C ZINC000279712661 1044447346 /nfs/dbraw/zinc/44/73/46/1044447346.db2.gz SSYUXJVNDMJYKY-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@H+]2Cc2cccc(C)c2O)sc1C ZINC000279712661 1044447355 /nfs/dbraw/zinc/44/73/55/1044447355.db2.gz SSYUXJVNDMJYKY-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2O)sc1C ZINC000279712662 1044449755 /nfs/dbraw/zinc/44/97/55/1044449755.db2.gz SSYUXJVNDMJYKY-CQSZACIVSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@H]2CCC[N@H+]2Cc2cccc(C)c2O)sc1C ZINC000279712662 1044449760 /nfs/dbraw/zinc/44/97/60/1044449760.db2.gz SSYUXJVNDMJYKY-CQSZACIVSA-N 1 1 346.452 3.589 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)c(F)c1)C[C@@H]1CCCO1 ZINC000072952790 1126948909 /nfs/dbraw/zinc/94/89/09/1126948909.db2.gz BLTSAKSFPPFUCV-INIZCTEOSA-N 1 1 333.378 3.852 20 10 EHCDMO Cc1ccn(-c2ccccc2C[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000186122880 1127288974 /nfs/dbraw/zinc/28/89/74/1127288974.db2.gz JQGQIYQLMRUEAY-AWEZNQCLSA-N 1 1 325.387 3.876 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1O ZINC000765005207 1127564184 /nfs/dbraw/zinc/56/41/84/1127564184.db2.gz HREWZNZKJYHSGM-HNNXBMFYSA-N 1 1 344.842 3.708 20 10 EHCDMO Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)nnn1-c1ccc(C)cc1 ZINC000765607347 1127703103 /nfs/dbraw/zinc/70/31/03/1127703103.db2.gz BHNLXUGNKAXAML-OAHLLOKOSA-N 1 1 348.450 3.670 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nnc2n1CCCCC2 ZINC000921653281 1128436115 /nfs/dbraw/zinc/43/61/15/1128436115.db2.gz ACGDULTUBNNZOB-KRWDZBQOSA-N 1 1 340.471 3.570 20 10 EHCDMO c1sc(C[NH2+]Cc2ccc3c(c2)CCCO3)nc1-c1ccncc1 ZINC000921740285 1128706728 /nfs/dbraw/zinc/70/67/28/1128706728.db2.gz JRISQDPOVXQTCL-UHFFFAOYSA-N 1 1 337.448 3.820 20 10 EHCDMO C[C@@H]1CCC[C@](CNC/C=C/c2ccc(N(C)C)cc2)([NH+](C)C)C1 ZINC001648895160 1120062670 /nfs/dbraw/zinc/06/26/70/1120062670.db2.gz DSAPRAZBNGQMCI-XDJBQHOISA-N 1 1 329.532 3.866 20 10 EHCDMO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC000921981561 1128996329 /nfs/dbraw/zinc/99/63/29/1128996329.db2.gz AICFAOSDTNAANY-SFHVURJKSA-N 1 1 325.456 3.956 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cn(-c3ccccc3)nn2)cc1 ZINC000154107204 1122237184 /nfs/dbraw/zinc/23/71/84/1122237184.db2.gz UELVVVMCVCXZQP-KRWDZBQOSA-N 1 1 349.482 3.964 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000917013488 1122438667 /nfs/dbraw/zinc/43/86/67/1122438667.db2.gz CVOLOCFRDYJVQB-HXUWFJFHSA-N 1 1 346.421 3.729 20 10 EHCDMO CC(C)Cc1noc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000917074911 1122471903 /nfs/dbraw/zinc/47/19/03/1122471903.db2.gz KWNVWZGPUNINIL-UHFFFAOYSA-N 1 1 330.476 3.745 20 10 EHCDMO CC(C)Cc1noc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000917074911 1122471904 /nfs/dbraw/zinc/47/19/04/1122471904.db2.gz KWNVWZGPUNINIL-UHFFFAOYSA-N 1 1 330.476 3.745 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOc3ccccc3C2)c1 ZINC000917486732 1122618860 /nfs/dbraw/zinc/61/88/60/1122618860.db2.gz VDRPOSVACRLBLV-UHFFFAOYSA-N 1 1 327.424 3.790 20 10 EHCDMO COCCC[N@@H+](CCOC)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000921055831 1123459499 /nfs/dbraw/zinc/45/94/99/1123459499.db2.gz RMRSWVZAZPIJHM-UHFFFAOYSA-N 1 1 347.455 3.502 20 10 EHCDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1ccccc1O ZINC000179562651 1123797059 /nfs/dbraw/zinc/79/70/59/1123797059.db2.gz IJLKAQKXDUYOQM-UHFFFAOYSA-N 1 1 339.414 3.986 20 10 EHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3cccc(OC(F)F)c3)C2)c1O ZINC000180644287 1124037368 /nfs/dbraw/zinc/03/73/68/1124037368.db2.gz GFODFYXSKTZGDY-QGZVFWFLSA-N 1 1 349.377 3.876 20 10 EHCDMO CCc1noc([C@@H]2CC[C@@H]([NH2+]Cc3c(O)ccc(Cl)c3F)C2)n1 ZINC000922866054 1129694911 /nfs/dbraw/zinc/69/49/11/1129694911.db2.gz ZAHBHYAVHDLHRF-NXEZZACHSA-N 1 1 339.798 3.556 20 10 EHCDMO CCCC[N@@H+](Cc1cnc2c(c1)c(C)nn2C)Cc1ccccc1O ZINC000282407824 1129706685 /nfs/dbraw/zinc/70/66/85/1129706685.db2.gz IHVUGVYLKFIKJA-UHFFFAOYSA-N 1 1 338.455 3.785 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)COc1c(C)cccc1C ZINC000727830691 1130597467 /nfs/dbraw/zinc/59/74/67/1130597467.db2.gz HGMAVSOMEQQYJV-IBGZPJMESA-N 1 1 343.467 3.661 20 10 EHCDMO CCCN(Cc1ccccc1O)C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000731283168 1130783485 /nfs/dbraw/zinc/78/34/85/1130783485.db2.gz BHSLZMWRDGLGJQ-CALCHBBNSA-N 1 1 347.503 3.577 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](c3ccc(Cl)cc3)C1)OCO2 ZINC000732186539 1130895513 /nfs/dbraw/zinc/89/55/13/1130895513.db2.gz JKJVOOVBGFAOBG-CYBMUJFWSA-N 1 1 331.799 3.764 20 10 EHCDMO C[N@@H+](Cc1cc[nH]n1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000732665465 1130946829 /nfs/dbraw/zinc/94/68/29/1130946829.db2.gz CRNQOIXUYYNGAE-UHFFFAOYSA-N 1 1 346.228 3.663 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCCN(CC(F)(F)F)CC2)cc1C(C)C ZINC000738067153 1131459073 /nfs/dbraw/zinc/45/90/73/1131459073.db2.gz HIANSRXWYGWGQN-UHFFFAOYSA-N 1 1 344.421 3.894 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc3c(c2)OCCO3)cc1 ZINC000741753112 1131643728 /nfs/dbraw/zinc/64/37/28/1131643728.db2.gz NOFVSVRCKYCDHO-UHFFFAOYSA-N 1 1 326.440 3.546 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)CCOc2ccccc2OC)cc1 ZINC000741754890 1131643877 /nfs/dbraw/zinc/64/38/77/1131643877.db2.gz ZWVLODJOTVAVGN-UHFFFAOYSA-N 1 1 328.456 3.662 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N1CCc2ccccc21 ZINC000743870685 1131995064 /nfs/dbraw/zinc/99/50/64/1131995064.db2.gz ZSSJPMZVESRBHM-MRXNPFEDSA-N 1 1 338.451 3.582 20 10 EHCDMO CN(Cc1cccs1)c1ccc(CNCCC[NH+]2CCCC2)cc1 ZINC001177136375 1133034059 /nfs/dbraw/zinc/03/40/59/1133034059.db2.gz LYFHARVYXJQJHH-UHFFFAOYSA-N 1 1 343.540 3.960 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2Cc3ccccc32)c1 ZINC001177724725 1133093420 /nfs/dbraw/zinc/09/34/20/1133093420.db2.gz JSTTVHHYYKJCDK-CYBMUJFWSA-N 1 1 332.241 3.893 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc2c(c1)COC2)C[C@@H]1CCCO1 ZINC000768163270 1133103220 /nfs/dbraw/zinc/10/32/20/1133103220.db2.gz XLMNIXIITPYDNF-FQEVSTJZSA-N 1 1 339.435 3.604 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@H]1C[C@H]1c1ccccc1 ZINC000768208567 1133107600 /nfs/dbraw/zinc/10/76/00/1133107600.db2.gz UFJUZPFHDBRRNI-IRLDBZIGSA-N 1 1 336.479 3.759 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccccc2-n2cncn2)cc1 ZINC000768211900 1133110644 /nfs/dbraw/zinc/11/06/44/1133110644.db2.gz HOGLWFXZZRZOIL-UHFFFAOYSA-N 1 1 349.482 3.746 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)cc1F ZINC000768263008 1133119081 /nfs/dbraw/zinc/11/90/81/1133119081.db2.gz NRYJQUZQAJXLFN-UHFFFAOYSA-N 1 1 341.224 3.879 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Br)o2)cc1F ZINC000768263008 1133119077 /nfs/dbraw/zinc/11/90/77/1133119077.db2.gz NRYJQUZQAJXLFN-UHFFFAOYSA-N 1 1 341.224 3.879 20 10 EHCDMO CCOC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000768358423 1133129313 /nfs/dbraw/zinc/12/93/13/1133129313.db2.gz UQDHFRZIJVXTTF-UHFFFAOYSA-N 1 1 344.455 3.933 20 10 EHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc(OC)c(OC)cc1O ZINC000768440883 1133139085 /nfs/dbraw/zinc/13/90/85/1133139085.db2.gz UTQCQIOEDKWJQB-UHFFFAOYSA-N 1 1 333.403 3.961 20 10 EHCDMO CCC[N@@H+](Cc1cc2c(cc1O)OC[C@@H]2O)[C@H]1CCc2ccccc21 ZINC000768443247 1133139287 /nfs/dbraw/zinc/13/92/87/1133139287.db2.gz BZGITQFBZFWJFW-ICSRJNTNSA-N 1 1 339.435 3.718 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1)[C@H](O)CO2 ZINC000768440924 1133139468 /nfs/dbraw/zinc/13/94/68/1133139468.db2.gz HUHGMJDTKWGKMS-FUHWJXTLSA-N 1 1 345.826 3.809 20 10 EHCDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768447934 1133140343 /nfs/dbraw/zinc/14/03/43/1133140343.db2.gz RSHOCHWQVMVTPO-AZUAARDMSA-N 1 1 327.424 3.647 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CC[C@H]3[C@@H](CCCN3C3CC3)C1)CCCC2 ZINC000768463434 1133144027 /nfs/dbraw/zinc/14/40/27/1133144027.db2.gz TUPBJRJHYRPUAZ-RXVVDRJESA-N 1 1 340.511 3.720 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]3[C@@H](CCCN3C3CC3)C1)CCCC2 ZINC000768463434 1133144032 /nfs/dbraw/zinc/14/40/32/1133144032.db2.gz TUPBJRJHYRPUAZ-RXVVDRJESA-N 1 1 340.511 3.720 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@H]2CCCCO2)c1 ZINC001178295248 1133153895 /nfs/dbraw/zinc/15/38/95/1133153895.db2.gz NCZXHEPUKCMIDO-CYBMUJFWSA-N 1 1 328.250 3.512 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cccc(OC)c1O ZINC000768564234 1133156706 /nfs/dbraw/zinc/15/67/06/1133156706.db2.gz LNSHKMLVFCDXCG-UHFFFAOYSA-N 1 1 329.440 3.666 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c1O ZINC000768886211 1133196734 /nfs/dbraw/zinc/19/67/34/1133196734.db2.gz OIJZJBPWCLMYRO-UHFFFAOYSA-N 1 1 349.434 3.535 20 10 EHCDMO CCOc1cccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1O ZINC000769034280 1133216291 /nfs/dbraw/zinc/21/62/91/1133216291.db2.gz MGUNYHRYZUGZJJ-LJQANCHMSA-N 1 1 341.451 3.972 20 10 EHCDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000769006887 1133220757 /nfs/dbraw/zinc/22/07/57/1133220757.db2.gz SFMYCKNNSXOUTN-UONOGXRCSA-N 1 1 338.879 3.562 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@H](C)[C@@H]2C)c1O ZINC000769222257 1133245797 /nfs/dbraw/zinc/24/57/97/1133245797.db2.gz FZPVPJCSNYVICQ-QWRGUYRKSA-N 1 1 328.250 3.784 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)cc1C ZINC000769424832 1133282563 /nfs/dbraw/zinc/28/25/63/1133282563.db2.gz PDIMEHXNODULGA-FQEVSTJZSA-N 1 1 325.452 3.881 20 10 EHCDMO COc1cccc(C[N@@H+](C[C@H]2CCCO2)C2CCC(C)CC2)c1O ZINC000769492205 1133291432 /nfs/dbraw/zinc/29/14/32/1133291432.db2.gz HCNPDIWOEADMJB-VMWRSERWSA-N 1 1 333.472 3.961 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCSC[C@H]1c1ccc(C)cc1 ZINC000769446370 1133292674 /nfs/dbraw/zinc/29/26/74/1133292674.db2.gz MKYDNKUYNHVJQS-KRWDZBQOSA-N 1 1 329.465 3.999 20 10 EHCDMO COc1cccc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)c1O ZINC000769498258 1133301487 /nfs/dbraw/zinc/30/14/87/1133301487.db2.gz SPWOISSWFLWMLA-UZLBHIALSA-N 1 1 341.451 3.980 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1c(C)cc(OC)cc1O ZINC001180017505 1133317451 /nfs/dbraw/zinc/31/74/51/1133317451.db2.gz DDWXURLNYFRXDV-UHFFFAOYSA-N 1 1 343.467 3.975 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)C[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 ZINC001180239677 1133350626 /nfs/dbraw/zinc/35/06/26/1133350626.db2.gz PDBNHJIQXQCIJJ-FQEVSTJZSA-N 1 1 348.487 3.861 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+]2CCC23CCOCC3)c(C)n1-c1ccccc1 ZINC000769892841 1133356026 /nfs/dbraw/zinc/35/60/26/1133356026.db2.gz IYVXTPLEUSZZOJ-UHFFFAOYSA-N 1 1 338.451 3.532 20 10 EHCDMO Cc1cc(C(=O)C[N@H+]2CCC23CCOCC3)c(C)n1-c1ccccc1 ZINC000769892841 1133356033 /nfs/dbraw/zinc/35/60/33/1133356033.db2.gz IYVXTPLEUSZZOJ-UHFFFAOYSA-N 1 1 338.451 3.532 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)c1 ZINC000770665223 1133456146 /nfs/dbraw/zinc/45/61/46/1133456146.db2.gz PCLIYVMQQLIWRQ-UHFFFAOYSA-N 1 1 331.362 3.968 20 10 EHCDMO CC(C)OC[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000770687957 1133462350 /nfs/dbraw/zinc/46/23/50/1133462350.db2.gz HWTHYCKPSLENOW-FQEVSTJZSA-N 1 1 341.451 3.685 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@@H+](CC(=O)OC(C)(C)C)CC1CC1 ZINC001182743749 1133727927 /nfs/dbraw/zinc/72/79/27/1133727927.db2.gz RZCVZSBULNZAGH-UHFFFAOYSA-N 1 1 332.488 3.615 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+](CC(=O)OC(C)(C)C)CC1CC1 ZINC001182743749 1133727931 /nfs/dbraw/zinc/72/79/31/1133727931.db2.gz RZCVZSBULNZAGH-UHFFFAOYSA-N 1 1 332.488 3.615 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1 ZINC000785613988 1133731907 /nfs/dbraw/zinc/73/19/07/1133731907.db2.gz HETPOORVALOCJO-CQSZACIVSA-N 1 1 348.176 3.800 20 10 EHCDMO COc1cc(C)c(C[N@H+]2CCC[C@H](c3cc(C(C)C)n[nH]3)C2)c(O)c1 ZINC001183662884 1133843890 /nfs/dbraw/zinc/84/38/90/1133843890.db2.gz SSWMFVBTUNKGMY-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)c(C[N@@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c(O)c1 ZINC001183662884 1133843896 /nfs/dbraw/zinc/84/38/96/1133843896.db2.gz SSWMFVBTUNKGMY-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)c(C[N@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c(O)c1 ZINC001183662884 1133843903 /nfs/dbraw/zinc/84/39/03/1133843903.db2.gz SSWMFVBTUNKGMY-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCNC(=O)OC(C)(C)C)C2CC2)cc1 ZINC000774836327 1134037360 /nfs/dbraw/zinc/03/73/60/1134037360.db2.gz SCBZIQQLLDJYHI-UHFFFAOYSA-N 1 1 347.503 3.632 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2ccccc2F)C(C)C)ccc1[N+](=O)[O-] ZINC000774831145 1134038525 /nfs/dbraw/zinc/03/85/25/1134038525.db2.gz CVSRKUVLPVLYJB-UHFFFAOYSA-N 1 1 348.374 3.859 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000774958314 1134156287 /nfs/dbraw/zinc/15/62/87/1134156287.db2.gz WYZOMQXQAFUDIV-UMVBOHGHSA-N 1 1 334.416 3.758 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cccc(C(F)(F)F)c1O ZINC000788694044 1134158454 /nfs/dbraw/zinc/15/84/54/1134158454.db2.gz UJUKWQNOPGYIGH-NEPJUHHUSA-N 1 1 345.361 3.747 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)Cc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000775013325 1134208506 /nfs/dbraw/zinc/20/85/06/1134208506.db2.gz UVKXOQLHDGYIEG-AWEZNQCLSA-N 1 1 344.411 3.647 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1O ZINC000790935528 1134479952 /nfs/dbraw/zinc/47/99/52/1134479952.db2.gz YJMCBUOVVDDDNH-DOMZBBRYSA-N 1 1 342.277 3.589 20 10 EHCDMO COc1cccc(OCCC[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790966831 1134486870 /nfs/dbraw/zinc/48/68/70/1134486870.db2.gz TXZMEMXUGANKSH-UHFFFAOYSA-N 1 1 339.794 3.752 20 10 EHCDMO Cn1cc([C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C(C)(C)C)cn1 ZINC000790975005 1134494083 /nfs/dbraw/zinc/49/40/83/1134494083.db2.gz YIPSUHMWDFOXOG-HNNXBMFYSA-N 1 1 325.815 3.795 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(-c3ccc(C)cc3)no2)c1 ZINC000775370325 1134674895 /nfs/dbraw/zinc/67/48/95/1134674895.db2.gz LMCDWQBRJPQMEF-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c(C(F)(F)F)c1 ZINC000792832860 1134798657 /nfs/dbraw/zinc/79/86/57/1134798657.db2.gz PUEXPIDSUATFCR-HIFRSBDPSA-N 1 1 342.405 3.630 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](CC2CC2)C2CCC2)c1O ZINC000793393427 1134923026 /nfs/dbraw/zinc/92/30/26/1134923026.db2.gz GRGMQDPJHMRRKH-UHFFFAOYSA-N 1 1 340.261 3.928 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c(C(F)(F)F)c1 ZINC000793608028 1134968521 /nfs/dbraw/zinc/96/85/21/1134968521.db2.gz HIVHJARDPBFIJH-SJORKVTESA-N 1 1 342.405 3.915 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1O ZINC000793605827 1134968955 /nfs/dbraw/zinc/96/89/55/1134968955.db2.gz RREGYSAKPUOFMG-HXUWFJFHSA-N 1 1 346.471 3.534 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCCC[C@H]2CCO)c1 ZINC000793608462 1134970666 /nfs/dbraw/zinc/97/06/66/1134970666.db2.gz ISKUQJOJVIUARW-AWEZNQCLSA-N 1 1 342.277 3.590 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCCC[C@H]2CCO)c1 ZINC000793608462 1134970670 /nfs/dbraw/zinc/97/06/70/1134970670.db2.gz ISKUQJOJVIUARW-AWEZNQCLSA-N 1 1 342.277 3.590 20 10 EHCDMO CCc1cc(C[N@@H+]2CC[C@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748808 1134988719 /nfs/dbraw/zinc/98/87/19/1134988719.db2.gz UISYEMMXQDHXFZ-NRFANRHFSA-N 1 1 330.516 3.780 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748808 1134988724 /nfs/dbraw/zinc/98/87/24/1134988724.db2.gz UISYEMMXQDHXFZ-NRFANRHFSA-N 1 1 330.516 3.780 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000775711516 1135548980 /nfs/dbraw/zinc/54/89/80/1135548980.db2.gz CLBNRENSSTXUME-OAHLLOKOSA-N 1 1 326.843 3.635 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000775711516 1135548986 /nfs/dbraw/zinc/54/89/86/1135548986.db2.gz CLBNRENSSTXUME-OAHLLOKOSA-N 1 1 326.843 3.635 20 10 EHCDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000775725615 1135577309 /nfs/dbraw/zinc/57/73/09/1135577309.db2.gz JRGNXLYSSMGIFE-OAHLLOKOSA-N 1 1 329.440 3.720 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000775739184 1135596804 /nfs/dbraw/zinc/59/68/04/1135596804.db2.gz MJXJLNZTSKVEAU-YVEFUNNKSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000775739184 1135596808 /nfs/dbraw/zinc/59/68/08/1135596808.db2.gz MJXJLNZTSKVEAU-YVEFUNNKSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000775739184 1135596814 /nfs/dbraw/zinc/59/68/14/1135596814.db2.gz MJXJLNZTSKVEAU-YVEFUNNKSA-N 1 1 338.854 3.633 20 10 EHCDMO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c1O ZINC000775739460 1135597218 /nfs/dbraw/zinc/59/72/18/1135597218.db2.gz HLOXBALACMEQIZ-HOCLYGCPSA-N 1 1 334.460 3.578 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](N4CCCC4)[C@@H]3C)c2c1 ZINC000808190145 1135628395 /nfs/dbraw/zinc/62/83/95/1135628395.db2.gz CUJGADQSIPKJGD-YWZLYKJASA-N 1 1 340.467 3.613 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CC[C@H]([NH+]4CCCC4)[C@@H]3C)c2c1 ZINC000808190145 1135628399 /nfs/dbraw/zinc/62/83/99/1135628399.db2.gz CUJGADQSIPKJGD-YWZLYKJASA-N 1 1 340.467 3.613 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1c1cccc(F)c1 ZINC000747467493 1135633592 /nfs/dbraw/zinc/63/35/92/1135633592.db2.gz PHPIRNKHWVOMCS-BLVKFPJESA-N 1 1 329.371 3.843 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCN(c3ccccc3F)CC2)c1 ZINC000809712537 1135875941 /nfs/dbraw/zinc/87/59/41/1135875941.db2.gz PRSXNHAAULAHLX-UHFFFAOYSA-N 1 1 344.430 3.642 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H]2CCC(=O)NC)cc1F ZINC000809712960 1135876538 /nfs/dbraw/zinc/87/65/38/1135876538.db2.gz BCUZKSVPZNBWIU-KRWDZBQOSA-N 1 1 349.494 3.553 20 10 EHCDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000809780805 1135890875 /nfs/dbraw/zinc/89/08/75/1135890875.db2.gz KCCIVCFFBIHQSO-OAHLLOKOSA-N 1 1 329.396 3.713 20 10 EHCDMO CCOc1cccc(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c1O ZINC000809789711 1135892089 /nfs/dbraw/zinc/89/20/89/1135892089.db2.gz AJYQAHOYWGHLGM-UHFFFAOYSA-N 1 1 327.424 3.964 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC3(C2)Oc2ccccc2O3)c1O ZINC000809790086 1135892483 /nfs/dbraw/zinc/89/24/83/1135892483.db2.gz XICFZMBULUWMAS-UHFFFAOYSA-N 1 1 331.799 3.727 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(C(F)(F)F)cc1O ZINC000810253837 1135948724 /nfs/dbraw/zinc/94/87/24/1135948724.db2.gz DWNRRAZSBIASEQ-AAEUAGOBSA-N 1 1 339.361 3.732 20 10 EHCDMO CC[C@H](C)C[N@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001201504490 1136029740 /nfs/dbraw/zinc/02/97/40/1136029740.db2.gz WCMWZOXRSNYXBC-GHTZIAJQSA-N 1 1 346.515 3.660 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC(C)(C)[C@@H]3[C@H]3CCCO3)c2c1 ZINC000811777883 1136134189 /nfs/dbraw/zinc/13/41/89/1136134189.db2.gz KPEBBMCFJBQBQW-UXHICEINSA-N 1 1 341.451 3.943 20 10 EHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1c(O)ccc3ccncc31)C2 ZINC000811792561 1136141577 /nfs/dbraw/zinc/14/15/77/1136141577.db2.gz DAGGLOTUMGQDCV-UHFFFAOYSA-N 1 1 346.430 3.996 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CCC[C@@H](C)O2)c1 ZINC000850379297 1136245954 /nfs/dbraw/zinc/24/59/54/1136245954.db2.gz KIBMNSMCWPYRHA-DGCLKSJQSA-N 1 1 328.250 3.510 20 10 EHCDMO CCSC1(C[NH2+]Cc2cc(C)cc(Br)c2O)CC1 ZINC000850394512 1136248219 /nfs/dbraw/zinc/24/82/19/1136248219.db2.gz UVMXYCKIRXCZBG-UHFFFAOYSA-N 1 1 330.291 3.838 20 10 EHCDMO OC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccc(F)cc1F ZINC000850409942 1136252183 /nfs/dbraw/zinc/25/21/83/1136252183.db2.gz DJLLMTJCWMKBSZ-FQEVSTJZSA-N 1 1 346.421 3.778 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](C)=O)C1)c1cccc(C(F)(F)F)c1O ZINC000850500614 1136272593 /nfs/dbraw/zinc/27/25/93/1136272593.db2.gz FLKISIUHOQIPAP-TZQMRVBYSA-N 1 1 349.418 3.751 20 10 EHCDMO CC[C@@H]([NH2+][C@H](COC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000850513779 1136274769 /nfs/dbraw/zinc/27/47/69/1136274769.db2.gz JJEJVCYSFIGDET-QZTJIDSGSA-N 1 1 333.403 3.968 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H](O)c1cccc(F)c1 ZINC000109761233 1136339389 /nfs/dbraw/zinc/33/93/89/1136339389.db2.gz SOIRDXXCFWTNGM-HXUWFJFHSA-N 1 1 341.382 3.860 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000813791962 1136362908 /nfs/dbraw/zinc/36/29/08/1136362908.db2.gz MUTKCGLVPZTOHA-LLVKDONJSA-N 1 1 338.785 3.692 20 10 EHCDMO C[N@H+](Cc1cn2cc(Cl)cc(Cl)c2n1)Cc1ccccc1O ZINC000111235788 1136524607 /nfs/dbraw/zinc/52/46/07/1136524607.db2.gz UTKRDDRVIYKIAI-UHFFFAOYSA-N 1 1 336.222 3.979 20 10 EHCDMO C[N@@H+](Cc1cn2cc(Cl)cc(Cl)c2n1)Cc1ccccc1O ZINC000111235788 1136524610 /nfs/dbraw/zinc/52/46/10/1136524610.db2.gz UTKRDDRVIYKIAI-UHFFFAOYSA-N 1 1 336.222 3.979 20 10 EHCDMO Cc1cc(C[N@H+](C)CC(=O)Nc2ccccc2Cl)ccc1N(C)C ZINC000815015459 1136537452 /nfs/dbraw/zinc/53/74/52/1136537452.db2.gz IGJRGZNWPCIDAI-UHFFFAOYSA-N 1 1 345.874 3.785 20 10 EHCDMO Cc1cc(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)ccc1N(C)C ZINC000815015459 1136537454 /nfs/dbraw/zinc/53/74/54/1136537454.db2.gz IGJRGZNWPCIDAI-UHFFFAOYSA-N 1 1 345.874 3.785 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCOCC3)[C@H]1c1ccco1)CCC2 ZINC000853552002 1136544284 /nfs/dbraw/zinc/54/42/84/1136544284.db2.gz RHMBZTHEAPJXGJ-HXUWFJFHSA-N 1 1 339.435 3.828 20 10 EHCDMO Cc1cc(C[N@H+]2CCN(C(=O)C(C)(C)C)CC2(C)C)ccc1N(C)C ZINC000815083753 1136549206 /nfs/dbraw/zinc/54/92/06/1136549206.db2.gz ABWMBWKTADJDQV-UHFFFAOYSA-N 1 1 345.531 3.530 20 10 EHCDMO Cc1cc(CN2CCO[C@@H](CCC[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000853623165 1136550537 /nfs/dbraw/zinc/55/05/37/1136550537.db2.gz FRQWSLUBPDFICZ-SFHVURJKSA-N 1 1 348.531 3.541 20 10 EHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815101796 1136556030 /nfs/dbraw/zinc/55/60/30/1136556030.db2.gz ARVBVNMOKOCIHY-UHFFFAOYSA-N 1 1 328.504 3.732 20 10 EHCDMO C[C@@H]([NH2+]CCN1CCC(C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815559285 1136610760 /nfs/dbraw/zinc/61/07/60/1136610760.db2.gz CMVYOCQVOJEVNV-CYBMUJFWSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@H]([NH2+]CCNC(=O)OC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815572644 1136617933 /nfs/dbraw/zinc/61/79/33/1136617933.db2.gz JSHWQAQPPRTSNA-JTQLQIEISA-N 1 1 348.365 3.586 20 10 EHCDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ncc(Br)cn2)c1 ZINC000815634291 1136621851 /nfs/dbraw/zinc/62/18/51/1136621851.db2.gz HYZIIQRTMPXCLJ-GHMZBOCLSA-N 1 1 336.233 3.665 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](C)Cc2ccc3ccccc3c2O)oc1C ZINC000816483263 1136723812 /nfs/dbraw/zinc/72/38/12/1136723812.db2.gz LZFLMACCVZOXKN-UHFFFAOYSA-N 1 1 339.391 3.865 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(OC)ccc3F)CC2)cc1 ZINC000816494913 1136724547 /nfs/dbraw/zinc/72/45/47/1136724547.db2.gz DFPNHIXKTLXIFW-UHFFFAOYSA-N 1 1 344.430 3.555 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000816520322 1136727311 /nfs/dbraw/zinc/72/73/11/1136727311.db2.gz LZWCVSOCZMHZPD-WBMJQRKESA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000816520322 1136727313 /nfs/dbraw/zinc/72/73/13/1136727313.db2.gz LZWCVSOCZMHZPD-WBMJQRKESA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000816535456 1136730564 /nfs/dbraw/zinc/73/05/64/1136730564.db2.gz PBTHCROQOSEIIK-UHFFFAOYSA-N 1 1 331.778 3.660 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccsc1 ZINC000816532037 1136730756 /nfs/dbraw/zinc/73/07/56/1136730756.db2.gz OUYDFSCGYMSJEO-AWEZNQCLSA-N 1 1 328.840 3.639 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000816659603 1136745738 /nfs/dbraw/zinc/74/57/38/1136745738.db2.gz UFWALLXMFJHJNR-OAHLLOKOSA-N 1 1 333.815 3.708 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCc3cc(OC)c(Cl)cc3C2)c1 ZINC000816665140 1136746453 /nfs/dbraw/zinc/74/64/53/1136746453.db2.gz UUBIMZJEQITGJT-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCc3cc(OC)c(Cl)cc3C2)c1 ZINC000816665140 1136746457 /nfs/dbraw/zinc/74/64/57/1136746457.db2.gz UUBIMZJEQITGJT-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000816675431 1136747757 /nfs/dbraw/zinc/74/77/57/1136747757.db2.gz AMCRPFOKMKGMQM-HNNXBMFYSA-N 1 1 342.277 3.710 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000816675431 1136747759 /nfs/dbraw/zinc/74/77/59/1136747759.db2.gz AMCRPFOKMKGMQM-HNNXBMFYSA-N 1 1 342.277 3.710 20 10 EHCDMO CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817986531 1136855477 /nfs/dbraw/zinc/85/54/77/1136855477.db2.gz RFDYOJJMGPVBOM-OAHLLOKOSA-N 1 1 328.378 3.762 20 10 EHCDMO CC(C)c1ncc2c(n1)CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000857876660 1136916701 /nfs/dbraw/zinc/91/67/01/1136916701.db2.gz IUCQLGQNNHBSFV-AATRIKPKSA-N 1 1 336.483 3.738 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCc2scnc21)c1ccc(N2CCOCC2)cc1 ZINC000858355949 1136961194 /nfs/dbraw/zinc/96/11/94/1136961194.db2.gz SNJZQFZKQVSVFR-WMLDXEAASA-N 1 1 343.496 3.708 20 10 EHCDMO CCn1ncc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)n1 ZINC000858443330 1136967908 /nfs/dbraw/zinc/96/79/08/1136967908.db2.gz JICPLADLYVJYKT-INIZCTEOSA-N 1 1 327.476 3.529 20 10 EHCDMO COc1ccc(N2CC[NH+](CC[C@@H]3CC3(Cl)Cl)CC2)cc1F ZINC000822681055 1137070133 /nfs/dbraw/zinc/07/01/33/1137070133.db2.gz KQZRHKQULOGZIW-GFCCVEGCSA-N 1 1 347.261 3.540 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCCO1 ZINC000823433052 1137099405 /nfs/dbraw/zinc/09/94/05/1137099405.db2.gz QBJZEPHNSWOEDZ-MRXNPFEDSA-N 1 1 330.497 3.995 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@H]1O ZINC000823490174 1137102372 /nfs/dbraw/zinc/10/23/72/1137102372.db2.gz WCLDKWCGIKNULH-QFBILLFUSA-N 1 1 330.497 3.587 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@](C)(O)c2ccccc2)c1O ZINC000823591978 1137107399 /nfs/dbraw/zinc/10/73/99/1137107399.db2.gz OIOQZABAQHKCES-IBGZPJMESA-N 1 1 347.842 3.588 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000862024662 1137127328 /nfs/dbraw/zinc/12/73/28/1137127328.db2.gz BGYUFWUKXQJJPM-QZTJIDSGSA-N 1 1 345.531 3.802 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CC[C@@H]1O ZINC000824214210 1137128550 /nfs/dbraw/zinc/12/85/50/1137128550.db2.gz BYOKBZDWXIMXJA-BEFAXECRSA-N 1 1 330.497 3.587 20 10 EHCDMO CC[C@@H](COCC(F)(F)F)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824554641 1137142573 /nfs/dbraw/zinc/14/25/73/1137142573.db2.gz JKJFFIXSCSZUEM-VIFPVBQESA-N 1 1 329.721 3.632 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccccc2CC(C)C)ccc1[N+](=O)[O-] ZINC000862434663 1137144397 /nfs/dbraw/zinc/14/43/97/1137144397.db2.gz ZYCYVRKNAZLGPX-UHFFFAOYSA-N 1 1 344.411 3.797 20 10 EHCDMO CCc1cccc(C[N@H+]2CCc3nc(C(C)(C)C)ncc3C2)c1O ZINC000862440381 1137144774 /nfs/dbraw/zinc/14/47/74/1137144774.db2.gz MQNXJQHYWQRFTA-UHFFFAOYSA-N 1 1 325.456 3.600 20 10 EHCDMO C[C@H]1C[NH+](Cc2cccc(Br)c2O)C[C@H](C)C1(F)F ZINC000862442271 1137145119 /nfs/dbraw/zinc/14/51/19/1137145119.db2.gz HISZSEPWPFLSES-UWVGGRQHSA-N 1 1 334.204 3.878 20 10 EHCDMO CC[N@@H+](CCc1ccccn1)Cc1ccc(Br)cc1O ZINC000824610797 1137145160 /nfs/dbraw/zinc/14/51/60/1137145160.db2.gz QWIPRHKISTUOMW-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c(O)cc1C ZINC000863303668 1137180405 /nfs/dbraw/zinc/18/04/05/1137180405.db2.gz YEZXBWMTKAKQLT-ZBFHGGJFSA-N 1 1 349.471 3.509 20 10 EHCDMO CC(C)(C)c1cc(C[NH2+]CC2(N)CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000863645105 1137196455 /nfs/dbraw/zinc/19/64/55/1137196455.db2.gz BNUOPJLHCRWCIK-UHFFFAOYSA-N 1 1 348.531 3.585 20 10 EHCDMO CC(C)(C)c1cc(CNCC2([NH3+])CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000863645105 1137196457 /nfs/dbraw/zinc/19/64/57/1137196457.db2.gz BNUOPJLHCRWCIK-UHFFFAOYSA-N 1 1 348.531 3.585 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)[C@@H](C)c2nc3ccccc3o2)cc1 ZINC000844400496 1137217253 /nfs/dbraw/zinc/21/72/53/1137217253.db2.gz CRZHEHIHBVPYBN-HNNXBMFYSA-N 1 1 339.439 3.966 20 10 EHCDMO CC[C@@H](Nc1ccc(N2CCOCC2)[nH+]c1C)c1ccc(C)cc1O ZINC000794815914 1137263570 /nfs/dbraw/zinc/26/35/70/1137263570.db2.gz ILRKYRGOCWEOCM-QGZVFWFLSA-N 1 1 341.455 3.804 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC000866482228 1137358257 /nfs/dbraw/zinc/35/82/57/1137358257.db2.gz VSLHDSRHXSQFQC-RDTXWAMCSA-N 1 1 347.455 3.569 20 10 EHCDMO CCC1([NH+](C)C)CCN(Cc2c(O)ccc3ccc(OC)cc32)CC1 ZINC000872669850 1137582620 /nfs/dbraw/zinc/58/26/20/1137582620.db2.gz VIPGQAKXQRQKGN-UHFFFAOYSA-N 1 1 342.483 3.860 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](C)c2ncc(C)s2)cc1Cn1cccn1 ZINC000873071968 1137589498 /nfs/dbraw/zinc/58/94/98/1137589498.db2.gz NXURRUYRBPDFCR-AWEZNQCLSA-N 1 1 342.468 3.556 20 10 EHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000125812840 1137646251 /nfs/dbraw/zinc/64/62/51/1137646251.db2.gz MAGILNZCXGNSFX-QGZVFWFLSA-N 1 1 340.467 3.725 20 10 EHCDMO COc1cncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1C ZINC000876510411 1137654416 /nfs/dbraw/zinc/65/44/16/1137654416.db2.gz NBHLVNQVFHAJOH-UHFFFAOYSA-N 1 1 338.407 3.900 20 10 EHCDMO COc1cncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1C ZINC000876510411 1137654417 /nfs/dbraw/zinc/65/44/17/1137654417.db2.gz NBHLVNQVFHAJOH-UHFFFAOYSA-N 1 1 338.407 3.900 20 10 EHCDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876554206 1137655474 /nfs/dbraw/zinc/65/54/74/1137655474.db2.gz GGAWOSYEJTWGAL-MRXNPFEDSA-N 1 1 342.458 3.980 20 10 EHCDMO C[N@@H+](CCCc1ccccc1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876581329 1137656160 /nfs/dbraw/zinc/65/61/60/1137656160.db2.gz GVUWPWKFVJVTMB-UHFFFAOYSA-N 1 1 338.495 3.712 20 10 EHCDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876733014 1137659860 /nfs/dbraw/zinc/65/98/60/1137659860.db2.gz MEHRZHKIUMUBQC-BLIXFSHQSA-N 1 1 328.500 3.801 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@]4(CC=CCC4)C3)cc2)CC1 ZINC000876739174 1137659962 /nfs/dbraw/zinc/65/99/62/1137659962.db2.gz AHRUNAYKBYXDPR-JOCHJYFZSA-N 1 1 340.511 3.970 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCS[C@H]4CCCC[C@H]43)cc2)CC1 ZINC000876771803 1137660981 /nfs/dbraw/zinc/66/09/81/1137660981.db2.gz ZGSONBAZZUYDAC-UXHICEINSA-N 1 1 346.540 3.508 20 10 EHCDMO Cc1cccc(O)c1CNc1cccc([C@H](C)[NH+]2CCOCC2)c1 ZINC000876859161 1137663993 /nfs/dbraw/zinc/66/39/93/1137663993.db2.gz PBQFZTCCNMVGCM-INIZCTEOSA-N 1 1 326.440 3.706 20 10 EHCDMO c1ccc2oc(C[NH2+]Cc3ccc(N4CCSCC4)cc3)nc2c1 ZINC000876943786 1137665914 /nfs/dbraw/zinc/66/59/14/1137665914.db2.gz VEWCXMSDHNREAL-UHFFFAOYSA-N 1 1 339.464 3.671 20 10 EHCDMO COc1cc(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)on1 ZINC000877635221 1137683772 /nfs/dbraw/zinc/68/37/72/1137683772.db2.gz JLRHLOSDDCZGHK-UHFFFAOYSA-N 1 1 349.434 3.536 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1c(F)cccc1F ZINC000883025396 1137841844 /nfs/dbraw/zinc/84/18/44/1137841844.db2.gz JAZSMGCJBQGZOX-PBHICJAKSA-N 1 1 343.320 3.550 20 10 EHCDMO CC(C)(CO)[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883073706 1137843545 /nfs/dbraw/zinc/84/35/45/1137843545.db2.gz YHKGOMBUCDRATN-INIZCTEOSA-N 1 1 335.394 3.562 20 10 EHCDMO COc1ccc([C@H](OC)[C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000883081688 1137843832 /nfs/dbraw/zinc/84/38/32/1137843832.db2.gz LXTSSKNJQRELGJ-ADLMAVQZSA-N 1 1 337.366 3.545 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000883289905 1137852920 /nfs/dbraw/zinc/85/29/20/1137852920.db2.gz DOKHFUWWECIWPV-JOCHJYFZSA-N 1 1 335.495 3.679 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000282870101 1137891588 /nfs/dbraw/zinc/89/15/88/1137891588.db2.gz XWIBJQMFMJTPNC-INIZCTEOSA-N 1 1 325.456 3.613 20 10 EHCDMO Cc1cnc([C@H](C)[NH2+]Cc2cccc(Br)c2O)s1 ZINC000134906815 1137961419 /nfs/dbraw/zinc/96/14/19/1137961419.db2.gz OSXWYWLAKKZOPI-VIFPVBQESA-N 1 1 327.247 3.770 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc2cccnc21 ZINC000066610093 1138076471 /nfs/dbraw/zinc/07/64/71/1138076471.db2.gz GCTXBQWRXVMQLY-UHFFFAOYSA-N 1 1 347.462 3.703 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1c(O)cccc1F ZINC000886502570 1138084844 /nfs/dbraw/zinc/08/48/44/1138084844.db2.gz DOIOLZHTZNDRRJ-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(N2CCOCC2)cc1 ZINC000886512628 1138087222 /nfs/dbraw/zinc/08/72/22/1138087222.db2.gz JUJZSGZUBSFCLA-GJZGRUSLSA-N 1 1 344.430 3.780 20 10 EHCDMO COCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886539049 1138093122 /nfs/dbraw/zinc/09/31/22/1138093122.db2.gz SCZKBYYQAPKECA-AWEZNQCLSA-N 1 1 333.403 3.716 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1c(O)cccc1F ZINC000886549517 1138094732 /nfs/dbraw/zinc/09/47/32/1138094732.db2.gz JDIABBKVLMDIRC-OTYXRUKQSA-N 1 1 327.758 3.708 20 10 EHCDMO CC(=O)N1CC[C@H]([NH2+][C@H](C)c2c(O)cccc2F)c2ccccc21 ZINC000886556746 1138095873 /nfs/dbraw/zinc/09/58/73/1138095873.db2.gz JJRHZYCRJWZMTF-WBMJQRKESA-N 1 1 328.387 3.680 20 10 EHCDMO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1c(O)cccc1F ZINC000886614085 1138102188 /nfs/dbraw/zinc/10/21/88/1138102188.db2.gz MZKMLCOPIAJLRI-JTQLQIEISA-N 1 1 328.309 3.838 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@H](OC(C)(C)C)[C@@H]1n1cccn1)c1c(O)cccc1F ZINC000886621731 1138103342 /nfs/dbraw/zinc/10/33/42/1138103342.db2.gz ACAGJLWBUYUQHF-PZMTTYODSA-N 1 1 347.434 3.576 20 10 EHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3F)no2)c(O)c1 ZINC000886714135 1138123750 /nfs/dbraw/zinc/12/37/50/1138123750.db2.gz CJQUNNQDQLIWST-CYBMUJFWSA-N 1 1 341.386 3.664 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@@H]2C)O1)c1ccc(F)cc1O ZINC000886768668 1138136753 /nfs/dbraw/zinc/13/67/53/1138136753.db2.gz FYPYAHMUSWZFKR-RZNHCAFUSA-N 1 1 337.435 3.545 20 10 EHCDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1O ZINC000083170135 1138174824 /nfs/dbraw/zinc/17/48/24/1138174824.db2.gz IPVJIQIFBWUUCW-UHFFFAOYSA-N 1 1 341.367 3.854 20 10 EHCDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc(OC)c1O)CCC2 ZINC000093767985 1138240825 /nfs/dbraw/zinc/24/08/25/1138240825.db2.gz KILQKVAJGNJPHG-AWEZNQCLSA-N 1 1 332.469 3.929 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)N(C)C1CC1)Cc1ccccc1O ZINC000179642730 1139771323 /nfs/dbraw/zinc/77/13/23/1139771323.db2.gz ZKLZXSVAXHDUAF-MRXNPFEDSA-N 1 1 338.451 3.576 20 10 EHCDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(OC)ccc1O)CCC2 ZINC000180544646 1139843753 /nfs/dbraw/zinc/84/37/53/1139843753.db2.gz LUIHSZNFBBHRPG-HNNXBMFYSA-N 1 1 332.469 3.929 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCc3c(ncn3CCc3ccccc3)C2)c1O ZINC000182144290 1139954193 /nfs/dbraw/zinc/95/41/93/1139954193.db2.gz FRWMOZZQEBPPSF-UHFFFAOYSA-N 1 1 347.462 3.698 20 10 EHCDMO Cc1cccc(C[N@H+]2CCc3c(ncn3CCc3ccccc3)C2)c1O ZINC000182144290 1139954198 /nfs/dbraw/zinc/95/41/98/1139954198.db2.gz FRWMOZZQEBPPSF-UHFFFAOYSA-N 1 1 347.462 3.698 20 10 EHCDMO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C[C@@H]1CCCOC1 ZINC000183050694 1140010053 /nfs/dbraw/zinc/01/00/53/1140010053.db2.gz LVQPCIJPLRBFLU-SFHVURJKSA-N 1 1 341.451 3.830 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@@H](C)c1ccc(F)cc1O)O[C@@H](C)C2 ZINC000184975061 1140129199 /nfs/dbraw/zinc/12/91/99/1140129199.db2.gz IDZZXMDOOMABPC-RYUDHWBXSA-N 1 1 331.387 3.714 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184997936 1140130683 /nfs/dbraw/zinc/13/06/83/1140130683.db2.gz HISYGRXWWTZMRS-MNOVXSKESA-N 1 1 329.271 3.834 20 10 EHCDMO CC(C)NC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185087134 1140136098 /nfs/dbraw/zinc/13/60/98/1140136098.db2.gz MRLVFAREZFJPID-ZDUSSCGKSA-N 1 1 345.418 3.912 20 10 EHCDMO COCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185681905 1140162888 /nfs/dbraw/zinc/16/28/88/1140162888.db2.gz YLTOWPOFCDXSFV-AWEZNQCLSA-N 1 1 333.403 3.716 20 10 EHCDMO C[C@@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(F)cc1O ZINC000186152380 1140189006 /nfs/dbraw/zinc/18/90/06/1140189006.db2.gz PGBYNFYZGGCTOK-CABCVRRESA-N 1 1 343.446 3.803 20 10 EHCDMO CC(=O)N1CCC(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000192837008 1140552752 /nfs/dbraw/zinc/55/27/52/1140552752.db2.gz BDVMLUBBRZICET-JTQLQIEISA-N 1 1 345.270 3.608 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN(C)[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874312 201115118 /nfs/dbraw/zinc/11/51/18/201115118.db2.gz RFPFCDWPSHWPCC-YYFZDKIDSA-N 1 1 328.431 3.875 20 10 EHCDMO COc1ccc(-c2noc([C@H](C)[N@H+](C)Cc3ccccc3O)n2)cc1 ZINC000153880892 1014279656 /nfs/dbraw/zinc/27/96/56/1014279656.db2.gz BPUWBVRXGCIXPE-ZDUSSCGKSA-N 1 1 339.395 3.644 20 10 EHCDMO COc1ccc(-c2noc([C@H](C)[N@@H+](C)Cc3ccccc3O)n2)cc1 ZINC000153880892 1014279663 /nfs/dbraw/zinc/27/96/63/1014279663.db2.gz BPUWBVRXGCIXPE-ZDUSSCGKSA-N 1 1 339.395 3.644 20 10 EHCDMO CC(C)c1cc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)on1 ZINC000169287583 1016937870 /nfs/dbraw/zinc/93/78/70/1016937870.db2.gz BWEPQTZVGCKFJA-AWEZNQCLSA-N 1 1 347.434 3.625 20 10 EHCDMO Cc1[nH]c2ccccc2c1C1=CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000574209467 1032739848 /nfs/dbraw/zinc/73/98/48/1032739848.db2.gz OLSWIQXTKWJJQU-UHFFFAOYSA-N 1 1 333.439 3.626 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1cc(C)ccc1O ZINC000160740807 1020367829 /nfs/dbraw/zinc/36/78/29/1020367829.db2.gz HHSLSSIRCRIJCU-UHFFFAOYSA-N 1 1 326.440 3.860 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1OC ZINC000276230965 1020947862 /nfs/dbraw/zinc/94/78/62/1020947862.db2.gz RUBVFQJQPNXVJI-CQSZACIVSA-N 1 1 333.350 3.572 20 10 EHCDMO COC1CCC(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CC1 ZINC000891468741 1021702500 /nfs/dbraw/zinc/70/25/00/1021702500.db2.gz XAAVVWIXRFNYJZ-NKELODKYSA-N 1 1 333.472 3.578 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(F)cc1O ZINC000796714921 1022240059 /nfs/dbraw/zinc/24/00/59/1022240059.db2.gz DJVYFPHTUSHWSE-GOSISDBHSA-N 1 1 325.387 3.958 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](C)c2nnc([C@H](C)CC)[nH]2)ccc1OC ZINC000276759703 1022645682 /nfs/dbraw/zinc/64/56/82/1022645682.db2.gz ADZMYPJVGXXBRK-ZIAGYGMSSA-N 1 1 346.475 3.714 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3ccc[nH]3)cc2)CC1 ZINC000295665244 1023281191 /nfs/dbraw/zinc/28/11/91/1023281191.db2.gz IRCUUEUKOZFCSG-OAQYLSRUSA-N 1 1 339.483 3.967 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nnc([C@H](C)CC)[nH]2)c(O)c1 ZINC000277060385 1023727893 /nfs/dbraw/zinc/72/78/93/1023727893.db2.gz BRYZESOXSVVCNS-OLZOCXBDSA-N 1 1 332.448 3.663 20 10 EHCDMO Cc1nc([C@@H]2CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)no1 ZINC000896239799 1025281380 /nfs/dbraw/zinc/28/13/80/1025281380.db2.gz LVJBYDSPLRVKJM-QGZVFWFLSA-N 1 1 335.407 3.740 20 10 EHCDMO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3nccn3C)cc2Cl)C1 ZINC000282092155 1033284801 /nfs/dbraw/zinc/28/48/01/1033284801.db2.gz RZKLTZDTNCWMHN-CQSZACIVSA-N 1 1 332.879 3.600 20 10 EHCDMO CCOc1cc(C[NH2+]Cc2c(O)cccc2F)cc(Cl)c1O ZINC000896638383 1025791683 /nfs/dbraw/zinc/79/16/83/1025791683.db2.gz PLLVPWBMIIRFGI-UHFFFAOYSA-N 1 1 325.767 3.579 20 10 EHCDMO CCN(CC)C(=O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176677065 1026426559 /nfs/dbraw/zinc/42/65/59/1026426559.db2.gz OCYWETZKKCVUCN-KRWDZBQOSA-N 1 1 340.467 3.824 20 10 EHCDMO COCC[C@H]([NH2+][C@H](C)c1cc(C(=O)OC)ccc1O)c1ccc(C)o1 ZINC000273384705 1027405600 /nfs/dbraw/zinc/40/56/00/1027405600.db2.gz CQRHLCZFOCJOSY-CJNGLKHVSA-N 1 1 347.411 3.509 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)c1 ZINC000273432228 1027425620 /nfs/dbraw/zinc/42/56/20/1027425620.db2.gz WAJUUYDDXQAMAO-ZIAGYGMSSA-N 1 1 343.423 3.908 20 10 EHCDMO CCOCc1ccccc1C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000273439595 1027428176 /nfs/dbraw/zinc/42/81/76/1027428176.db2.gz YAXZULSPAZJJND-AWEZNQCLSA-N 1 1 343.423 3.566 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1ccc(F)cc1O ZINC000273467854 1027442621 /nfs/dbraw/zinc/44/26/21/1027442621.db2.gz JGOHQMYZXQVLEH-GXTWGEPZSA-N 1 1 325.449 3.627 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1 ZINC000245944500 1029502727 /nfs/dbraw/zinc/50/27/27/1029502727.db2.gz VKZUDOVWSMKTGT-FXAWDEMLSA-N 1 1 345.414 3.628 20 10 EHCDMO COc1ccc2c(c1)CCC[N@H+](Cc1c(O)ccc3ccncc31)C2 ZINC000728562629 1029707289 /nfs/dbraw/zinc/70/72/89/1029707289.db2.gz AIQICTATJOIVGR-UHFFFAOYSA-N 1 1 334.419 3.897 20 10 EHCDMO CC(C)O[C@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000404586966 1029811218 /nfs/dbraw/zinc/81/12/18/1029811218.db2.gz VDPOCZSNXPNYNH-ZDUSSCGKSA-N 1 1 328.250 3.544 20 10 EHCDMO CC(C)O[C@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000404586966 1029811227 /nfs/dbraw/zinc/81/12/27/1029811227.db2.gz VDPOCZSNXPNYNH-ZDUSSCGKSA-N 1 1 328.250 3.544 20 10 EHCDMO Oc1c(F)cccc1C[NH+]1CCC(O)(c2ccccc2Cl)CC1 ZINC000278380752 1030496595 /nfs/dbraw/zinc/49/65/95/1030496595.db2.gz LRNLTDWNRPBVSD-UHFFFAOYSA-N 1 1 335.806 3.668 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)c2ncccc2F)c1 ZINC000527827532 1031294620 /nfs/dbraw/zinc/29/46/20/1031294620.db2.gz DZVOWWCRITUHRF-JTQLQIEISA-N 1 1 339.208 3.848 20 10 EHCDMO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000278556097 1031366797 /nfs/dbraw/zinc/36/67/97/1031366797.db2.gz ARSYWWOSNXRDJW-OAHLLOKOSA-N 1 1 330.384 3.940 20 10 EHCDMO CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1[O-] ZINC000227433984 1034001582 /nfs/dbraw/zinc/00/15/82/1034001582.db2.gz QKXWJKBRVJIVDX-ZDUSSCGKSA-N 1 1 343.309 3.755 20 10 EHCDMO Cc1cc(N[C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)nc(C)n1 ZINC000780544417 1034248674 /nfs/dbraw/zinc/24/86/74/1034248674.db2.gz DZWFFTNFHAAFKB-INIZCTEOSA-N 1 1 346.862 3.529 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCc3nc(C(C)(C)C)ncc3C2)cc1C ZINC000529640205 1034329774 /nfs/dbraw/zinc/32/97/74/1034329774.db2.gz GYAYZWCMFCXIQP-UHFFFAOYSA-N 1 1 325.456 3.655 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2C[C@@H]3C[C@]3(CO)C2)cc1 ZINC000783742747 1035882703 /nfs/dbraw/zinc/88/27/03/1035882703.db2.gz OXCUSSQYHARSPL-RBBKRZOGSA-N 1 1 336.479 3.527 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(-n2cncn2)c(C)c1 ZINC000156837151 1036006482 /nfs/dbraw/zinc/00/64/82/1036006482.db2.gz BBEBVLDRGYQLGW-UHFFFAOYSA-N 1 1 349.482 3.664 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCc2n[nH]cc2C1)c1cc(Cl)c(Cl)cc1O ZINC000193023898 1036572845 /nfs/dbraw/zinc/57/28/45/1036572845.db2.gz SCQXRTSDGDGSQX-WCBMZHEXSA-N 1 1 326.227 3.630 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000893915227 1039823010 /nfs/dbraw/zinc/82/30/10/1039823010.db2.gz SCTYWZJDQMLTBO-UHFFFAOYSA-N 1 1 333.378 3.852 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(F)cc1O ZINC000310090609 1041307213 /nfs/dbraw/zinc/30/72/13/1041307213.db2.gz QSYCTGNHKPXGET-QMTMVMCOSA-N 1 1 328.431 3.845 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2SC)c(O)c1OC ZINC000894140917 1041313770 /nfs/dbraw/zinc/31/37/70/1041313770.db2.gz HSUUOTWRDYMLOA-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1OC(F)F ZINC000184950005 1126722584 /nfs/dbraw/zinc/72/25/84/1126722584.db2.gz PNSXWAKYPLNNEZ-SNVBAGLBSA-N 1 1 341.329 3.992 20 10 EHCDMO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(F)cc3O)CC2)cc1 ZINC000185311895 1126862347 /nfs/dbraw/zinc/86/23/47/1126862347.db2.gz PVBYYBZSYAOXFB-AWEZNQCLSA-N 1 1 344.430 3.860 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000185337427 1126868284 /nfs/dbraw/zinc/86/82/84/1126868284.db2.gz HEAUSTMKLIGOFU-FUHWJXTLSA-N 1 1 342.458 3.747 20 10 EHCDMO C[C@@H]1CCC[C@](CNC/C=C\c2ccc(N(C)C)cc2)([NH+](C)C)C1 ZINC001648895157 1120062726 /nfs/dbraw/zinc/06/27/26/1120062726.db2.gz DSAPRAZBNGQMCI-CHMBIBJPSA-N 1 1 329.532 3.866 20 10 EHCDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1cc2c(cc1O)CCC2 ZINC000915207663 1121251643 /nfs/dbraw/zinc/25/16/43/1121251643.db2.gz GJXSCOAGZODZCA-UHFFFAOYSA-N 1 1 329.415 3.921 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2ccccc2F)cc1 ZINC000915361072 1121359176 /nfs/dbraw/zinc/35/91/76/1121359176.db2.gz OYQOCKIQFVRQNR-FQEVSTJZSA-N 1 1 330.447 3.837 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCOc2ccccc2F)C2CC2)cc1 ZINC000917073858 1122470527 /nfs/dbraw/zinc/47/05/27/1122470527.db2.gz DPMFXRCSUBTPLO-UHFFFAOYSA-N 1 1 328.431 3.935 20 10 EHCDMO CC(C)[N@@H+](CC(=O)NC1CCCCCC1)Cc1ccc(N(C)C)cc1 ZINC000917075113 1122471956 /nfs/dbraw/zinc/47/19/56/1122471956.db2.gz QLFGJTWTRGPAFT-UHFFFAOYSA-N 1 1 345.531 3.802 20 10 EHCDMO COC(=O)c1occc1C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075053 1122472390 /nfs/dbraw/zinc/47/23/90/1122472390.db2.gz OXXVKUFSHMEPCY-UHFFFAOYSA-N 1 1 330.428 3.543 20 10 EHCDMO COC(=O)c1occc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075053 1122472394 /nfs/dbraw/zinc/47/23/94/1122472394.db2.gz OXXVKUFSHMEPCY-UHFFFAOYSA-N 1 1 330.428 3.543 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000917075166 1122472528 /nfs/dbraw/zinc/47/25/28/1122472528.db2.gz RDYRITUURMHYFY-UHFFFAOYSA-N 1 1 330.428 3.543 20 10 EHCDMO Cc1ccccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075395 1122472950 /nfs/dbraw/zinc/47/29/50/1122472950.db2.gz VEBPVNOMWCIZMB-UHFFFAOYSA-N 1 1 339.483 3.910 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1Cc1ccccc1Cl)OCO2 ZINC000919955645 1123245273 /nfs/dbraw/zinc/24/52/73/1123245273.db2.gz XIUVMHTZRXTMFR-OAHLLOKOSA-N 1 1 345.826 3.981 20 10 EHCDMO COc1ccc(O)c(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000179608507 1123806601 /nfs/dbraw/zinc/80/66/01/1123806601.db2.gz KVLHDHFDQSMCRO-MRXNPFEDSA-N 1 1 333.453 3.644 20 10 EHCDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000183082403 1125441536 /nfs/dbraw/zinc/44/15/36/1125441536.db2.gz WSMHNDUAXMRAIU-QFBILLFUSA-N 1 1 341.451 3.707 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccc(N2CCOCC2)cc1 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EHCDMO CC(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccc(N(C)C)cc1 ZINC000771792265 1133595712 /nfs/dbraw/zinc/59/57/12/1133595712.db2.gz YFAQIDJWQDTDOB-UHFFFAOYSA-N 1 1 343.446 3.741 20 10 EHCDMO CCOCc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)ccc1OC ZINC000771935573 1133616683 /nfs/dbraw/zinc/61/66/83/1133616683.db2.gz XXHFGZITUGCQMR-UHFFFAOYSA-N 1 1 342.483 3.930 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cc(Cl)c(Cl)cc1O ZINC000774165681 1133626645 /nfs/dbraw/zinc/62/66/45/1133626645.db2.gz QRWCUTRDHBCLIZ-DGCLKSJQSA-N 1 1 340.250 3.953 20 10 EHCDMO C[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774180093 1133636470 /nfs/dbraw/zinc/63/64/70/1133636470.db2.gz BJSZZWIOXBAJGS-MRVPVSSYSA-N 1 1 345.192 3.844 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2c(=O)[nH]1)c1ccc(N(C)C)cc1 ZINC000774480389 1133687370 /nfs/dbraw/zinc/68/73/70/1133687370.db2.gz BMAZOJDPMJAINR-KGLIPLIRSA-N 1 1 336.439 3.813 20 10 EHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)CC2(CCCC2)O1 ZINC000785519415 1133717286 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COc1c(O)c(C[N@H+](Cc2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774831147 1134038101 /nfs/dbraw/zinc/03/81/01/1134038101.db2.gz CWYBOWFHGLHUOD-UHFFFAOYSA-N 1 1 348.374 3.859 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774831147 1134038105 /nfs/dbraw/zinc/03/81/05/1134038105.db2.gz CWYBOWFHGLHUOD-UHFFFAOYSA-N 1 1 348.374 3.859 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@H](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774904640 1134113780 /nfs/dbraw/zinc/11/37/80/1134113780.db2.gz IETFOIKRCLEARS-CQSZACIVSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@H](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774904640 1134113784 /nfs/dbraw/zinc/11/37/84/1134113784.db2.gz IETFOIKRCLEARS-CQSZACIVSA-N 1 1 344.411 3.680 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cccc(C(F)(F)F)c1O ZINC000788526340 1134143263 /nfs/dbraw/zinc/14/32/63/1134143263.db2.gz PTDUZJQBBRPIPM-QMTHXVAHSA-N 1 1 339.361 3.873 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788629212 1134153712 /nfs/dbraw/zinc/15/37/12/1134153712.db2.gz SENJEDGCETUGKH-JRPNMDOOSA-N 1 1 328.378 3.544 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1ccsc1)c1cccc(C(F)(F)F)c1O ZINC000788753319 1134165223 /nfs/dbraw/zinc/16/52/23/1134165223.db2.gz IQAVMIKZASMCKF-TVQRCGJNSA-N 1 1 331.359 3.857 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2ccccc2C)ccc1[N+](=O)[O-] ZINC000774991005 1134189606 /nfs/dbraw/zinc/18/96/06/1134189606.db2.gz VKZAXXYOAQRPBM-UHFFFAOYSA-N 1 1 344.411 3.685 20 10 EHCDMO COc1c(O)c(C[NH2+][C@]2(C)CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000775015701 1134211562 /nfs/dbraw/zinc/21/15/62/1134211562.db2.gz JKBRIYTWMSZQJF-LJQANCHMSA-N 1 1 342.395 3.650 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001203643058 1134240849 /nfs/dbraw/zinc/24/08/49/1134240849.db2.gz QZZXTZXNIYPACD-MRXNPFEDSA-N 1 1 347.256 3.757 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3cc4ccccc4[nH]3)CC2)cc1F ZINC000789739314 1134330871 /nfs/dbraw/zinc/33/08/71/1134330871.db2.gz MFQYOZGCAAHCBH-UHFFFAOYSA-N 1 1 339.414 3.638 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000775138281 1134368548 /nfs/dbraw/zinc/36/85/48/1134368548.db2.gz NVMOMVWLGSRYNP-RDJZCZTQSA-N 1 1 344.421 3.668 20 10 EHCDMO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000775166959 1134471224 /nfs/dbraw/zinc/47/12/24/1134471224.db2.gz FAYGNBCRQGQNSI-UHFFFAOYSA-N 1 1 346.421 3.742 20 10 EHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000775166959 1134471229 /nfs/dbraw/zinc/47/12/29/1134471229.db2.gz FAYGNBCRQGQNSI-UHFFFAOYSA-N 1 1 346.421 3.742 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1O ZINC000790935530 1134480112 /nfs/dbraw/zinc/48/01/12/1134480112.db2.gz YJMCBUOVVDDDNH-SWLSCSKDSA-N 1 1 342.277 3.589 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3c(O)ccc(Cl)c3F)ccc21 ZINC000790961854 1134486330 /nfs/dbraw/zinc/48/63/30/1134486330.db2.gz BLULDELVNMKDEI-UHFFFAOYSA-N 1 1 334.822 3.857 20 10 EHCDMO COC1(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCCCC1 ZINC000792157330 1134659230 /nfs/dbraw/zinc/65/92/30/1134659230.db2.gz UQWPDNKIFNMWFD-GOSISDBHSA-N 1 1 333.472 3.723 20 10 EHCDMO COCC[N@H+](Cc1cccc(Br)c1O)[C@H]1CC[C@@H](C)C1 ZINC000792192377 1134666317 /nfs/dbraw/zinc/66/63/17/1134666317.db2.gz JHLWXAOHYKBOEQ-OCCSQVGLSA-N 1 1 342.277 3.792 20 10 EHCDMO COCC[N@@H+](Cc1cccc(Br)c1O)[C@H]1CC[C@@H](C)C1 ZINC000792192377 1134666319 /nfs/dbraw/zinc/66/63/19/1134666319.db2.gz JHLWXAOHYKBOEQ-OCCSQVGLSA-N 1 1 342.277 3.792 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCc3cccc(F)c3)CC2)cc1 ZINC001190446513 1134702262 /nfs/dbraw/zinc/70/22/62/1134702262.db2.gz OCCXVXDCZKCKKT-UHFFFAOYSA-N 1 1 328.431 3.589 20 10 EHCDMO Cc1ccccc1-n1nccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000792763509 1134787278 /nfs/dbraw/zinc/78/72/78/1134787278.db2.gz SWVUSHAVLLGEIP-UHFFFAOYSA-N 1 1 334.467 3.879 20 10 EHCDMO COc1ccc(CNC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c(O)c1 ZINC000793390882 1134922139 /nfs/dbraw/zinc/92/21/39/1134922139.db2.gz TYJJNMXOBMCDDR-CRAIPNDOSA-N 1 1 332.488 3.534 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000793609638 1134971407 /nfs/dbraw/zinc/97/14/07/1134971407.db2.gz QLHZEYRFZWHZKU-GJZGRUSLSA-N 1 1 340.261 3.607 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000793609638 1134971403 /nfs/dbraw/zinc/97/14/03/1134971403.db2.gz QLHZEYRFZWHZKU-GJZGRUSLSA-N 1 1 340.261 3.607 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCN(c3cccc(F)c3)C[C@H]2C)c1O ZINC000793734320 1134987085 /nfs/dbraw/zinc/98/70/85/1134987085.db2.gz VNDSLLUNLYKJDC-OAHLLOKOSA-N 1 1 344.430 3.559 20 10 EHCDMO COc1ccc2c(c1)CCCC[N@H+]2C[Si](C)(C)c1ccccc1 ZINC001192313886 1134998357 /nfs/dbraw/zinc/99/83/57/1134998357.db2.gz FXTNGMMTTMXIKX-UHFFFAOYSA-N 1 1 325.528 3.993 20 10 EHCDMO COc1ccc2c(c1)CCCC[N@@H+]2C[Si](C)(C)c1ccccc1 ZINC001192313886 1134998360 /nfs/dbraw/zinc/99/83/60/1134998360.db2.gz FXTNGMMTTMXIKX-UHFFFAOYSA-N 1 1 325.528 3.993 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)c1 ZINC000775649178 1135412364 /nfs/dbraw/zinc/41/23/64/1135412364.db2.gz LZLBYNXGSCGUCQ-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO CC[N@H+](CCc1ccccc1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775652979 1135422939 /nfs/dbraw/zinc/42/29/39/1135422939.db2.gz YADFNUHHHXHQKK-UHFFFAOYSA-N 1 1 337.511 3.503 20 10 EHCDMO CC[N@@H+](CCc1ccccc1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775652979 1135422941 /nfs/dbraw/zinc/42/29/41/1135422941.db2.gz YADFNUHHHXHQKK-UHFFFAOYSA-N 1 1 337.511 3.503 20 10 EHCDMO CCC[N@@H+](Cc1cccc(C)c1O)[C@@H](C)C(=O)Nc1ccccc1 ZINC000775667962 1135454153 /nfs/dbraw/zinc/45/41/53/1135454153.db2.gz PPBDTAAIGLEMDG-INIZCTEOSA-N 1 1 326.440 3.940 20 10 EHCDMO C[N@H+]1CCCC[C@H]1CCC(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000806666632 1135482202 /nfs/dbraw/zinc/48/22/02/1135482202.db2.gz PUYASOWJDPITLY-IBGZPJMESA-N 1 1 343.515 3.558 20 10 EHCDMO C[C@H](C[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 ZINC000775679276 1135503750 /nfs/dbraw/zinc/50/37/50/1135503750.db2.gz UEHUCFJRLQQJPF-LJQANCHMSA-N 1 1 337.511 3.674 20 10 EHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 ZINC000775679276 1135503752 /nfs/dbraw/zinc/50/37/52/1135503752.db2.gz UEHUCFJRLQQJPF-LJQANCHMSA-N 1 1 337.511 3.674 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3cccc(F)c3[C@H]2C)cc1OC ZINC000775699841 1135532562 /nfs/dbraw/zinc/53/25/62/1135532562.db2.gz IFCSKEIGAXSBEG-GFCCVEGCSA-N 1 1 331.387 3.668 20 10 EHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2nnc3n2CCCCC3)c1O ZINC000808672370 1135713692 /nfs/dbraw/zinc/71/36/92/1135713692.db2.gz LDUOWNQQTYLHKX-LBPRGKRZSA-N 1 1 334.851 3.523 20 10 EHCDMO Cc1cc(F)ccc1[C@H](O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000747523977 1135715758 /nfs/dbraw/zinc/71/57/58/1135715758.db2.gz BUCSMOGFVWLTOS-OAQYLSRUSA-N 1 1 342.458 3.898 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000809730307 1135872996 /nfs/dbraw/zinc/87/29/96/1135872996.db2.gz JICKWXORIXNGRV-UHFFFAOYSA-N 1 1 347.256 3.929 20 10 EHCDMO Oc1ccc(F)cc1CN1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000809703733 1135875123 /nfs/dbraw/zinc/87/51/23/1135875123.db2.gz OZVFPCMHRGHNHR-OAQYLSRUSA-N 1 1 340.442 3.629 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000809768143 1135880395 /nfs/dbraw/zinc/88/03/95/1135880395.db2.gz DAHLBKRWTZEBFS-INIZCTEOSA-N 1 1 325.387 3.546 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](CCOC)Cc2cccnc2)cc1F ZINC000809740768 1135884184 /nfs/dbraw/zinc/88/41/84/1135884184.db2.gz DIERDVGSEFVMIS-UHFFFAOYSA-N 1 1 345.462 3.716 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](CCOC)Cc2cccnc2)cc1F ZINC000809740768 1135884188 /nfs/dbraw/zinc/88/41/88/1135884188.db2.gz DIERDVGSEFVMIS-UHFFFAOYSA-N 1 1 345.462 3.716 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]Cc3ccc(F)c(Cl)c3)cc2)CC1 ZINC001199940705 1135940135 /nfs/dbraw/zinc/94/01/35/1135940135.db2.gz CIGDAFBOEYRNTF-UHFFFAOYSA-N 1 1 347.865 3.521 20 10 EHCDMO C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001201686082 1136056838 /nfs/dbraw/zinc/05/68/38/1136056838.db2.gz ZJPKMBICMMZCNS-FDDCHVKYSA-N 1 1 349.522 3.852 20 10 EHCDMO Cc1ccc(C[C@H]2CCC[N@@H+](Cc3cc4c(cc3O)OCO4)C2)cc1 ZINC000747798105 1136227004 /nfs/dbraw/zinc/22/70/04/1136227004.db2.gz NAGDYZPGMMWWBQ-QGZVFWFLSA-N 1 1 339.435 3.884 20 10 EHCDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000747804503 1136236133 /nfs/dbraw/zinc/23/61/33/1136236133.db2.gz YWOFNNXUNKNJIB-QGZVFWFLSA-N 1 1 346.515 3.952 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CC(=O)N(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812739954 1136240440 /nfs/dbraw/zinc/24/04/40/1136240440.db2.gz JAVKPFPZWGOZRU-CZUORRHYSA-N 1 1 346.377 3.517 20 10 EHCDMO Cc1cncc(CC[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)n1 ZINC000850551649 1136283698 /nfs/dbraw/zinc/28/36/98/1136283698.db2.gz UXJISSFUXZIWIE-SNVBAGLBSA-N 1 1 326.227 3.691 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1c(F)cccc1F ZINC000850565118 1136286780 /nfs/dbraw/zinc/28/67/80/1136286780.db2.gz ANKNDIRVXWPJSD-AWEZNQCLSA-N 1 1 346.421 3.777 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cnc3ccccc3n2)C2CC2)cc1 ZINC000851732736 1136402173 /nfs/dbraw/zinc/40/21/73/1136402173.db2.gz XBCWKHIVFSXNCK-UHFFFAOYSA-N 1 1 332.451 3.860 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000814170326 1136415534 /nfs/dbraw/zinc/41/55/34/1136415534.db2.gz VKGAFFLCUHCWDN-OCCSQVGLSA-N 1 1 346.215 3.940 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000814170326 1136415535 /nfs/dbraw/zinc/41/55/35/1136415535.db2.gz VKGAFFLCUHCWDN-OCCSQVGLSA-N 1 1 346.215 3.940 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCO[C@](C)(C4CC4)C3)c2c1 ZINC000853528397 1136541603 /nfs/dbraw/zinc/54/16/03/1136541603.db2.gz OVMOVADUQUSMLZ-FQEVSTJZSA-N 1 1 327.424 3.555 20 10 EHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC000815033203 1136542967 /nfs/dbraw/zinc/54/29/67/1136542967.db2.gz BZUOGFZWDFAACW-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC000815033203 1136542970 /nfs/dbraw/zinc/54/29/70/1136542970.db2.gz BZUOGFZWDFAACW-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)cc1F ZINC000853562345 1136543745 /nfs/dbraw/zinc/54/37/45/1136543745.db2.gz LUZAHBKQFSVJPY-HNNXBMFYSA-N 1 1 345.370 3.606 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)C[C@H]2CCc3ccccc32)cc1OC ZINC000853609794 1136548930 /nfs/dbraw/zinc/54/89/30/1136548930.db2.gz MVMVURRNKCUEJB-OAHLLOKOSA-N 1 1 327.424 3.571 20 10 EHCDMO COc1ccc(N2CC[C@H](CNc3[nH+]ccc4c(N)cccc43)C2)cc1 ZINC000853700019 1136556344 /nfs/dbraw/zinc/55/63/44/1136556344.db2.gz VIIJSSHENPGTCT-OAHLLOKOSA-N 1 1 348.450 3.764 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c1O ZINC000815254558 1136573813 /nfs/dbraw/zinc/57/38/13/1136573813.db2.gz MMNJJPPALPBPEK-QGZVFWFLSA-N 1 1 339.863 3.525 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c1O ZINC000815254557 1136573896 /nfs/dbraw/zinc/57/38/96/1136573896.db2.gz MMNJJPPALPBPEK-KRWDZBQOSA-N 1 1 339.863 3.525 20 10 EHCDMO COc1cc(C)cc(C[N@H+](C)Cc2nc3ccccc3s2)c1O ZINC000111898408 1136586895 /nfs/dbraw/zinc/58/68/95/1136586895.db2.gz HPNWCLXMVUDLNK-UHFFFAOYSA-N 1 1 328.437 3.951 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2nc3ccccc3s2)c1O ZINC000111898408 1136586897 /nfs/dbraw/zinc/58/68/97/1136586897.db2.gz HPNWCLXMVUDLNK-UHFFFAOYSA-N 1 1 328.437 3.951 20 10 EHCDMO COc1ncccc1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815557793 1136610212 /nfs/dbraw/zinc/61/02/12/1136610212.db2.gz FKTGXAOOTPZRQU-JTQLQIEISA-N 1 1 326.318 3.665 20 10 EHCDMO C[C@H]([NH2+]CCN1CCCC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815559860 1136610605 /nfs/dbraw/zinc/61/06/05/1136610605.db2.gz RPOBBEXVISLMEU-OLZOCXBDSA-N 1 1 330.394 3.936 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1c(C)nn(C)c1C ZINC000816554516 1136736328 /nfs/dbraw/zinc/73/63/28/1136736328.db2.gz APEXUAQFRDDIBG-AWEZNQCLSA-N 1 1 325.815 3.776 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2C2CC2)cc1 ZINC000816656140 1136745502 /nfs/dbraw/zinc/74/55/02/1136745502.db2.gz HARUUYLKBBFHKY-HXUWFJFHSA-N 1 1 328.500 3.924 20 10 EHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938543 1136847213 /nfs/dbraw/zinc/84/72/13/1136847213.db2.gz MSMPIOMKHXLAIG-PMACEKPBSA-N 1 1 327.472 3.502 20 10 EHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000817938583 1136847501 /nfs/dbraw/zinc/84/75/01/1136847501.db2.gz NOVOBHQTCORKKN-XIKOKIGWSA-N 1 1 335.854 3.896 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000817939238 1136848450 /nfs/dbraw/zinc/84/84/50/1136848450.db2.gz APOJVDIZNMQSKS-UXHICEINSA-N 1 1 327.447 3.632 20 10 EHCDMO Nc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000817956939 1136851672 /nfs/dbraw/zinc/85/16/72/1136851672.db2.gz GGKMPKZGYNUHBV-KOUNCHBCSA-N 1 1 335.495 3.597 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000818357110 1136875855 /nfs/dbraw/zinc/87/58/55/1136875855.db2.gz VPLHUDZFASIJQR-RKDXNWHRSA-N 1 1 340.832 3.701 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+]2CCc3n[nH]cc3C2)cc1 ZINC000857878060 1136917579 /nfs/dbraw/zinc/91/75/79/1136917579.db2.gz UHQKMWXZQMNIKN-UHFFFAOYSA-N 1 1 338.480 3.666 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCc3n[nH]cc3C2)cc1 ZINC000857878060 1136917581 /nfs/dbraw/zinc/91/75/81/1136917581.db2.gz UHQKMWXZQMNIKN-UHFFFAOYSA-N 1 1 338.480 3.666 20 10 EHCDMO CC[N@H+](C)Cc1cccc(CNCc2cc(F)c(N(C)C)cc2F)c1 ZINC000858128005 1136941905 /nfs/dbraw/zinc/94/19/05/1136941905.db2.gz XVWCCFMQMBOOKY-UHFFFAOYSA-N 1 1 347.453 3.772 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(CNCc2cc(F)c(N(C)C)cc2F)c1 ZINC000858128005 1136941908 /nfs/dbraw/zinc/94/19/08/1136941908.db2.gz XVWCCFMQMBOOKY-UHFFFAOYSA-N 1 1 347.453 3.772 20 10 EHCDMO Cc1cccc2nc(CNCc3cc(F)c(N(C)C)cc3F)[nH]c21 ZINC000858154410 1136944902 /nfs/dbraw/zinc/94/49/02/1136944902.db2.gz GWWWNCSVSMOFGD-UHFFFAOYSA-N 1 1 330.382 3.505 20 10 EHCDMO COCc1cnc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)s1 ZINC000858293942 1136955881 /nfs/dbraw/zinc/95/58/81/1136955881.db2.gz RRWXZHUHPRLCCB-UHFFFAOYSA-N 1 1 341.480 3.987 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cn(C)nc2Cl)c(C)n1-c1ccccc1 ZINC000858294389 1136956013 /nfs/dbraw/zinc/95/60/13/1136956013.db2.gz HTHBXGSXJLOOSY-UHFFFAOYSA-N 1 1 328.847 3.771 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](OC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000858443939 1136968355 /nfs/dbraw/zinc/96/83/55/1136968355.db2.gz XEABKRCUCLBOEL-IEBWSBKVSA-N 1 1 333.403 3.968 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1ccc(F)cc1O ZINC000858449957 1136969230 /nfs/dbraw/zinc/96/92/30/1136969230.db2.gz WLFAJQFLMNSHSY-TZMCWYRMSA-N 1 1 331.313 3.572 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c1O ZINC000821333075 1137022601 /nfs/dbraw/zinc/02/26/01/1137022601.db2.gz XXLLNFFUTJVJPQ-AWEZNQCLSA-N 1 1 328.387 3.509 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)cc1 ZINC000823476921 1137101878 /nfs/dbraw/zinc/10/18/78/1137101878.db2.gz DEPUNOAJIUBRBD-HXUWFJFHSA-N 1 1 342.508 3.997 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2C[C@@H](O)C(C)(C)C2)cc1 ZINC000824307419 1137131601 /nfs/dbraw/zinc/13/16/01/1137131601.db2.gz JDTXXHKDVWFUJR-GOSISDBHSA-N 1 1 330.497 3.587 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)c1O ZINC000013993996 1137133993 /nfs/dbraw/zinc/13/39/93/1137133993.db2.gz SKBGDUSLVJKLQR-GOSISDBHSA-N 1 1 345.414 3.721 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1F ZINC000862327620 1137138356 /nfs/dbraw/zinc/13/83/56/1137138356.db2.gz FIDYTUMTBHKGCV-FQEVSTJZSA-N 1 1 344.405 3.662 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1F ZINC000862327620 1137138358 /nfs/dbraw/zinc/13/83/58/1137138358.db2.gz FIDYTUMTBHKGCV-FQEVSTJZSA-N 1 1 344.405 3.662 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCCc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000824468146 1137140433 /nfs/dbraw/zinc/14/04/33/1137140433.db2.gz CPVNCDPVTCAFJG-HNNXBMFYSA-N 1 1 346.358 3.615 20 10 EHCDMO CC(C)[N@@H+](Cc1ccnn1CC1CC1)Cc1ccc(N(C)C)cc1 ZINC000824567734 1137143081 /nfs/dbraw/zinc/14/30/81/1137143081.db2.gz VHOUJFFWOUUYCS-UHFFFAOYSA-N 1 1 326.488 3.770 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000862539833 1137148885 /nfs/dbraw/zinc/14/88/85/1137148885.db2.gz WPDIUBKWHVVRCT-CQSZACIVSA-N 1 1 348.786 3.740 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000824820672 1137153878 /nfs/dbraw/zinc/15/38/78/1137153878.db2.gz KEJUQMQRNOXBPM-OAHLLOKOSA-N 1 1 342.395 3.689 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000824855679 1137154700 /nfs/dbraw/zinc/15/47/00/1137154700.db2.gz ORIGYRIROUUZNV-INIZCTEOSA-N 1 1 340.261 3.547 20 10 EHCDMO CCc1nc(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)co1 ZINC000825058132 1137163754 /nfs/dbraw/zinc/16/37/54/1137163754.db2.gz SMUUOWFRRJPUBE-UHFFFAOYSA-N 1 1 338.407 3.811 20 10 EHCDMO Cc1cc([O-])c(C[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Cl ZINC000825166489 1137167559 /nfs/dbraw/zinc/16/75/59/1137167559.db2.gz BHEMLSAVLVZCGD-UHFFFAOYSA-N 1 1 348.874 3.584 20 10 EHCDMO Cc1cc([O-])c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000825404993 1137177032 /nfs/dbraw/zinc/17/70/32/1137177032.db2.gz AHDYWBCGBZHGBE-UHFFFAOYSA-N 1 1 345.874 3.755 20 10 EHCDMO Cc1cc(O)c(CNc2ccc(N3CCOCC3)[nH+]c2C)cc1Cl ZINC000825435514 1137179001 /nfs/dbraw/zinc/17/90/01/1137179001.db2.gz AWIASBOOXJTTEH-UHFFFAOYSA-N 1 1 347.846 3.506 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@@]2(CCOC2)O1 ZINC000794690572 1137233909 /nfs/dbraw/zinc/23/39/09/1137233909.db2.gz BKUWLDDIPLZBGJ-LAUBAEHRSA-N 1 1 347.499 3.768 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@H](C)CO ZINC000794713164 1137242493 /nfs/dbraw/zinc/24/24/93/1137242493.db2.gz WIFBDSFWLIHCIK-OAHLLOKOSA-N 1 1 340.427 3.743 20 10 EHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(Br)ccc1[O-] ZINC000844923131 1137263134 /nfs/dbraw/zinc/26/31/34/1137263134.db2.gz HDDBGFYVSAEBDC-GFCCVEGCSA-N 1 1 349.272 3.725 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001144299250 1137268481 /nfs/dbraw/zinc/26/84/81/1137268481.db2.gz TVWRKHZVHBHZEE-PHIMTYICSA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001144299250 1137268483 /nfs/dbraw/zinc/26/84/83/1137268483.db2.gz TVWRKHZVHBHZEE-PHIMTYICSA-N 1 1 328.225 3.916 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](c2ccccc2F)[C@@H](C)O)ccc1OC ZINC000846018560 1137326362 /nfs/dbraw/zinc/32/63/62/1137326362.db2.gz UNSCMMUSORTJKY-JLTOFOAXSA-N 1 1 347.430 3.583 20 10 EHCDMO C[N@@H+](Cc1c[nH]c2cc(Br)cnc12)Cc1ccccc1O ZINC001144703746 1137331605 /nfs/dbraw/zinc/33/16/05/1137331605.db2.gz IQTOIAWPBIPBJM-UHFFFAOYSA-N 1 1 346.228 3.663 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@H]1CSc3ccccc3C1)CCC2 ZINC001172209188 1137541251 /nfs/dbraw/zinc/54/12/51/1137541251.db2.gz OYLWINOCUWCOBA-MRXNPFEDSA-N 1 1 327.449 3.563 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000872814859 1137584850 /nfs/dbraw/zinc/58/48/50/1137584850.db2.gz VUWLXFPMTIVPHG-MRXNPFEDSA-N 1 1 325.330 3.699 20 10 EHCDMO CO[C@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000876511518 1137654395 /nfs/dbraw/zinc/65/43/95/1137654395.db2.gz LEHBTDBKJTUTQL-OAQYLSRUSA-N 1 1 346.515 3.550 20 10 EHCDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876568971 1137655809 /nfs/dbraw/zinc/65/58/09/1137655809.db2.gz BDWYFGNEKGZAGH-MRXNPFEDSA-N 1 1 342.458 3.980 20 10 EHCDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876568970 1137655932 /nfs/dbraw/zinc/65/59/32/1137655932.db2.gz BDWYFGNEKGZAGH-INIZCTEOSA-N 1 1 342.458 3.980 20 10 EHCDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876590347 1137656416 /nfs/dbraw/zinc/65/64/16/1137656416.db2.gz UIYIENDKUAKLOF-HNNXBMFYSA-N 1 1 330.497 3.902 20 10 EHCDMO C[C@@H](c1ccco1)[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876640020 1137657876 /nfs/dbraw/zinc/65/78/76/1137657876.db2.gz YQDDAFDTGJIGSP-INIZCTEOSA-N 1 1 340.467 3.966 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCCc4ccccc4C3)cc2)CC1 ZINC000876689911 1137659198 /nfs/dbraw/zinc/65/91/98/1137659198.db2.gz NUIPQUFVMFYDNC-UHFFFAOYSA-N 1 1 336.479 3.596 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C3CCC3)cc2)CC1 ZINC000877607906 1137682696 /nfs/dbraw/zinc/68/26/96/1137682696.db2.gz JGTAUTMNOXQIFT-NRFANRHFSA-N 1 1 328.500 3.802 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(NC(=O)C2CC2)cc1 ZINC000882882257 1137836815 /nfs/dbraw/zinc/83/68/15/1137836815.db2.gz BBTZFVHLTSSERR-NSHDSACASA-N 1 1 346.377 3.870 20 10 EHCDMO Cc1cccc2ncc(C[N@H+](C)Cc3ccc(N4CCCC4)cc3)n21 ZINC001137196479 1137869200 /nfs/dbraw/zinc/86/92/00/1137869200.db2.gz IBXAVERWIMQUCF-UHFFFAOYSA-N 1 1 334.467 3.875 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c([O-])cccc1F ZINC000886603335 1138101068 /nfs/dbraw/zinc/10/10/68/1138101068.db2.gz LPVVJFVGNKLERS-WBVHZDCISA-N 1 1 328.431 3.704 20 10 EHCDMO C[C@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1c(O)cccc1F ZINC000886623987 1138103189 /nfs/dbraw/zinc/10/31/89/1138103189.db2.gz VAYVDVVNRAHTJK-AUYAEMIRSA-N 1 1 337.416 3.517 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(-c2cccnc2)no1 ZINC000076074239 1138129572 /nfs/dbraw/zinc/12/95/72/1138129572.db2.gz ITVXQURNHJVJFS-AWEZNQCLSA-N 1 1 338.411 3.810 20 10 EHCDMO CCC[N@H+](Cc1nc([C@H](C)OCC(C)C)no1)Cc1ccccc1O ZINC000080633282 1138163627 /nfs/dbraw/zinc/16/36/27/1138163627.db2.gz DPJIPHQXVALTPB-HNNXBMFYSA-N 1 1 347.459 3.921 20 10 EHCDMO CCC[N@@H+](Cc1nc([C@H](C)OCC(C)C)no1)Cc1ccccc1O ZINC000080633282 1138163630 /nfs/dbraw/zinc/16/36/30/1138163630.db2.gz DPJIPHQXVALTPB-HNNXBMFYSA-N 1 1 347.459 3.921 20 10 EHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccc(O)c(OC)c2)c(O)c1 ZINC000125983303 1138321027 /nfs/dbraw/zinc/32/10/27/1138321027.db2.gz PMFFTFDPCYMSLK-UHFFFAOYSA-N 1 1 331.412 3.527 20 10 EHCDMO COc1cccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000173866810 1139383372 /nfs/dbraw/zinc/38/33/72/1139383372.db2.gz LJDACZXOCAQARO-LBPRGKRZSA-N 1 1 331.416 3.682 20 10 EHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(OC)c(OC)cc2O)cc1 ZINC000179664494 1139772769 /nfs/dbraw/zinc/77/27/69/1139772769.db2.gz IUMJNUQQXMRWJR-ZDUSSCGKSA-N 1 1 331.412 3.611 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(N2CCOC2=O)cc1 ZINC000185160306 1140138365 /nfs/dbraw/zinc/13/83/65/1140138365.db2.gz DBGBCAZWHLAUAA-STQMWFEESA-N 1 1 344.386 3.900 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777438968 1140269261 /nfs/dbraw/zinc/26/92/61/1140269261.db2.gz DVBGTKMXXBRGKH-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2O)n1 ZINC000191823939 1140487516 /nfs/dbraw/zinc/48/75/16/1140487516.db2.gz KDHIOGSQSMGIJE-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@H+]2Cc2cccc(C)c2O)n1 ZINC000191823939 1140487518 /nfs/dbraw/zinc/48/75/18/1140487518.db2.gz KDHIOGSQSMGIJE-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1ccc(C)cc1 ZINC000268745666 1140981740 /nfs/dbraw/zinc/98/17/40/1140981740.db2.gz RVXVOHQNRHEDMB-MRXNPFEDSA-N 1 1 349.482 3.801 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000274400027 1141516234 /nfs/dbraw/zinc/51/62/34/1141516234.db2.gz QBFFMPPDPLQCEC-IAQYHMDHSA-N 1 1 331.437 3.969 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644085 522632071 /nfs/dbraw/zinc/63/20/71/522632071.db2.gz RHZLUOHKCQRDTP-DOMZBBRYSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644085 522632077 /nfs/dbraw/zinc/63/20/77/522632077.db2.gz RHZLUOHKCQRDTP-DOMZBBRYSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[NH+](CC)CCC[N@@H+](CC)Cc1cccc(Br)c1[O-] ZINC000230744949 1032829063 /nfs/dbraw/zinc/82/90/63/1032829063.db2.gz RFINQNWQGVSMRI-UHFFFAOYSA-N 1 1 343.309 3.709 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)s2)c(O)c1OC ZINC000891497758 1021767753 /nfs/dbraw/zinc/76/77/53/1021767753.db2.gz HDOHVPPINIGNJX-UHFFFAOYSA-N 1 1 327.833 3.756 20 10 EHCDMO COc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c(O)c1OC ZINC000891580703 1021989883 /nfs/dbraw/zinc/98/98/83/1021989883.db2.gz BVDNKFLGDJODEU-MRXNPFEDSA-N 1 1 345.464 3.700 20 10 EHCDMO C[C@@H]1CC([NH2+]Cc2ccc(O)cc2O)C[C@@H](C)N1Cc1ccccc1 ZINC001168024042 1024300340 /nfs/dbraw/zinc/30/03/40/1024300340.db2.gz ZLKBUOVKJJUBJL-HZPDHXFCSA-N 1 1 340.467 3.629 20 10 EHCDMO CCSc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)cc1 ZINC000895526293 1024584330 /nfs/dbraw/zinc/58/43/30/1024584330.db2.gz LMGDHOIXKKMUTI-UHFFFAOYSA-N 1 1 348.424 3.711 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC[S@](=O)c2ccccc2)cc1 ZINC000729542899 1024595893 /nfs/dbraw/zinc/59/58/93/1024595893.db2.gz RWIMEDSXBZHKEO-DEOSSOPVSA-N 1 1 344.524 3.772 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](Cc3nc(C)cs3)C2)c1O ZINC000895824076 1024880078 /nfs/dbraw/zinc/88/00/78/1024880078.db2.gz VVSIWJAEVYBGOK-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158113406 1025984613 /nfs/dbraw/zinc/98/46/13/1025984613.db2.gz SLLWUJHZUXXSKX-IAGOWNOFSA-N 1 1 333.495 3.808 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273569467 1027498225 /nfs/dbraw/zinc/49/82/25/1027498225.db2.gz KHNODVZWQHDQPS-CQSZACIVSA-N 1 1 343.427 3.603 20 10 EHCDMO C[C@H]([NH2+]C1CCN(c2ccccn2)CC1)c1ccc(Cl)cc1O ZINC000841746284 1028701057 /nfs/dbraw/zinc/70/10/57/1028701057.db2.gz XQEAUMZAUFWNCK-ZDUSSCGKSA-N 1 1 331.847 3.760 20 10 EHCDMO CC(C)O[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2[O-])C1 ZINC000708215961 1028970042 /nfs/dbraw/zinc/97/00/42/1028970042.db2.gz OTGDGNRKEJJCGW-LBPRGKRZSA-N 1 1 348.668 3.807 20 10 EHCDMO CC(C)O[C@H]1CCN(Cc2cc(Cl)cc(Br)c2[O-])C1 ZINC000708215961 1028970055 /nfs/dbraw/zinc/97/00/55/1028970055.db2.gz OTGDGNRKEJJCGW-LBPRGKRZSA-N 1 1 348.668 3.807 20 10 EHCDMO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(OC)c(OC)c2)c1O ZINC000124667972 1029299508 /nfs/dbraw/zinc/29/95/08/1029299508.db2.gz DNXCXVRTDZLYDZ-INIZCTEOSA-N 1 1 343.423 3.755 20 10 EHCDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@@H](C)c1cccc(O)c1 ZINC000278310063 1030100524 /nfs/dbraw/zinc/10/05/24/1030100524.db2.gz WTBAZDRCRUOMCA-LBPRGKRZSA-N 1 1 346.383 3.598 20 10 EHCDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@@H](C)c1cccc(O)c1 ZINC000278310063 1030100534 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EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1c(F)cccc1-n1cccn1 ZINC001178731303 1133194399 /nfs/dbraw/zinc/19/43/99/1133194399.db2.gz PBNIAGQHEUJSOE-UHFFFAOYSA-N 1 1 349.768 3.799 20 10 EHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cc(Br)ccc1O ZINC000768925138 1133204064 /nfs/dbraw/zinc/20/40/64/1133204064.db2.gz CBELIMWHEBVYOO-UHFFFAOYSA-N 1 1 335.245 3.960 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)c1O ZINC000769022465 1133214666 /nfs/dbraw/zinc/21/46/66/1133214666.db2.gz LZWKDIJVLZWIOI-LJQANCHMSA-N 1 1 327.424 3.537 20 10 EHCDMO CCOC(=O)CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000769122132 1133230095 /nfs/dbraw/zinc/23/00/95/1133230095.db2.gz MJUKGWLZGABIKJ-UHFFFAOYSA-N 1 1 330.472 3.595 20 10 EHCDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C2CC2)ccc1N1CCCCC1 ZINC000769332191 1133264416 /nfs/dbraw/zinc/26/44/16/1133264416.db2.gz YQTICAAWNLOBQD-QGZVFWFLSA-N 1 1 329.444 3.960 20 10 EHCDMO COC(=O)CC[N@@H+](Cc1ccc(F)c(F)c1)Cc1cc(C)ccc1O ZINC000769387188 1133274041 /nfs/dbraw/zinc/27/40/41/1133274041.db2.gz JSJXEOLRQKQGQQ-UHFFFAOYSA-N 1 1 349.377 3.544 20 10 EHCDMO CN(Cc1c(O)cccc1Cl)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000769402595 1133277828 /nfs/dbraw/zinc/27/78/28/1133277828.db2.gz MSFZWEYJQGCBHA-KRWDZBQOSA-N 1 1 344.886 4.000 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1F ZINC000769426898 1133282607 /nfs/dbraw/zinc/28/26/07/1133282607.db2.gz VRWYCXMOHIIIQZ-HXUWFJFHSA-N 1 1 342.458 3.764 20 10 EHCDMO CCOc1ccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)c(O)c1 ZINC000769425387 1133282842 /nfs/dbraw/zinc/28/28/42/1133282842.db2.gz RFZRSHSOAHTOLQ-HXUWFJFHSA-N 1 1 341.451 3.663 20 10 EHCDMO C[C@@H]1CSCC[N@@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769427186 1133282921 /nfs/dbraw/zinc/28/29/21/1133282921.db2.gz IHFDDGOINICZTC-CQSZACIVSA-N 1 1 335.473 3.522 20 10 EHCDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769427186 1133282925 /nfs/dbraw/zinc/28/29/25/1133282925.db2.gz IHFDDGOINICZTC-CQSZACIVSA-N 1 1 335.473 3.522 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](CO)c2ccc(OC)cc2)cc1 ZINC000769424504 1133283078 /nfs/dbraw/zinc/28/30/78/1133283078.db2.gz FXCVLSJSODGLCQ-OAQYLSRUSA-N 1 1 342.483 3.707 20 10 EHCDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2c(O)cccc2OC)cc1 ZINC000769519247 1133308177 /nfs/dbraw/zinc/30/81/77/1133308177.db2.gz MVWSDOWJPPDSIL-OAHLLOKOSA-N 1 1 329.440 3.720 20 10 EHCDMO CCCN(Cc1ccccc1O)C(=O)CC[N@@H+](C)C1CCCCC1 ZINC000769708625 1133333765 /nfs/dbraw/zinc/33/37/65/1133333765.db2.gz AOJYEMSSIPGFFA-UHFFFAOYSA-N 1 1 332.488 3.785 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000770328277 1133412573 /nfs/dbraw/zinc/41/25/73/1133412573.db2.gz NLSGIRKBMZBDHH-VQIMIIECSA-N 1 1 345.414 3.628 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000770345962 1133419187 /nfs/dbraw/zinc/41/91/87/1133419187.db2.gz AJBHUUHFUOJZLD-IFXJQAMLSA-N 1 1 327.424 3.615 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2O)[C@H]1CNC(=O)OC(C)(C)C ZINC000770510910 1133436950 /nfs/dbraw/zinc/43/69/50/1133436950.db2.gz VBLHOEWXTNKORN-ZBFHGGJFSA-N 1 1 334.460 3.517 20 10 EHCDMO CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)c(F)cc1[O-] ZINC001181486700 1133497762 /nfs/dbraw/zinc/49/77/62/1133497762.db2.gz MCTZYFJMRBSHEB-UHFFFAOYSA-N 1 1 334.410 3.754 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1Cl ZINC001182160009 1133580766 /nfs/dbraw/zinc/58/07/66/1133580766.db2.gz DIXJDRIAYUCERI-KRWDZBQOSA-N 1 1 342.870 3.991 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@@H]2CCN2C(=O)OC(C)(C)C)c1 ZINC001184012889 1133888237 /nfs/dbraw/zinc/88/82/37/1133888237.db2.gz QAYBKFAPLWVMFW-KRWDZBQOSA-N 1 1 348.487 3.957 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)CCCCO)cc1 ZINC000788269949 1134106958 /nfs/dbraw/zinc/10/69/58/1134106958.db2.gz UKKXOTJHQWHGRE-UHFFFAOYSA-N 1 1 326.484 3.917 20 10 EHCDMO COc1c(O)c(C[NH2+]CCc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000774941760 1134140215 /nfs/dbraw/zinc/14/02/15/1134140215.db2.gz DACYDXFIOSKEDG-UHFFFAOYSA-N 1 1 344.411 3.765 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cccc(C(F)(F)F)c1O ZINC000788526338 1134143199 /nfs/dbraw/zinc/14/31/99/1134143199.db2.gz PTDUZJQBBRPIPM-IINYFYTJSA-N 1 1 339.361 3.873 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788629215 1134153883 /nfs/dbraw/zinc/15/38/83/1134153883.db2.gz SENJEDGCETUGKH-ZIBATOQPSA-N 1 1 328.378 3.544 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc(C(F)(F)F)c1O ZINC000788749131 1134169843 /nfs/dbraw/zinc/16/98/43/1134169843.db2.gz CLTWEBACUXCZNB-MFKMUULPSA-N 1 1 329.318 3.778 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000775028910 1134230259 /nfs/dbraw/zinc/23/02/59/1134230259.db2.gz UTLJERGEEBBTOZ-ZDUSSCGKSA-N 1 1 330.384 3.511 20 10 EHCDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000789516367 1134296858 /nfs/dbraw/zinc/29/68/58/1134296858.db2.gz OZSOYCGCKCZREF-KRWDZBQOSA-N 1 1 346.515 3.879 20 10 EHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000789585972 1134298527 /nfs/dbraw/zinc/29/85/27/1134298527.db2.gz ICGHNJMSXCSTBG-KRWDZBQOSA-N 1 1 349.858 3.744 20 10 EHCDMO Fc1cccc(OC(F)(F)F)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000790534563 1134432048 /nfs/dbraw/zinc/43/20/48/1134432048.db2.gz YVOSTJRRRMWJLJ-UHFFFAOYSA-N 1 1 341.304 3.949 20 10 EHCDMO Fc1cc(C[NH2+]Cc2ccsc2Cl)ccc1N1CCOCC1 ZINC000790948053 1134484096 /nfs/dbraw/zinc/48/40/96/1134484096.db2.gz GFHKICQVKUBBOC-UHFFFAOYSA-N 1 1 340.851 3.667 20 10 EHCDMO CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790983138 1134495736 /nfs/dbraw/zinc/49/57/36/1134495736.db2.gz NCZSYPLMKZNVRM-CYBMUJFWSA-N 1 1 328.859 3.642 20 10 EHCDMO C[C@H](NC(=O)CC[N@@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000791137099 1134513670 /nfs/dbraw/zinc/51/36/70/1134513670.db2.gz AOVGTTUNWQOVFH-INIZCTEOSA-N 1 1 331.504 3.584 20 10 EHCDMO Cc1noc([C@@H](C)[NH2+]Cc2ccc(OCc3ccccc3)cc2O)n1 ZINC000792176949 1134663491 /nfs/dbraw/zinc/66/34/91/1134663491.db2.gz OUOPHIQWHDPFAD-CYBMUJFWSA-N 1 1 339.395 3.513 20 10 EHCDMO CCc1ccc([C@H]2C[N@H+](Cc3c(O)cccc3OC)CCO2)cc1 ZINC000792189561 1134666308 /nfs/dbraw/zinc/66/63/08/1134666308.db2.gz PEGUSDZOTCPFTK-HXUWFJFHSA-N 1 1 327.424 3.537 20 10 EHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3c(O)cccc3OC)CCO2)cc1 ZINC000792189561 1134666309 /nfs/dbraw/zinc/66/63/09/1134666309.db2.gz PEGUSDZOTCPFTK-HXUWFJFHSA-N 1 1 327.424 3.537 20 10 EHCDMO CN(C)c1ccc(CN[C@@H]2CCC[C@@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002788 1134837366 /nfs/dbraw/zinc/83/73/66/1134837366.db2.gz BWOBXWKYKPAFCE-HUUCEWRRSA-N 1 1 343.437 3.734 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000793216992 1134873980 /nfs/dbraw/zinc/87/39/80/1134873980.db2.gz KYQQWPGOOPNQST-OAQYLSRUSA-N 1 1 341.451 3.972 20 10 EHCDMO CC[N@H+](Cc1cc(Br)cc(OC)c1O)CC1CCC1 ZINC000793352323 1134917132 /nfs/dbraw/zinc/91/71/32/1134917132.db2.gz LGFJYWJDBRWRDD-UHFFFAOYSA-N 1 1 328.250 3.785 20 10 EHCDMO COc1c(O)c(C[N@H+](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000793608442 1134970317 /nfs/dbraw/zinc/97/03/17/1134970317.db2.gz INWPGMYLLYFFPY-UHFFFAOYSA-N 1 1 330.384 3.676 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000793608442 1134970325 /nfs/dbraw/zinc/97/03/25/1134970325.db2.gz INWPGMYLLYFFPY-UHFFFAOYSA-N 1 1 330.384 3.676 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc3c(c2)ncn3C)C2CC2)cc1 ZINC000775649196 1135409222 /nfs/dbraw/zinc/40/92/22/1135409222.db2.gz MHXRKWJXXPGXBW-UHFFFAOYSA-N 1 1 334.467 3.804 20 10 EHCDMO COc1ccc(OC)c(C[N@@H+](Cc2cccc(C)c2O)C2CC2)c1 ZINC000775652189 1135417054 /nfs/dbraw/zinc/41/70/54/1135417054.db2.gz HGQANRGPJRVLCN-UHFFFAOYSA-N 1 1 327.424 3.882 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1 ZINC001196218313 1135533868 /nfs/dbraw/zinc/53/38/68/1135533868.db2.gz PHUQJGFMBSPRAJ-LPHOPBHVSA-N 1 1 346.515 3.942 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000807486951 1135548629 /nfs/dbraw/zinc/54/86/29/1135548629.db2.gz YWSYJIACIBZCIB-GOSISDBHSA-N 1 1 332.488 3.785 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cccc(C)c2O)CC[C@H]1NC(=O)OC(C)(C)C ZINC000775716931 1135557242 /nfs/dbraw/zinc/55/72/42/1135557242.db2.gz ISPVLLLGQVXRPC-DOTOQJQBSA-N 1 1 348.487 3.826 20 10 EHCDMO CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775720543 1135575941 /nfs/dbraw/zinc/57/59/41/1135575941.db2.gz LASVYVBLRAZOEJ-SJORKVTESA-N 1 1 338.879 3.575 20 10 EHCDMO C[NH+]1CCN(c2ccc(CN3CC[C@H]3c3cccc(F)c3)cc2)CC1 ZINC000775724762 1135580209 /nfs/dbraw/zinc/58/02/09/1135580209.db2.gz KLHZZVUVCPXPQJ-NRFANRHFSA-N 1 1 339.458 3.525 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CCCSC2)c1 ZINC000808429636 1135674202 /nfs/dbraw/zinc/67/42/02/1135674202.db2.gz FVPAYDBEYAWUDX-NSHDSACASA-N 1 1 330.291 3.696 20 10 EHCDMO O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2ccc(O)c(O)c2)CC1 ZINC001203879236 1135698194 /nfs/dbraw/zinc/69/81/94/1135698194.db2.gz NOJHYOMSJJHCFC-UHFFFAOYSA-N 1 1 345.826 3.846 20 10 EHCDMO CCOc1cccc(C[N@H+](C)Cc2nc(-c3cccs3)no2)c1O ZINC000809687202 1135871739 /nfs/dbraw/zinc/87/17/39/1135871739.db2.gz DLMDLPZRNYJXTA-UHFFFAOYSA-N 1 1 345.424 3.534 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c1O ZINC000809687202 1135871741 /nfs/dbraw/zinc/87/17/41/1135871741.db2.gz DLMDLPZRNYJXTA-UHFFFAOYSA-N 1 1 345.424 3.534 20 10 EHCDMO C[N@@H+](CCc1nc(-c2ccccc2)no1)Cc1cc(Cl)ccc1O ZINC000809701743 1135874706 /nfs/dbraw/zinc/87/47/06/1135874706.db2.gz JSELVQBXLLXJQW-UHFFFAOYSA-N 1 1 343.814 3.770 20 10 EHCDMO C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766798 1135879729 /nfs/dbraw/zinc/87/97/29/1135879729.db2.gz AYDWBIJOZOEAIV-IAQYHMDHSA-N 1 1 329.271 3.615 20 10 EHCDMO C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766798 1135879732 /nfs/dbraw/zinc/87/97/32/1135879732.db2.gz AYDWBIJOZOEAIV-IAQYHMDHSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766798 1135879735 /nfs/dbraw/zinc/87/97/35/1135879735.db2.gz AYDWBIJOZOEAIV-IAQYHMDHSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766798 1135879739 /nfs/dbraw/zinc/87/97/39/1135879739.db2.gz AYDWBIJOZOEAIV-IAQYHMDHSA-N 1 1 329.271 3.615 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1 ZINC000809768585 1135880506 /nfs/dbraw/zinc/88/05/06/1135880506.db2.gz PIQBDDWLTIYJKI-DOTOQJQBSA-N 1 1 329.465 3.701 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000809757726 1135887101 /nfs/dbraw/zinc/88/71/01/1135887101.db2.gz SKWJXCXXQHLKQB-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000809757726 1135887105 /nfs/dbraw/zinc/88/71/05/1135887105.db2.gz SKWJXCXXQHLKQB-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1O ZINC000809758079 1135888122 /nfs/dbraw/zinc/88/81/22/1135888122.db2.gz BSOIEZPSDBGUPZ-ZIAGYGMSSA-N 1 1 339.863 3.693 20 10 EHCDMO CCOc1ccc(C[N@H+]2Cc3ccc(OC)cc3C3(CC3)C2)c(O)c1 ZINC000811518223 1136097933 /nfs/dbraw/zinc/09/79/33/1136097933.db2.gz HISRZKKKYRFLQE-UHFFFAOYSA-N 1 1 339.435 3.847 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCC[C@H]2COC(=O)NC2CCCC2)c1O ZINC000811510864 1136102443 /nfs/dbraw/zinc/10/24/43/1136102443.db2.gz QJDUAZWUKYQQMY-SFHVURJKSA-N 1 1 346.471 3.724 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1O ZINC000811512499 1136103127 /nfs/dbraw/zinc/10/31/27/1136103127.db2.gz MQTUFYAHJRYQGF-JTQLQIEISA-N 1 1 334.204 3.940 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2COC(=O)NC2CCCC2)c1 ZINC000811510740 1136103151 /nfs/dbraw/zinc/10/31/51/1136103151.db2.gz NWMZOAXCOLVIDP-SFHVURJKSA-N 1 1 346.471 3.724 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]23CCCN(C(=O)OC(C)(C)C)C3)c1 ZINC000812761631 1136238890 /nfs/dbraw/zinc/23/88/90/1136238890.db2.gz CZJAIEWANYAUCI-FQEVSTJZSA-N 1 1 346.471 3.676 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850371255 1136243271 /nfs/dbraw/zinc/24/32/71/1136243271.db2.gz HYTOJELEVANVLA-JKSUJKDBSA-N 1 1 348.240 3.731 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000850549100 1136283147 /nfs/dbraw/zinc/28/31/47/1136283147.db2.gz DLGIKHMUGJRHEM-FFLHNBHYSA-N 1 1 339.382 3.797 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](C)CN2C[C@@H](C)C[C@H](C)C2)ccc1OC ZINC000747854591 1136326342 /nfs/dbraw/zinc/32/63/42/1136326342.db2.gz PYWHFEQCZCRIIB-OKZBNKHCSA-N 1 1 348.531 3.688 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813884421 1136372777 /nfs/dbraw/zinc/37/27/77/1136372777.db2.gz VZXPWZPNYZXHOB-RHSMWYFYSA-N 1 1 332.394 3.990 20 10 EHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC12CCC2 ZINC000814171872 1136415584 /nfs/dbraw/zinc/41/55/84/1136415584.db2.gz XKMMRVJYOMHFRL-LJQANCHMSA-N 1 1 332.463 3.673 20 10 EHCDMO C[N@@H+](CC(=O)N[C@H](c1cccs1)C(C)(C)C)Cc1ccccc1O ZINC000111236385 1136525036 /nfs/dbraw/zinc/52/50/36/1136525036.db2.gz WKHYCCSMVHJNBY-GOSISDBHSA-N 1 1 346.496 3.789 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1C ZINC000853552127 1136543691 /nfs/dbraw/zinc/54/36/91/1136543691.db2.gz VYUJULBCCRLMBO-LJQANCHMSA-N 1 1 327.424 3.956 20 10 EHCDMO Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000815151632 1136557603 /nfs/dbraw/zinc/55/76/03/1136557603.db2.gz RHOIPRUWXIQKGK-UHFFFAOYSA-N 1 1 337.511 3.772 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]CCOC1CCCCC1 ZINC000111607908 1136565737 /nfs/dbraw/zinc/56/57/37/1136565737.db2.gz QIRLRMISJCLWEG-UHFFFAOYSA-N 1 1 328.250 3.594 20 10 EHCDMO C[C@H](CN1CCCCC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815559139 1136610908 /nfs/dbraw/zinc/61/09/08/1136610908.db2.gz YTXMTHYLKSROSD-OLZOCXBDSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@H]([NH2+]Cc1ccccc1CO)c1cccc(C(F)(F)F)c1O ZINC000815564198 1136611315 /nfs/dbraw/zinc/61/13/15/1136611315.db2.gz AZHBFICEBQHYDL-NSHDSACASA-N 1 1 325.330 3.754 20 10 EHCDMO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815587639 1136615469 /nfs/dbraw/zinc/61/54/69/1136615469.db2.gz PIPRCTGGEBMHGV-AMKSKSKJSA-N 1 1 337.341 3.720 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CSCCS1)c1cccc(C(F)(F)F)c1O ZINC000815587740 1136615568 /nfs/dbraw/zinc/61/55/68/1136615568.db2.gz SDFXSFKUSUDSEW-VHSXEESVSA-N 1 1 337.432 3.910 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815589097 1136615594 /nfs/dbraw/zinc/61/55/94/1136615594.db2.gz IOKIAOFGEHUWAM-ABAIWWIYSA-N 1 1 325.330 3.795 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000815593130 1136616042 /nfs/dbraw/zinc/61/60/42/1136616042.db2.gz CMKKXNMBFVBWKY-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C2CC2)cc1 ZINC000748046019 1136677179 /nfs/dbraw/zinc/67/71/79/1136677179.db2.gz BVLUBGKIPAHRDS-UHFFFAOYSA-N 1 1 343.398 3.907 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnn(CC(F)F)c1)Cc1ccco1 ZINC000816477896 1136722864 /nfs/dbraw/zinc/72/28/64/1136722864.db2.gz NIYSLRMRPHMZGA-UHFFFAOYSA-N 1 1 347.365 3.649 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnn(CC(F)F)c1)Cc1ccco1 ZINC000816477896 1136722866 /nfs/dbraw/zinc/72/28/66/1136722866.db2.gz NIYSLRMRPHMZGA-UHFFFAOYSA-N 1 1 347.365 3.649 20 10 EHCDMO OCC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCc2ccccc21 ZINC000816510627 1136728859 /nfs/dbraw/zinc/72/88/59/1136728859.db2.gz AZJKADXZUOJLEJ-QGZVFWFLSA-N 1 1 335.806 3.667 20 10 EHCDMO OCC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCc2ccccc21 ZINC000816510627 1136728861 /nfs/dbraw/zinc/72/88/61/1136728861.db2.gz AZJKADXZUOJLEJ-QGZVFWFLSA-N 1 1 335.806 3.667 20 10 EHCDMO C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1cc(Cl)c(F)cc1O ZINC000816514354 1136729332 /nfs/dbraw/zinc/72/93/32/1136729332.db2.gz VBGYVBUAYNLKIA-UHFFFAOYSA-N 1 1 346.830 3.531 20 10 EHCDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1cc(Cl)c(F)cc1O ZINC000816514354 1136729336 /nfs/dbraw/zinc/72/93/36/1136729336.db2.gz VBGYVBUAYNLKIA-UHFFFAOYSA-N 1 1 346.830 3.531 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1cccc(F)c1 ZINC000816528684 1136729944 /nfs/dbraw/zinc/72/99/44/1136729944.db2.gz MYGOKYAJZDDGSA-MRXNPFEDSA-N 1 1 340.801 3.716 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](O)c1c(F)cccc1Cl ZINC000816553351 1136736127 /nfs/dbraw/zinc/73/61/27/1136736127.db2.gz RQIUEFFBMRTCDW-AWEZNQCLSA-N 1 1 348.176 3.800 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@H](Cc3ccccc3)C2)ccc2ccccc21 ZINC000816560367 1136736677 /nfs/dbraw/zinc/73/66/77/1136736677.db2.gz MNIFLIURASWKAK-HXUWFJFHSA-N 1 1 333.431 3.989 20 10 EHCDMO OCC1(c2ccccc2)CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000816625007 1136739441 /nfs/dbraw/zinc/73/94/41/1136739441.db2.gz OBNIFHSNCYWPLD-UHFFFAOYSA-N 1 1 349.833 3.711 20 10 EHCDMO Oc1c(CNc2cccc(C[N@@H+]3CC[C@@H](O)C3)c2)ccc2ccccc21 ZINC000816616790 1136741966 /nfs/dbraw/zinc/74/19/66/1136741966.db2.gz GMYGKHGCBSOIGA-HXUWFJFHSA-N 1 1 348.446 3.724 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](c3cccc(Cl)c3)C1)OCO2 ZINC000816631880 1136747104 /nfs/dbraw/zinc/74/71/04/1136747104.db2.gz KBJOXPDOAZBWBJ-CYBMUJFWSA-N 1 1 331.799 3.764 20 10 EHCDMO Cc1nc(C(C)C)sc1[C@H](C)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939578 1136847489 /nfs/dbraw/zinc/84/74/89/1136847489.db2.gz CQTUESWRJQTUGL-SUMWQHHRSA-N 1 1 346.544 3.992 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H]2CCCc3cc(F)ccc32)cc1 ZINC000817940691 1136848541 /nfs/dbraw/zinc/84/85/41/1136848541.db2.gz GVMVPRNBVYHFES-UXHICEINSA-N 1 1 327.447 3.559 20 10 EHCDMO Cc1ccc([C@H]([NH2+]C[C@@H](N)c2ccc(N(C)C)cc2)C2CCC2)o1 ZINC000817942962 1136849095 /nfs/dbraw/zinc/84/90/95/1136849095.db2.gz SCWGPVCDITVDBS-UYAOXDASSA-N 1 1 327.472 3.785 20 10 EHCDMO CCOc1cccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817944121 1136849271 /nfs/dbraw/zinc/84/92/71/1136849271.db2.gz XJKJANUVRSPCLX-MGPUTAFESA-N 1 1 327.472 3.502 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1[O-] ZINC000817969199 1136853859 /nfs/dbraw/zinc/85/38/59/1136853859.db2.gz RNTKQUSDAMIDEM-NSHDSACASA-N 1 1 347.256 3.609 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1[O-] ZINC000817976561 1136854306 /nfs/dbraw/zinc/85/43/06/1136854306.db2.gz NLTHIVNZVGRFKU-ZFWWWQNUSA-N 1 1 328.378 3.594 20 10 EHCDMO CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817981342 1136854969 /nfs/dbraw/zinc/85/49/69/1136854969.db2.gz REMXTAFGKBCAPA-UKRRQHHQSA-N 1 1 341.293 3.728 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000818358293 1136875887 /nfs/dbraw/zinc/87/58/87/1136875887.db2.gz SXOQBPUUFOLNGH-NWDGAFQWSA-N 1 1 334.441 3.664 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H](O)Cc1ccccc1 ZINC000857758324 1136905690 /nfs/dbraw/zinc/90/56/90/1136905690.db2.gz FRMTYHVKAHNGBV-JOCHJYFZSA-N 1 1 338.495 3.712 20 10 EHCDMO CCc1cccc(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)c1O ZINC000858021650 1136933028 /nfs/dbraw/zinc/93/30/28/1136933028.db2.gz ZVKMEHLMZAEVBH-IBGZPJMESA-N 1 1 338.451 3.880 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000858100580 1136939955 /nfs/dbraw/zinc/93/99/55/1136939955.db2.gz KQFRRVWIZXRZED-LLVKDONJSA-N 1 1 335.354 3.790 20 10 EHCDMO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCC[N@H+](C(C)C)C1 ZINC001136336029 1136990653 /nfs/dbraw/zinc/99/06/53/1136990653.db2.gz YHGIFXFLBKOADX-IBGZPJMESA-N 1 1 345.531 3.610 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC(F)(F)C[C@H]3C)cc2)CC1 ZINC000859839054 1137034038 /nfs/dbraw/zinc/03/40/38/1137034038.db2.gz ULZQMXCMOKVXPD-OAHLLOKOSA-N 1 1 338.442 3.921 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCN(C(C)(C)C)C1=O ZINC000822570581 1137065452 /nfs/dbraw/zinc/06/54/52/1137065452.db2.gz NMDDHDHXRHOMBE-LJQANCHMSA-N 1 1 343.515 3.508 20 10 EHCDMO CCC(CC)NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000862024065 1137127275 /nfs/dbraw/zinc/12/72/75/1137127275.db2.gz OZKJOHIVJWCQRI-INIZCTEOSA-N 1 1 333.520 3.658 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000862347568 1137139281 /nfs/dbraw/zinc/13/92/81/1137139281.db2.gz GPEPNKJUAHXJOL-VIFPVBQESA-N 1 1 338.167 3.929 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@@H](O)C2(C)C)cc1 ZINC000824422649 1137137206 /nfs/dbraw/zinc/13/72/06/1137137206.db2.gz DEBBYODSBDMURJ-GOSISDBHSA-N 1 1 330.497 3.730 20 10 EHCDMO C[C@H](C[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F)c1nccs1 ZINC000862322506 1137138161 /nfs/dbraw/zinc/13/81/61/1137138161.db2.gz MJRHUKCBJPPPOA-LLVKDONJSA-N 1 1 325.428 3.723 20 10 EHCDMO c1cn2c(n1)[C@@H]([NH2+]Cc1ccc3c(c1)CCN3Cc1ccccc1)CC2 ZINC000824526726 1137141423 /nfs/dbraw/zinc/14/14/23/1137141423.db2.gz PEGFYTFXFVJPRZ-FQEVSTJZSA-N 1 1 344.462 3.680 20 10 EHCDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ccc(Br)cc1O ZINC000824530373 1137141732 /nfs/dbraw/zinc/14/17/32/1137141732.db2.gz ZFWZACFRDLRTOS-HNNXBMFYSA-N 1 1 335.245 3.830 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](Cc2cccc(C(N)=O)c2)C2CC2)c1O ZINC000824608250 1137144865 /nfs/dbraw/zinc/14/48/65/1137144865.db2.gz DYZRGBUPHFILAK-UHFFFAOYSA-N 1 1 344.842 3.618 20 10 EHCDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824645187 1137146018 /nfs/dbraw/zinc/14/60/18/1137146018.db2.gz ZQENUHVHMWCOAA-NXEZZACHSA-N 1 1 346.830 3.576 20 10 EHCDMO O=C1C[C@@]2(CCC[N@H+](Cc3cc(F)ccc3O)C2)Oc2ccccc21 ZINC000862482228 1137146259 /nfs/dbraw/zinc/14/62/59/1137146259.db2.gz QLPYKMWRYXANRS-HXUWFJFHSA-N 1 1 341.382 3.531 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CCCC2(F)F)c1 ZINC000824799037 1137153033 /nfs/dbraw/zinc/15/30/33/1137153033.db2.gz JLJVINWUFLJNRB-NSHDSACASA-N 1 1 334.204 3.988 20 10 EHCDMO COc1cc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000825513189 1137180750 /nfs/dbraw/zinc/18/07/50/1137180750.db2.gz DSHZCKKCKNUOII-INIZCTEOSA-N 1 1 329.444 3.759 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000825513189 1137180752 /nfs/dbraw/zinc/18/07/52/1137180752.db2.gz DSHZCKKCKNUOII-INIZCTEOSA-N 1 1 329.444 3.759 20 10 EHCDMO CC[N@H+](Cc1ccccn1)Cc1cc(Br)c(F)cc1O ZINC001144306499 1137270752 /nfs/dbraw/zinc/27/07/52/1137270752.db2.gz DPCALJUUBNXSJO-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[N@@H+](Cc1ccccn1)Cc1cc(Br)c(F)cc1O ZINC001144306499 1137270753 /nfs/dbraw/zinc/27/07/53/1137270753.db2.gz DPCALJUUBNXSJO-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CCn1cc(C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C(C)C)cn1 ZINC000846055125 1137331306 /nfs/dbraw/zinc/33/13/06/1137331306.db2.gz JCDLHIKXCKDJFF-FPLPWBNLSA-N 1 1 326.488 3.893 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@]3(CCCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794902174 1137332377 /nfs/dbraw/zinc/33/23/77/1137332377.db2.gz POHBAGQEIJPVFJ-IIBYNOLFSA-N 1 1 347.499 3.768 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794902173 1137332524 /nfs/dbraw/zinc/33/25/24/1137332524.db2.gz POHBAGQEIJPVFJ-IERDGZPVSA-N 1 1 347.499 3.768 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@H](c3nccn3C)C2)ccc1N1CCCCC1 ZINC000846837654 1137370661 /nfs/dbraw/zinc/37/06/61/1137370661.db2.gz HATCVFACAYGLBG-IBGZPJMESA-N 1 1 338.499 3.708 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000773009254 1137458696 /nfs/dbraw/zinc/45/86/96/1137458696.db2.gz NHRSEZSRHREKKG-SCLBCKFNSA-N 1 1 334.410 3.805 20 10 EHCDMO COc1ccccc1-c1noc([C@H](C)[NH2+]Cc2c(C)cccc2O)n1 ZINC000877471154 1137677302 /nfs/dbraw/zinc/67/73/02/1137677302.db2.gz RNKBUQXHKUOAEU-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO Cc1cc(C)cc(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000877478835 1137677767 /nfs/dbraw/zinc/67/77/67/1137677767.db2.gz QEJNICICHHHCCK-UHFFFAOYSA-N 1 1 338.495 3.897 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)c1O ZINC000877673202 1137685491 /nfs/dbraw/zinc/68/54/91/1137685491.db2.gz PKXKTPVVPMJSBF-DLBZAZTESA-N 1 1 347.842 3.752 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](c3nccs3)C2)c1O ZINC000880316884 1137774737 /nfs/dbraw/zinc/77/47/37/1137774737.db2.gz INHGNDGIAIBFIP-NSHDSACASA-N 1 1 336.844 3.694 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCc2ccccc2CC1 ZINC000211401146 1137801480 /nfs/dbraw/zinc/80/14/80/1137801480.db2.gz ZEYPOUKMHAOCHE-UHFFFAOYSA-N 1 1 332.241 3.756 20 10 EHCDMO COc1cc(C)c([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC000882889859 1137837014 /nfs/dbraw/zinc/83/70/14/1137837014.db2.gz KNBDTMIHNHMPGC-NSHDSACASA-N 1 1 337.366 3.847 20 10 EHCDMO COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000883081690 1137843744 /nfs/dbraw/zinc/84/37/44/1137843744.db2.gz LXTSSKNJQRELGJ-VOJFVSQTSA-N 1 1 337.366 3.545 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccccc1C(F)(F)F)c1c(O)cccc1F ZINC000886512718 1138087285 /nfs/dbraw/zinc/08/72/85/1138087285.db2.gz LQQQPBCGFVQZCC-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886527882 1138090327 /nfs/dbraw/zinc/09/03/27/1138090327.db2.gz BTQLQLAHPDXTNV-UGSOOPFHSA-N 1 1 333.403 3.703 20 10 EHCDMO C[C@H]([NH2+][C@H](Cc1nccn1C)c1ccccc1)c1c(O)cccc1F ZINC000886535171 1138092141 /nfs/dbraw/zinc/09/21/41/1138092141.db2.gz VXDWANWLRPDGSE-WMLDXEAASA-N 1 1 339.414 3.899 20 10 EHCDMO Cc1noc(C[C@H]([NH2+][C@H](C)c2c(O)cccc2F)c2ccccc2)n1 ZINC000886601266 1138100732 /nfs/dbraw/zinc/10/07/32/1138100732.db2.gz NUYPMFWNJNUDQT-WBMJQRKESA-N 1 1 341.386 3.857 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886608925 1138101378 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20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)Cc1cccc(C)c1O ZINC000179569463 1139765382 /nfs/dbraw/zinc/76/53/82/1139765382.db2.gz FWIIUOPGFILLNZ-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(OC)c(OC)cc2O)c1 ZINC000179657608 1139772651 /nfs/dbraw/zinc/77/26/51/1139772651.db2.gz LFQYGOXVFAABDG-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(Br)s2)c1O ZINC000179696390 1139776198 /nfs/dbraw/zinc/77/61/98/1139776198.db2.gz FHMAWLJGIJYIOI-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)c(O)c1 ZINC000186427642 1140203389 /nfs/dbraw/zinc/20/33/89/1140203389.db2.gz QQDPVNVKJZTLPW-UHFFFAOYSA-N 1 1 348.443 3.774 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)cc1 ZINC000187517978 1140259372 /nfs/dbraw/zinc/25/93/72/1140259372.db2.gz KDHPSSCZUXBSII-HXUWFJFHSA-N 1 1 338.430 3.504 20 10 EHCDMO COc1cccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1O ZINC000271032958 1141297284 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C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158113137 1025984474 /nfs/dbraw/zinc/98/44/74/1025984474.db2.gz SLLWUJHZUXXSKX-SJORKVTESA-N 1 1 333.495 3.808 20 10 EHCDMO COc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(C)c1OC ZINC000897245807 1026568846 /nfs/dbraw/zinc/56/88/46/1026568846.db2.gz JKLBVJBRQFMCCB-UHFFFAOYSA-N 1 1 339.794 3.800 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1 ZINC000273364211 1027395360 /nfs/dbraw/zinc/39/53/60/1027395360.db2.gz AZAYVHXUHLDHJX-KBXCAEBGSA-N 1 1 342.439 3.930 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Br)ccc1O ZINC000273458041 1027438213 /nfs/dbraw/zinc/43/82/13/1027438213.db2.gz HMYUJXRIYXXUDO-ZANVPECISA-N 1 1 336.233 3.606 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2(c3cccc(OC)c3)CC2)c1 ZINC000273547841 1027487223 /nfs/dbraw/zinc/48/72/23/1027487223.db2.gz ZSBBPJCVIMTEJN-CYBMUJFWSA-N 1 1 341.407 3.527 20 10 EHCDMO CCC[N@@H+](CC(=O)N(C)CC1CCCCC1)Cc1ccccc1O ZINC000303206066 1027495519 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C[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@H]2O ZINC000905741907 1039077871 /nfs/dbraw/zinc/07/78/71/1039077871.db2.gz OYNPZBCVKXCAMJ-HEFCMCLBSA-N 1 1 339.435 3.586 20 10 EHCDMO CC(C)(C)OC(=O)NCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000759791121 1040718722 /nfs/dbraw/zinc/71/87/22/1040718722.db2.gz QOXISZPICZBMIS-UHFFFAOYSA-N 1 1 334.460 3.662 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)c1O ZINC000164204607 1041220411 /nfs/dbraw/zinc/22/04/11/1041220411.db2.gz MPZZYCSCLLERPF-KXBFYZLASA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)[C@H](C)CCSC)c1O ZINC000093558610 1042358658 /nfs/dbraw/zinc/35/86/58/1042358658.db2.gz VDQQOXNVJFGLOU-SNVBAGLBSA-N 1 1 348.306 3.737 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000186003102 1127220633 /nfs/dbraw/zinc/22/06/33/1127220633.db2.gz BSAJDVLRJGRUAR-QFYYESIMSA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cs1 ZINC000765855306 1128604691 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EHCDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(N2CCCCC2)cc1 ZINC000920181256 1123328656 /nfs/dbraw/zinc/32/86/56/1123328656.db2.gz BZHLKCSCZYEHRY-RBUKOAKNSA-N 1 1 329.532 3.887 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc(N(C)C)cc1 ZINC000920258779 1123344598 /nfs/dbraw/zinc/34/45/98/1123344598.db2.gz WEGMEDUAQBATEC-UHFFFAOYSA-N 1 1 339.483 3.912 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000180322884 1123987028 /nfs/dbraw/zinc/98/70/28/1123987028.db2.gz DXZCQTGPJXDRGN-GOSISDBHSA-N 1 1 326.440 3.502 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1O ZINC000180723897 1124058539 /nfs/dbraw/zinc/05/85/39/1124058539.db2.gz KGMJBYKNCPNXNT-OALUTQOASA-N 1 1 329.415 3.928 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C)CC2)c(Br)c1 ZINC001237065378 1125260623 /nfs/dbraw/zinc/26/06/23/1125260623.db2.gz NUFKCBOBGYWHJI-NSHDSACASA-N 1 1 328.250 3.785 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CCCO1 ZINC000183041199 1125421807 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COc1cc(O)c(C[N@@H+](C)[C@@H]2CCCc3ccccc32)cc1OC ZINC000768441442 1133138849 /nfs/dbraw/zinc/13/88/49/1133138849.db2.gz LNWHJCPRVGVQOM-QGZVFWFLSA-N 1 1 327.424 3.919 20 10 EHCDMO Oc1cc2c(cc1C[N@H+](Cc1ccccc1)CC1CCC1)[C@@H](O)CO2 ZINC000768443184 1133139011 /nfs/dbraw/zinc/13/90/11/1133139011.db2.gz QYPALGIYXNRBPB-FQEVSTJZSA-N 1 1 339.435 3.620 20 10 EHCDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768465515 1133144128 /nfs/dbraw/zinc/14/41/28/1133144128.db2.gz ILMUYLLNJOVJFF-LLSQANQASA-N 1 1 343.398 3.540 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(SC)c(OC)c1 ZINC000769192841 1133233320 /nfs/dbraw/zinc/23/33/20/1133233320.db2.gz QLXDMRVUJVLVJH-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769234533 1133247953 /nfs/dbraw/zinc/24/79/53/1133247953.db2.gz UGLPBDZFUNGYIU-FQEVSTJZSA-N 1 1 336.479 3.821 20 10 EHCDMO Cc1ccc2[nH]c(NCc3c(O)cccc3Br)[nH+]c2c1 ZINC001179443268 1133251887 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CCOc1ccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)c(O)c1 ZINC000769425385 1133282262 /nfs/dbraw/zinc/28/22/62/1133282262.db2.gz RFZRSHSOAHTOLQ-FQEVSTJZSA-N 1 1 341.451 3.663 20 10 EHCDMO CCOc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000769513347 1133306530 /nfs/dbraw/zinc/30/65/30/1133306530.db2.gz BIPJMWNNVOTFEQ-FZKQIMNGSA-N 1 1 333.453 3.814 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000769513347 1133306534 /nfs/dbraw/zinc/30/65/34/1133306534.db2.gz BIPJMWNNVOTFEQ-FZKQIMNGSA-N 1 1 333.453 3.814 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1 ZINC001180006670 1133316366 /nfs/dbraw/zinc/31/63/66/1133316366.db2.gz IQYOPVWTBBYTFK-HNNXBMFYSA-N 1 1 348.487 3.862 20 10 EHCDMO CC[N@H+]1C[C@@H](C)N(Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@H]1C ZINC001180141612 1133329590 /nfs/dbraw/zinc/32/95/90/1133329590.db2.gz HAFVUUWJKXCFGI-ZIAGYGMSSA-N 1 1 343.437 3.686 20 10 EHCDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001180112166 1133332826 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327.424 3.615 20 10 EHCDMO COc1cc(C)c(C[N@@H+](CCN(C)C)CC2CCCCC2)c(O)c1 ZINC001181471097 1133491127 /nfs/dbraw/zinc/49/11/27/1133491127.db2.gz BSXSNOAVBVRGJK-UHFFFAOYSA-N 1 1 334.504 3.653 20 10 EHCDMO Cc1ccc(C[N@@H+](CCc2ccccn2)Cc2ccncc2)c(O)c1 ZINC001181524986 1133497482 /nfs/dbraw/zinc/49/74/82/1133497482.db2.gz IQVYNYGJNJTSHG-UHFFFAOYSA-N 1 1 333.435 3.736 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2nc3cc(Cl)ccc3n2C)cc1 ZINC000771525363 1133570802 /nfs/dbraw/zinc/57/08/02/1133570802.db2.gz IHNAJTHZOBSCLP-UHFFFAOYSA-N 1 1 342.874 3.925 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2nc3cc(Cl)ccc3n2C)cc1 ZINC000771525363 1133570810 /nfs/dbraw/zinc/57/08/10/1133570810.db2.gz IHNAJTHZOBSCLP-UHFFFAOYSA-N 1 1 342.874 3.925 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000771866957 1133603203 /nfs/dbraw/zinc/60/32/03/1133603203.db2.gz GFXYIXBZMAMSNO-FGZHOGPDSA-N 1 1 349.522 3.864 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cc(Cl)c(Cl)cc1O ZINC000774205695 1133632995 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EHCDMO CC(C)C[N@H+](Cc1c([O-])ccc(Cl)c1F)CC1CC[NH+](C)CC1 ZINC001183463182 1133810822 /nfs/dbraw/zinc/81/08/22/1133810822.db2.gz BWMDXHLLQLZYPZ-UHFFFAOYSA-N 1 1 342.886 3.985 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3cncn3C(C)(C)C)C2)c1 ZINC001184373667 1133932335 /nfs/dbraw/zinc/93/23/35/1133932335.db2.gz CVKWDIRYPRETMO-HNNXBMFYSA-N 1 1 343.471 3.732 20 10 EHCDMO COc1ccc(C[N@H+]2CCc3cc(C)cc(C)c3C2)c(O)c1OC ZINC001184429315 1133940596 /nfs/dbraw/zinc/94/05/96/1133940596.db2.gz WCRMPKOEBZKXND-UHFFFAOYSA-N 1 1 327.424 3.585 20 10 EHCDMO CCOc1cccc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)c1O ZINC001203613647 1134061298 /nfs/dbraw/zinc/06/12/98/1134061298.db2.gz CNPMQZUEMMLNKP-UHFFFAOYSA-N 1 1 327.424 3.884 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CCC2(CCCC2)O1 ZINC000788018288 1134064489 /nfs/dbraw/zinc/06/44/89/1134064489.db2.gz AEMSQGGCHICTDT-OALUTQOASA-N 1 1 345.483 3.865 20 10 EHCDMO CC[C@@H]([NH2+]C1CCN(C(=O)C(C)(C)C)CC1)c1ccc(F)cc1O ZINC000796691799 1134098084 /nfs/dbraw/zinc/09/80/84/1134098084.db2.gz DEWLXCUQVFPQAX-MRXNPFEDSA-N 1 1 336.451 3.609 20 10 EHCDMO Cc1cc(C)n(CCC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)n1 ZINC000788502274 1134132891 /nfs/dbraw/zinc/13/28/91/1134132891.db2.gz IXGCQIIKSGKTSO-CYBMUJFWSA-N 1 1 341.377 3.965 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CCCCCO)c(C)n1-c1ccc(C)cc1 ZINC000789343442 1134259478 /nfs/dbraw/zinc/25/94/78/1134259478.db2.gz YAULQZBBXNAPJI-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CCCCCO)c(C)n1-c1ccc(C)cc1 ZINC000789343442 1134259483 /nfs/dbraw/zinc/25/94/83/1134259483.db2.gz YAULQZBBXNAPJI-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000775061105 1134274410 /nfs/dbraw/zinc/27/44/10/1134274410.db2.gz RWNKLABSFYBXKP-OAHLLOKOSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000775061105 1134274418 /nfs/dbraw/zinc/27/44/18/1134274418.db2.gz RWNKLABSFYBXKP-OAHLLOKOSA-N 1 1 342.395 3.607 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000790408013 1134411838 /nfs/dbraw/zinc/41/18/38/1134411838.db2.gz SIOCSAUBSGCEFJ-GCKMJXCFSA-N 1 1 347.499 3.766 20 10 EHCDMO CN1CC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)[C@@H]1c1ccccc1 ZINC000790981871 1134495629 /nfs/dbraw/zinc/49/56/29/1134495629.db2.gz ZILLDKGROVUEOS-QAPCUYQASA-N 1 1 334.822 3.720 20 10 EHCDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792173143 1134662273 /nfs/dbraw/zinc/66/22/73/1134662273.db2.gz ROWJLXBWFDUDHR-GFCCVEGCSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173143 1134662277 /nfs/dbraw/zinc/66/22/77/1134662277.db2.gz ROWJLXBWFDUDHR-GFCCVEGCSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173143 1134662279 /nfs/dbraw/zinc/66/22/79/1134662279.db2.gz ROWJLXBWFDUDHR-GFCCVEGCSA-N 1 1 343.826 3.740 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCc3cc(Br)ccc3C2)c1 ZINC000792179503 1134663149 /nfs/dbraw/zinc/66/31/49/1134663149.db2.gz HJEXMZSQDSCJGA-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCc3cc(Br)ccc3C2)c1 ZINC000792179503 1134663155 /nfs/dbraw/zinc/66/31/55/1134663155.db2.gz HJEXMZSQDSCJGA-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1CC[C@H](C)C1 ZINC000792193496 1134666117 /nfs/dbraw/zinc/66/61/17/1134666117.db2.gz XJZKGJJTQFUYPN-SWLSCSKDSA-N 1 1 327.852 3.691 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353082 1134754029 /nfs/dbraw/zinc/75/40/29/1134754029.db2.gz VLHAWGMLJXMWDO-CQSZACIVSA-N 1 1 344.411 3.762 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000793207287 1134883745 /nfs/dbraw/zinc/88/37/45/1134883745.db2.gz OKUZUSCODYYLJF-OAHLLOKOSA-N 1 1 348.849 3.796 20 10 EHCDMO C[C@@H](CCNC(=O)OC(C)(C)C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000793598735 1134966847 /nfs/dbraw/zinc/96/68/47/1134966847.db2.gz CJIGPUVXCYLTQY-JTQLQIEISA-N 1 1 346.830 3.578 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1 ZINC000793614198 1134972917 /nfs/dbraw/zinc/97/29/17/1134972917.db2.gz OSSPXGAZCSSJSS-CABCVRRESA-N 1 1 330.255 3.807 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC[N@H+](Cc2ccccc2)CC1 ZINC000775633483 1135365325 /nfs/dbraw/zinc/36/53/25/1135365325.db2.gz JTPZHNYAJXXGSI-UHFFFAOYSA-N 1 1 348.849 3.893 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000775633483 1135365327 /nfs/dbraw/zinc/36/53/27/1135365327.db2.gz JTPZHNYAJXXGSI-UHFFFAOYSA-N 1 1 348.849 3.893 20 10 EHCDMO Cc1cc(C[N@H+]2CC(C)(C)[C@H]3COC[C@H]32)ccc1N1CCCCC1 ZINC001195083683 1135367160 /nfs/dbraw/zinc/36/71/60/1135367160.db2.gz FTWSMLKMBARZQN-AZUAARDMSA-N 1 1 328.500 3.842 20 10 EHCDMO C[C@H]([NH2+][C@@H](CN(C)C)c1ccc(F)cc1)c1cc(F)cc(F)c1O ZINC000806173109 1135398053 /nfs/dbraw/zinc/39/80/53/1135398053.db2.gz WPTNXCQZIQDOAY-GTNSWQLSSA-N 1 1 338.373 3.763 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccn(-c2cccc(F)c2)n1)c1ccc(N(C)C)cc1 ZINC000775833891 1135798513 /nfs/dbraw/zinc/79/85/13/1135798513.db2.gz HCSQFJCBWFVOQI-OAHLLOKOSA-N 1 1 338.430 3.928 20 10 EHCDMO C[C@@H](O)c1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000809574738 1135852256 /nfs/dbraw/zinc/85/22/56/1135852256.db2.gz SQBUVDVSKNUKRQ-CYBMUJFWSA-N 1 1 332.469 3.847 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC[C@@H]2CCOC2)Cc2ccco2)cc1 ZINC000809731790 1135873667 /nfs/dbraw/zinc/87/36/67/1135873667.db2.gz QVIPAURAXHLOJS-GOSISDBHSA-N 1 1 328.456 3.774 20 10 EHCDMO CCOC1CC([N@@H+](C)Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000809774693 1135880989 /nfs/dbraw/zinc/88/09/89/1135880989.db2.gz XFIJYCRNRMHZOQ-UHFFFAOYSA-N 1 1 347.459 3.584 20 10 EHCDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000809783647 1135890765 /nfs/dbraw/zinc/89/07/65/1135890765.db2.gz KADKOCOHAJBMHK-INIZCTEOSA-N 1 1 329.396 3.713 20 10 EHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000776003986 1135915568 /nfs/dbraw/zinc/91/55/68/1135915568.db2.gz YYQONYNALUAEFU-GXFFZTMASA-N 1 1 328.250 3.784 20 10 EHCDMO C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001199336001 1135898989 /nfs/dbraw/zinc/89/89/89/1135898989.db2.gz FZYCXKYWAGPBOZ-HNNXBMFYSA-N 1 1 339.474 3.775 20 10 EHCDMO C[C@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(N3CCCC3)cc2)C1 ZINC001199732831 1135924145 /nfs/dbraw/zinc/92/41/45/1135924145.db2.gz SAPKGEUYBNZIHA-SFHVURJKSA-N 1 1 329.532 3.887 20 10 EHCDMO C[C@H]1CCC[N@H+](C(C)(C)CNCc2ccc(N3CCCC3)cc2)C1 ZINC001199732831 1135924148 /nfs/dbraw/zinc/92/41/48/1135924148.db2.gz SAPKGEUYBNZIHA-SFHVURJKSA-N 1 1 329.532 3.887 20 10 EHCDMO C[C@]1(C[NH2+]Cc2c(O)ccc(Cl)c2F)OCCc2sccc21 ZINC000810171483 1135930473 /nfs/dbraw/zinc/93/04/73/1135930473.db2.gz YLLUFKCZPUMVPR-MRXNPFEDSA-N 1 1 341.835 3.824 20 10 EHCDMO CCCN(CC)C[C@@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000810179899 1135934664 /nfs/dbraw/zinc/93/46/64/1135934664.db2.gz HYAWFBPLXUWUAT-CYBMUJFWSA-N 1 1 343.309 3.673 20 10 EHCDMO CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000810252849 1135948781 /nfs/dbraw/zinc/94/87/81/1135948781.db2.gz VOXKQKQWOXSWGK-HNNXBMFYSA-N 1 1 342.936 3.914 20 10 EHCDMO Cc1cc(C[N@@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)ccc1N(C)C ZINC001170615044 1136003311 /nfs/dbraw/zinc/00/33/11/1136003311.db2.gz UWFPQDOEGZVMHZ-KRWDZBQOSA-N 1 1 344.421 3.993 20 10 EHCDMO Cc1cc(C[N@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)ccc1N(C)C ZINC001170615044 1136003314 /nfs/dbraw/zinc/00/33/14/1136003314.db2.gz UWFPQDOEGZVMHZ-KRWDZBQOSA-N 1 1 344.421 3.993 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850371254 1136243408 /nfs/dbraw/zinc/24/34/08/1136243408.db2.gz HYTOJELEVANVLA-HZPDHXFCSA-N 1 1 348.240 3.731 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000747830863 1136279387 /nfs/dbraw/zinc/27/93/87/1136279387.db2.gz MQWDIFBZODDARH-CABCVRRESA-N 1 1 333.472 3.644 20 10 EHCDMO COc1ncc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000813334300 1136319962 /nfs/dbraw/zinc/31/99/62/1136319962.db2.gz FBLUAFAVZURUKG-UHFFFAOYSA-N 1 1 331.485 3.774 20 10 EHCDMO COc1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000813334300 1136319963 /nfs/dbraw/zinc/31/99/63/1136319963.db2.gz FBLUAFAVZURUKG-UHFFFAOYSA-N 1 1 331.485 3.774 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@@H](C(=O)N1CCCCC1)c1ccccc1 ZINC000109771738 1136339766 /nfs/dbraw/zinc/33/97/66/1136339766.db2.gz LXNAPZIODXSYAS-HXUWFJFHSA-N 1 1 338.451 3.578 20 10 EHCDMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000851716462 1136401117 /nfs/dbraw/zinc/40/11/17/1136401117.db2.gz MYNMEPZVWXFZTP-HNNXBMFYSA-N 1 1 326.431 3.636 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000814170324 1136415519 /nfs/dbraw/zinc/41/55/19/1136415519.db2.gz VKGAFFLCUHCWDN-GXTWGEPZSA-N 1 1 346.215 3.940 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000814170324 1136415522 /nfs/dbraw/zinc/41/55/22/1136415522.db2.gz VKGAFFLCUHCWDN-GXTWGEPZSA-N 1 1 346.215 3.940 20 10 EHCDMO C[C@H](c1ccc(Cl)cc1)N(C)C(=O)C[N@@H+](C)Cc1ccccc1O ZINC000111236373 1136525057 /nfs/dbraw/zinc/52/50/57/1136525057.db2.gz YWACXPRXVWIHGM-CQSZACIVSA-N 1 1 346.858 3.697 20 10 EHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC000815014872 1136537375 /nfs/dbraw/zinc/53/73/75/1136537375.db2.gz CACCTJXSTRVWJR-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC000815014872 1136537378 /nfs/dbraw/zinc/53/73/78/1136537378.db2.gz CACCTJXSTRVWJR-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)c1C ZINC000815016397 1136537762 /nfs/dbraw/zinc/53/77/62/1136537762.db2.gz WPIHHURWZVEVMA-UHFFFAOYSA-N 1 1 339.483 3.748 20 10 EHCDMO Cc1cccc(NC(=O)C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)c1C ZINC000815016397 1136537766 /nfs/dbraw/zinc/53/77/66/1136537766.db2.gz WPIHHURWZVEVMA-UHFFFAOYSA-N 1 1 339.483 3.748 20 10 EHCDMO COc1ccccc1OCC[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815021131 1136538660 /nfs/dbraw/zinc/53/86/60/1136538660.db2.gz CMVHRJPTDONJPP-UHFFFAOYSA-N 1 1 328.456 3.580 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815031420 1136542654 /nfs/dbraw/zinc/54/26/54/1136542654.db2.gz SXCRAEFEXOPALI-HKUYNNGSSA-N 1 1 345.531 3.578 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)ccc1N(C)C ZINC000815105791 1136556689 /nfs/dbraw/zinc/55/66/89/1136556689.db2.gz LNXZGLDUGXABHL-HMXCVIKNSA-N 1 1 330.516 3.967 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2cc(C)cc(OC)c2O)C2CC2)cc1 ZINC000111892795 1136587000 /nfs/dbraw/zinc/58/70/00/1136587000.db2.gz GWGXORNQHPJQGT-UHFFFAOYSA-N 1 1 327.424 3.882 20 10 EHCDMO C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815587641 1136615584 /nfs/dbraw/zinc/61/55/84/1136615584.db2.gz PIPRCTGGEBMHGV-JQAFLVLXSA-N 1 1 337.341 3.720 20 10 EHCDMO COc1ccncc1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628752 1136621224 /nfs/dbraw/zinc/62/12/24/1136621224.db2.gz IOAKHJAFINMVMA-JTQLQIEISA-N 1 1 326.318 3.665 20 10 EHCDMO CO[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(F)(F)F ZINC000815605367 1136622546 /nfs/dbraw/zinc/62/25/46/1136622546.db2.gz RYKUSFDKFHGDAX-XVKPBYJWSA-N 1 1 331.256 3.639 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000112960333 1136665379 /nfs/dbraw/zinc/66/53/79/1136665379.db2.gz FKRVBUPTJIBXKX-CQSZACIVSA-N 1 1 329.440 3.876 20 10 EHCDMO Cc1ccc(NC(=O)C[N@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816481001 1136722851 /nfs/dbraw/zinc/72/28/51/1136722851.db2.gz DYKGNBYTJCPLKB-UHFFFAOYSA-N 1 1 334.419 3.924 20 10 EHCDMO CNC(=O)c1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816482903 1136723667 /nfs/dbraw/zinc/72/36/67/1136723667.db2.gz XWQWULLSAGJIOW-UHFFFAOYSA-N 1 1 334.419 3.537 20 10 EHCDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816499048 1136727536 /nfs/dbraw/zinc/72/75/36/1136727536.db2.gz CMRGJNRDVHTYSH-GOSISDBHSA-N 1 1 340.467 3.674 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(-n2cncn2)cc1 ZINC000816530595 1136730885 /nfs/dbraw/zinc/73/08/85/1136730885.db2.gz NPSJLVBPWXBAMD-LLVKDONJSA-N 1 1 346.793 3.616 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2[O-])c1 ZINC000816548817 1136732145 /nfs/dbraw/zinc/73/21/45/1136732145.db2.gz UGMYRRFZUDJSDC-UHFFFAOYSA-N 1 1 336.838 3.926 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000817938919 1136847319 /nfs/dbraw/zinc/84/73/19/1136847319.db2.gz VKIVWTNWZLUODS-SCLBCKFNSA-N 1 1 349.425 3.705 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817942257 1136849295 /nfs/dbraw/zinc/84/92/95/1136849295.db2.gz NPJXQQZFTKFAJF-IERDGZPVSA-N 1 1 340.515 3.559 20 10 EHCDMO Nc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H]3CCC[C@@H]32)cc1 ZINC000817957341 1136851643 /nfs/dbraw/zinc/85/16/43/1136851643.db2.gz LCKRVBOPWMMDMS-DNVJHFABSA-N 1 1 349.522 3.844 20 10 EHCDMO CCC([NH3+])(CC)CN[C@@H](C)c1cc(Br)cc(C)c1O ZINC000817960858 1136852327 /nfs/dbraw/zinc/85/23/27/1136852327.db2.gz RTYNGCSIGOXIJN-NSHDSACASA-N 1 1 329.282 3.631 20 10 EHCDMO CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817966454 1136853203 /nfs/dbraw/zinc/85/32/03/1136853203.db2.gz OGKFQMAFQVVSPA-GDBMZVCRSA-N 1 1 341.293 3.585 20 10 EHCDMO CC(C)Oc1ccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)cn1 ZINC000858099207 1136940064 /nfs/dbraw/zinc/94/00/64/1136940064.db2.gz LUADWXKGGPCOOM-UHFFFAOYSA-N 1 1 335.398 3.503 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CCOc3ccc(F)cc32)cc1F ZINC000858133493 1136942423 /nfs/dbraw/zinc/94/24/23/1136942423.db2.gz WLVCXYBUYVFEBM-INIZCTEOSA-N 1 1 336.357 3.783 20 10 EHCDMO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858145998 1136943474 /nfs/dbraw/zinc/94/34/74/1136943474.db2.gz MSVPYCDYRSUVDG-QGZVFWFLSA-N 1 1 348.393 3.653 20 10 EHCDMO CCCc1cc(NCc2cc(Br)ccc2O)nc(C)[nH+]1 ZINC001160019696 1137054917 /nfs/dbraw/zinc/05/49/17/1137054917.db2.gz SBHXWQWNMRTGKJ-UHFFFAOYSA-N 1 1 336.233 3.818 20 10 EHCDMO CN(C)c1ncc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)n1C ZINC000822437969 1137059875 /nfs/dbraw/zinc/05/98/75/1137059875.db2.gz ACDAWAQSGWUROJ-UHFFFAOYSA-N 1 1 342.487 3.527 20 10 EHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1F ZINC000823390116 1137097868 /nfs/dbraw/zinc/09/78/68/1137097868.db2.gz FBONSRGCIPJVKF-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO C[C@@H]1COCC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823458799 1137100610 /nfs/dbraw/zinc/10/06/10/1137100610.db2.gz GXCXFGXEKLCKTA-INIZCTEOSA-N 1 1 330.497 3.853 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](CCO)C2CCC2)cc1 ZINC000824242454 1137129743 /nfs/dbraw/zinc/12/97/43/1137129743.db2.gz PLTOSFXIISFGJL-UHFFFAOYSA-N 1 1 330.497 3.731 20 10 EHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Br)on1 ZINC000862227697 1137133356 /nfs/dbraw/zinc/13/33/56/1137133356.db2.gz GJDZPUPIVIVTGY-ZDUSSCGKSA-N 1 1 337.217 3.788 20 10 EHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(O)cccc2Br)on1 ZINC000862227697 1137133357 /nfs/dbraw/zinc/13/33/57/1137133357.db2.gz GJDZPUPIVIVTGY-ZDUSSCGKSA-N 1 1 337.217 3.788 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1F ZINC000862370457 1137140985 /nfs/dbraw/zinc/14/09/85/1137140985.db2.gz MDQQOWGWLBWGNX-QZTJIDSGSA-N 1 1 336.426 3.564 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1F ZINC000862370457 1137140987 /nfs/dbraw/zinc/14/09/87/1137140987.db2.gz MDQQOWGWLBWGNX-QZTJIDSGSA-N 1 1 336.426 3.564 20 10 EHCDMO CC[C@@H](C)[N@@H+](CCO)Cc1ccc(OCc2ccccc2)cc1O ZINC000862386927 1137141910 /nfs/dbraw/zinc/14/19/10/1137141910.db2.gz DKISYTPWQMTDBC-MRXNPFEDSA-N 1 1 329.440 3.564 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824695773 1137148914 /nfs/dbraw/zinc/14/89/14/1137148914.db2.gz CMKOYSFRCFEWPG-WQVCFCJDSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824695773 1137148916 /nfs/dbraw/zinc/14/89/16/1137148916.db2.gz CMKOYSFRCFEWPG-WQVCFCJDSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000824855852 1137154905 /nfs/dbraw/zinc/15/49/05/1137154905.db2.gz QSEQGWIYGBLCSY-UHFFFAOYSA-N 1 1 336.151 3.849 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000824855852 1137154906 /nfs/dbraw/zinc/15/49/06/1137154906.db2.gz QSEQGWIYGBLCSY-UHFFFAOYSA-N 1 1 336.151 3.849 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)cc1Cl ZINC000824877068 1137156935 /nfs/dbraw/zinc/15/69/35/1137156935.db2.gz IVASOZFTIZGXOR-QFIPXVFZSA-N 1 1 337.872 3.723 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824952461 1137159133 /nfs/dbraw/zinc/15/91/33/1137159133.db2.gz AVJCACDRFZJKHG-MLGOLLRUSA-N 1 1 336.794 3.590 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1OC(F)(F)F ZINC001143878725 1137208071 /nfs/dbraw/zinc/20/80/71/1137208071.db2.gz IFCYZEXBMOVTHH-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000863941734 1137208628 /nfs/dbraw/zinc/20/86/28/1137208628.db2.gz JPPJQLMASYDIKZ-FQEVSTJZSA-N 1 1 345.531 3.754 20 10 EHCDMO COc1cc(C[N@H+]2C[C@H](C)O[C@@H](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794653251 1137223883 /nfs/dbraw/zinc/22/38/83/1137223883.db2.gz LKEOOJVHTFQAQS-SCLBCKFNSA-N 1 1 333.472 3.698 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](OCC(C)C)C3)c2c1 ZINC000120828239 1137321611 /nfs/dbraw/zinc/32/16/11/1137321611.db2.gz QZYUDOHZDOYRAZ-KRWDZBQOSA-N 1 1 329.440 3.801 20 10 EHCDMO CO[C@@]1(C)CCC[N@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000793338917 1137331512 /nfs/dbraw/zinc/33/15/12/1137331512.db2.gz HPPBNIPFPSQFDM-INIZCTEOSA-N 1 1 342.277 3.854 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000793338917 1137331514 /nfs/dbraw/zinc/33/15/14/1137331514.db2.gz HPPBNIPFPSQFDM-INIZCTEOSA-N 1 1 342.277 3.854 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000846167577 1137337380 /nfs/dbraw/zinc/33/73/80/1137337380.db2.gz KXYXHUFTZHJKAM-FUHWJXTLSA-N 1 1 340.467 3.574 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1O ZINC000846164224 1137337425 /nfs/dbraw/zinc/33/74/25/1137337425.db2.gz NEIRWZDBBCNQEA-LBPRGKRZSA-N 1 1 334.416 3.555 20 10 EHCDMO COc1cccc([C@@H](C)N[C@H](C[NH+]2CCCC2)c2ccccc2)c1O ZINC000846136674 1137338095 /nfs/dbraw/zinc/33/80/95/1137338095.db2.gz MVVUJCBOIOWWLW-VQIMIIECSA-N 1 1 340.467 3.889 20 10 EHCDMO C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000846206040 1137339384 /nfs/dbraw/zinc/33/93/84/1137339384.db2.gz UHWRTRLJJHHJHA-UWVGGRQHSA-N 1 1 346.240 3.760 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(C(C)(C)C)nc1 ZINC000793571886 1137343338 /nfs/dbraw/zinc/34/33/38/1137343338.db2.gz NIPWVFCVFPMGBY-UHFFFAOYSA-N 1 1 326.488 3.862 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC000866482224 1137358293 /nfs/dbraw/zinc/35/82/93/1137358293.db2.gz VSLHDSRHXSQFQC-KDOFPFPSSA-N 1 1 347.455 3.569 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCn2nccc21)c1cccc(C(F)(F)F)c1O ZINC000866633517 1137371382 /nfs/dbraw/zinc/37/13/82/1137371382.db2.gz JEHRSWZVVNKSPP-GWCFXTLKSA-N 1 1 325.334 3.793 20 10 EHCDMO O[C@@H]([C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1)C(F)(F)F ZINC000123664677 1137545537 /nfs/dbraw/zinc/54/55/37/1137545537.db2.gz GDXSZBUDUNIGQK-SJORKVTESA-N 1 1 342.405 3.565 20 10 EHCDMO CCCC[N@H+](Cc1ccnn1-c1ccncc1)Cc1ccccc1O ZINC000825789614 1137633062 /nfs/dbraw/zinc/63/30/62/1137633062.db2.gz SPJUBXBHGPMLBF-UHFFFAOYSA-N 1 1 336.439 3.775 20 10 EHCDMO CCCC[N@@H+](Cc1ccnn1-c1ccncc1)Cc1ccccc1O ZINC000825789614 1137633063 /nfs/dbraw/zinc/63/30/63/1137633063.db2.gz SPJUBXBHGPMLBF-UHFFFAOYSA-N 1 1 336.439 3.775 20 10 EHCDMO Nc1ccc(NC(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000876504310 1137654325 /nfs/dbraw/zinc/65/43/25/1137654325.db2.gz MKGOMFFULVOKNT-IBGZPJMESA-N 1 1 335.451 3.510 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@H]3C3CCCC3)cc2)CC1 ZINC000876632311 1137657808 /nfs/dbraw/zinc/65/78/08/1137657808.db2.gz IUVDIMYCYTUMFS-NRFANRHFSA-N 1 1 328.500 3.802 20 10 EHCDMO COc1ccccc1-c1noc([C@H](C)[NH2+]Cc2ccc(C)cc2O)n1 ZINC000877469897 1137677205 /nfs/dbraw/zinc/67/72/05/1137677205.db2.gz BDIGSSBVWOKKFY-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1F ZINC000877674933 1137685304 /nfs/dbraw/zinc/68/53/04/1137685304.db2.gz XMUMMNHGGVXCEF-FXAWDEMLSA-N 1 1 328.431 3.590 20 10 EHCDMO COc1cc(Cl)cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000877758507 1137688537 /nfs/dbraw/zinc/68/85/37/1137688537.db2.gz GEKPWAXHINBSDD-AWEZNQCLSA-N 1 1 327.758 3.994 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3cc(C(C)C)n[nH]3)C2)c1 ZINC000877783589 1137689731 /nfs/dbraw/zinc/68/97/31/1137689731.db2.gz AQOZMVDISIVWPJ-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1 ZINC000877783589 1137689732 /nfs/dbraw/zinc/68/97/32/1137689732.db2.gz AQOZMVDISIVWPJ-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1 ZINC000877783589 1137689733 /nfs/dbraw/zinc/68/97/33/1137689733.db2.gz AQOZMVDISIVWPJ-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc4ncccc4c3)CC2)cc1 ZINC000130536474 1137839216 /nfs/dbraw/zinc/83/92/16/1137839216.db2.gz PBUGGKGPSJKKAC-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO CCC[N@@H+](CC)C[C@@H](C)NCc1ccc(N(C)C)cc1C(F)(F)F ZINC001202612250 1137884103 /nfs/dbraw/zinc/88/41/03/1137884103.db2.gz UOFPNQDRDAKEQF-CQSZACIVSA-N 1 1 345.453 3.981 20 10 EHCDMO CCCN(CC)C[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001202612250 1137884104 /nfs/dbraw/zinc/88/41/04/1137884104.db2.gz UOFPNQDRDAKEQF-CQSZACIVSA-N 1 1 345.453 3.981 20 10 EHCDMO CSc1cccc(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)c1 ZINC000109773137 1137897465 /nfs/dbraw/zinc/89/74/65/1137897465.db2.gz NUPIQARXAOYYQD-CYBMUJFWSA-N 1 1 330.453 3.573 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@@H](C)c1c(O)cccc1F)O[C@@H](C)C2 ZINC000886500319 1138084533 /nfs/dbraw/zinc/08/45/33/1138084533.db2.gz PEAZLYJQPUURRW-RYUDHWBXSA-N 1 1 331.387 3.714 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1c(O)cccc1F ZINC000886502571 1138085073 /nfs/dbraw/zinc/08/50/73/1138085073.db2.gz DOIOLZHTZNDRRJ-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1c(O)cccc1F ZINC000886502940 1138085213 /nfs/dbraw/zinc/08/52/13/1138085213.db2.gz USJQTSGMODJZTN-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO CC(C)Oc1ccc([C@H](O)C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886527881 1138090570 /nfs/dbraw/zinc/09/05/70/1138090570.db2.gz BTQLQLAHPDXTNV-SCLBCKFNSA-N 1 1 333.403 3.703 20 10 EHCDMO C[C@@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)c1c(O)cccc1F ZINC000886553239 1138094947 /nfs/dbraw/zinc/09/49/47/1138094947.db2.gz HPIZDYQAPSAPJW-CABCVRRESA-N 1 1 343.446 3.803 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886608923 1138101321 /nfs/dbraw/zinc/10/13/21/1138101321.db2.gz IDOUQTDWNAWPEJ-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886644844 1138105581 /nfs/dbraw/zinc/10/55/81/1138105581.db2.gz LXPCUEAMNWKEGO-QMTHXVAHSA-N 1 1 343.320 3.934 20 10 EHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(OC)c(OC)cc2O)cc1 ZINC000179664504 1139772812 /nfs/dbraw/zinc/77/28/12/1139772812.db2.gz IUMJNUQQXMRWJR-CYBMUJFWSA-N 1 1 331.412 3.611 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)C[C@H](C)c2nccs2)c1O ZINC000184744863 1140118846 /nfs/dbraw/zinc/11/88/46/1140118846.db2.gz SELGPKAUIZLGNP-JTQLQIEISA-N 1 1 326.849 3.746 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)c(F)c2[O-])c1 ZINC000187700479 1140268066 /nfs/dbraw/zinc/26/80/66/1140268066.db2.gz NIXUFMMLQIHYNU-CYBMUJFWSA-N 1 1 334.410 3.973 20 10 EHCDMO COc1ncccc1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192651951 1140541988 /nfs/dbraw/zinc/54/19/88/1140541988.db2.gz JIIOUVNTUURXQZ-SECBINFHSA-N 1 1 327.211 3.953 20 10 EHCDMO Cn1c2ccccc2[nH+]c1NCc1ccc(N2CCSCC2)cc1 ZINC000178807853 1018737654 /nfs/dbraw/zinc/73/76/54/1018737654.db2.gz LPLXLMBZNVQDPM-UHFFFAOYSA-N 1 1 338.480 3.739 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2nccn2C(F)F)c(C(F)(F)F)c1 ZINC000280059103 1020016196 /nfs/dbraw/zinc/01/61/96/1020016196.db2.gz WSKFNRXEYFUFHY-UHFFFAOYSA-N 1 1 348.319 3.653 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)[C@@H](C)C1 ZINC000280054359 1020038951 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329.532 3.982 20 10 EHCDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000769471867 1133297517 /nfs/dbraw/zinc/29/75/17/1133297517.db2.gz XPPGXPWCYYWZSW-GHTZIAJQSA-N 1 1 329.532 3.982 20 10 EHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769476302 1133299690 /nfs/dbraw/zinc/29/96/90/1133299690.db2.gz YFGQPHVKBDASQX-MRXNPFEDSA-N 1 1 328.431 3.890 20 10 EHCDMO CC[C@]1(C)CC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000769519566 1133308253 /nfs/dbraw/zinc/30/82/53/1133308253.db2.gz SBFMSKFVRYRSQE-OAHLLOKOSA-N 1 1 328.250 3.785 20 10 EHCDMO CCOCC[C@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000769767946 1133339757 /nfs/dbraw/zinc/33/97/57/1133339757.db2.gz DDCOQHVAPKQWSE-XLIONFOSSA-N 1 1 343.467 3.743 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](CC(=O)OC(C)(C)C)C2)c1O ZINC000770332271 1133406463 /nfs/dbraw/zinc/40/64/63/1133406463.db2.gz MGPMIRJOWMSBPV-OAHLLOKOSA-N 1 1 349.471 3.735 20 10 EHCDMO CCOc1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c(O)c1 ZINC000770303644 1133407910 /nfs/dbraw/zinc/40/79/10/1133407910.db2.gz KLFLGAWKKJOGLS-IBGZPJMESA-N 1 1 341.451 3.625 20 10 EHCDMO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1cc(F)c(F)cc1O)N(C)C ZINC001180942630 1133433243 /nfs/dbraw/zinc/43/32/43/1133433243.db2.gz KFTIRQLSJKKIFV-YJYMSZOUSA-N 1 1 334.410 3.760 20 10 EHCDMO Fc1cc(CNc2cccc3cc[nH+]cc32)ccc1N1CCOCC1 ZINC000770571901 1133445836 /nfs/dbraw/zinc/44/58/36/1133445836.db2.gz WSCNBABDVBXJTB-UHFFFAOYSA-N 1 1 337.398 3.823 20 10 EHCDMO CCOCC[N@@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC000771635111 1133582771 /nfs/dbraw/zinc/58/27/71/1133582771.db2.gz FXOOCUVVKFPWQR-UHFFFAOYSA-N 1 1 338.245 3.776 20 10 EHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CCCC[C@H]1CN1CCCC1 ZINC001204326254 1133594383 /nfs/dbraw/zinc/59/43/83/1133594383.db2.gz DOMKSPAXTMQALU-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@H]1CN1CCCC1 ZINC001204326254 1133594387 /nfs/dbraw/zinc/59/43/87/1133594387.db2.gz DOMKSPAXTMQALU-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)co2)cc1F ZINC000774177913 1133635726 /nfs/dbraw/zinc/63/57/26/1133635726.db2.gz FPOLXRQYUNZZJW-ZDUSSCGKSA-N 1 1 348.418 3.902 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C(C)(C)C2CCOCC2)c1 ZINC000785603691 1133725580 /nfs/dbraw/zinc/72/55/80/1133725580.db2.gz XYSGOJWMIYTBNN-UHFFFAOYSA-N 1 1 342.277 3.758 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000774828381 1134027777 /nfs/dbraw/zinc/02/77/77/1134027777.db2.gz ZMRZDTNMISFCEI-INIZCTEOSA-N 1 1 342.395 3.516 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000774828381 1134027782 /nfs/dbraw/zinc/02/77/82/1134027782.db2.gz ZMRZDTNMISFCEI-INIZCTEOSA-N 1 1 342.395 3.516 20 10 EHCDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774883644 1134090710 /nfs/dbraw/zinc/09/07/10/1134090710.db2.gz HNNLGUGPQDNKQJ-MRXNPFEDSA-N 1 1 342.395 3.818 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789517591 1134289848 /nfs/dbraw/zinc/28/98/48/1134289848.db2.gz WTNKIRKJNNBEKJ-QZTJIDSGSA-N 1 1 333.472 3.842 20 10 EHCDMO C[C@@]12CC[N@@H+](Cc3c(O)ccc4ccncc43)C[C@@H]1C2(Cl)Cl ZINC000789479594 1134289984 /nfs/dbraw/zinc/28/99/84/1134289984.db2.gz LKKYYOQNMHHQRM-JKSUJKDBSA-N 1 1 337.250 3.956 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1ccn(-c2ccccc2)n1 ZINC000790955781 1134485531 /nfs/dbraw/zinc/48/55/31/1134485531.db2.gz YVNHCPLFEUAFMT-UHFFFAOYSA-N 1 1 345.805 3.703 20 10 EHCDMO COc1ccc(CC[NH2+]Cc2c(O)ccc(Cl)c2F)c(OC)c1 ZINC000790962862 1134486026 /nfs/dbraw/zinc/48/60/26/1134486026.db2.gz VUSTXESHIMOIOY-UHFFFAOYSA-N 1 1 339.794 3.534 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H](Cn1cccn1)c1ccccc1 ZINC000790970763 1134487718 /nfs/dbraw/zinc/48/77/18/1134487718.db2.gz FOTYJCINPDYSSP-MRXNPFEDSA-N 1 1 345.805 3.912 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@H](c1ccccc1)N(C)C ZINC000790992452 1134489588 /nfs/dbraw/zinc/48/95/88/1134489588.db2.gz ZUQXLEQGZWRKEP-SGTLLEGYSA-N 1 1 336.838 3.966 20 10 EHCDMO C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)Oc1ccccc1F ZINC000790973330 1134493803 /nfs/dbraw/zinc/49/38/03/1134493803.db2.gz LLZAFGMTMHMZEK-SNVBAGLBSA-N 1 1 327.758 3.881 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000790983016 1134496445 /nfs/dbraw/zinc/49/64/45/1134496445.db2.gz ZQAOMWSZAJJDRO-NSHDSACASA-N 1 1 345.867 3.719 20 10 EHCDMO CCC[C@@]1(COC)CCC[N@@H+]1Cc1cccc(Br)c1O ZINC000775203481 1134512763 /nfs/dbraw/zinc/51/27/63/1134512763.db2.gz LDEJQETZEVIPLV-INIZCTEOSA-N 1 1 342.277 3.936 20 10 EHCDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cccc(Br)c1O ZINC000775203481 1134512768 /nfs/dbraw/zinc/51/27/68/1134512768.db2.gz LDEJQETZEVIPLV-INIZCTEOSA-N 1 1 342.277 3.936 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCO)C2CCCC2)c(C(F)(F)F)c1 ZINC000792765270 1134787408 /nfs/dbraw/zinc/78/74/08/1134787408.db2.gz FUEYGTXXSMIEJO-UHFFFAOYSA-N 1 1 330.394 3.508 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1O ZINC000792900346 1134816873 /nfs/dbraw/zinc/81/68/73/1134816873.db2.gz FTZCCRXLQCNQPJ-HIFRSBDPSA-N 1 1 346.229 3.750 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1O ZINC000792900346 1134816876 /nfs/dbraw/zinc/81/68/76/1134816876.db2.gz FTZCCRXLQCNQPJ-HIFRSBDPSA-N 1 1 346.229 3.750 20 10 EHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Br)ccc1O ZINC000793230315 1134880217 /nfs/dbraw/zinc/88/02/17/1134880217.db2.gz FWCWPGADICJRNB-KWQFWETISA-N 1 1 338.167 3.927 20 10 EHCDMO CCc1cc(C[N@@H+]2CC[C@@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748811 1134988785 /nfs/dbraw/zinc/98/87/85/1134988785.db2.gz UISYEMMXQDHXFZ-OAQYLSRUSA-N 1 1 330.516 3.780 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748811 1134988790 /nfs/dbraw/zinc/98/87/90/1134988790.db2.gz UISYEMMXQDHXFZ-OAQYLSRUSA-N 1 1 330.516 3.780 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C(C)C)[C@H](CO)C(C)C)c1O ZINC001194497693 1135279504 /nfs/dbraw/zinc/27/95/04/1135279504.db2.gz ODFOLCXTQIEHJA-SJORKVTESA-N 1 1 341.879 3.627 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2O)ccc1OC(F)F ZINC000775643551 1135385731 /nfs/dbraw/zinc/38/57/31/1135385731.db2.gz ZTDIIUARCAJNJW-UHFFFAOYSA-N 1 1 337.366 3.943 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](Cc2ccc(C(N)=O)cc2)C2CC2)c1O ZINC000775649035 1135405303 /nfs/dbraw/zinc/40/53/03/1135405303.db2.gz IRUBMUVFXCYIAG-UHFFFAOYSA-N 1 1 344.842 3.618 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1C(C)C ZINC000747461824 1135625137 /nfs/dbraw/zinc/62/51/37/1135625137.db2.gz UEIKHJNIBWNNGI-MRXNPFEDSA-N 1 1 327.472 3.622 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC3(C1)Oc1ccccc1O3)CCCC2 ZINC000808238411 1135640183 /nfs/dbraw/zinc/64/01/83/1135640183.db2.gz DITAHEQJJPHABG-UHFFFAOYSA-N 1 1 337.419 3.644 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)o1 ZINC000747533022 1135748941 /nfs/dbraw/zinc/74/89/41/1135748941.db2.gz GSWMGKMDTOVUED-UHFFFAOYSA-N 1 1 344.455 3.851 20 10 EHCDMO CC(C)N(Cc1ncc(C[NH+](C)C)s1)Cc1ccc(N(C)C)cc1 ZINC000809546661 1135854439 /nfs/dbraw/zinc/85/44/39/1135854439.db2.gz CIMRSTDMRKFSBU-UHFFFAOYSA-N 1 1 346.544 3.681 20 10 EHCDMO C[C@H]1C[C@@H](N2CCCC2)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703659 1135874592 /nfs/dbraw/zinc/87/45/92/1135874592.db2.gz OENPVWDOMSXYAS-GHTZIAJQSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@H]1C[C@@H](N2CCCC2)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703659 1135874596 /nfs/dbraw/zinc/87/45/96/1135874596.db2.gz OENPVWDOMSXYAS-GHTZIAJQSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1[C@@H](N2CCCC2)CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724150 1135878743 /nfs/dbraw/zinc/87/87/43/1135878743.db2.gz FKQKDCNZLWWENT-NQIIRXRSSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1[C@@H](N2CCCC2)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724150 1135878744 /nfs/dbraw/zinc/87/87/44/1135878744.db2.gz FKQKDCNZLWWENT-NQIIRXRSSA-N 1 1 327.516 3.736 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000809764074 1135888358 /nfs/dbraw/zinc/88/83/58/1135888358.db2.gz GTPJUGNJUZAUEU-UHFFFAOYSA-N 1 1 337.511 3.849 20 10 EHCDMO OC[C@]1(Cc2ccc(F)cc2)CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000809791107 1135893247 /nfs/dbraw/zinc/89/32/47/1135893247.db2.gz UGVLWTUDWOEPMH-IBGZPJMESA-N 1 1 349.833 3.612 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cc1OC ZINC000776012895 1135917761 /nfs/dbraw/zinc/91/77/61/1135917761.db2.gz KLYHYEGZIJUGGP-PWSUYJOCSA-N 1 1 333.350 3.572 20 10 EHCDMO CC(C)c1ccc(C[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC001199699929 1135924666 /nfs/dbraw/zinc/92/46/66/1135924666.db2.gz BAXQXMOBMAZWEP-UHFFFAOYSA-N 1 1 337.511 3.852 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(C(F)(F)F)cc1O ZINC000810253840 1135948936 /nfs/dbraw/zinc/94/89/36/1135948936.db2.gz DWNRRAZSBIASEQ-YPMHNXCESA-N 1 1 339.361 3.732 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c1 ZINC000811780746 1136135007 /nfs/dbraw/zinc/13/50/07/1136135007.db2.gz WLRVBYALYHPSLE-WMZOPIPTSA-N 1 1 333.472 3.785 20 10 EHCDMO COc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)c(O)c(C(C)(C)C)c1 ZINC000850160826 1136216152 /nfs/dbraw/zinc/21/61/52/1136216152.db2.gz SUQXDASUMHSCKN-ALOPSCKCSA-N 1 1 346.515 3.803 20 10 EHCDMO COc1cc(C[NH2+]C2CC(N3CCCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000850283105 1136230668 /nfs/dbraw/zinc/23/06/68/1136230668.db2.gz VQUSMGFRLWVMGV-UHFFFAOYSA-N 1 1 346.515 3.805 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1cccc(C(F)(F)F)c1O ZINC000850494403 1136270881 /nfs/dbraw/zinc/27/08/81/1136270881.db2.gz OQEVCUCCNQPHMU-VXGBXAGGSA-N 1 1 330.394 3.934 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccc(N2CCCCC2)cc1 ZINC000850498886 1136272167 /nfs/dbraw/zinc/27/21/67/1136272167.db2.gz FGMLYYPLDHLZSS-RLFYNMQTSA-N 1 1 325.460 3.625 20 10 EHCDMO CC[C@@H]([NH2+]CC1(CC(=O)NC)CCCCC1)c1ccc(F)cc1O ZINC000850554483 1136284215 /nfs/dbraw/zinc/28/42/15/1136284215.db2.gz DUHAQZQQGZOSAD-MRXNPFEDSA-N 1 1 336.451 3.659 20 10 EHCDMO CC1(C)OC[C@@H](CC[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000851841191 1136412886 /nfs/dbraw/zinc/41/28/86/1136412886.db2.gz NUQVOWRSIBINDK-QGZVFWFLSA-N 1 1 331.412 3.529 20 10 EHCDMO CC[C@@H](CC(F)F)C[N@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000851841667 1136413332 /nfs/dbraw/zinc/41/33/32/1136413332.db2.gz WIIHOOWWYXSFQH-NSHDSACASA-N 1 1 349.805 3.702 20 10 EHCDMO CC[C@@H](CC(F)F)C[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000851841667 1136413335 /nfs/dbraw/zinc/41/33/35/1136413335.db2.gz WIIHOOWWYXSFQH-NSHDSACASA-N 1 1 349.805 3.702 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1O ZINC000814170572 1136415304 /nfs/dbraw/zinc/41/53/04/1136415304.db2.gz ZBJQQJJHTWCGIW-OCCSQVGLSA-N 1 1 346.215 3.940 20 10 EHCDMO CCOC[C@@H]1CC[N@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000747966507 1136486948 /nfs/dbraw/zinc/48/69/48/1136486948.db2.gz IXCQSWRRXBKFER-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO CCOC[C@@H]1CC[N@@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000747966507 1136486952 /nfs/dbraw/zinc/48/69/52/1136486952.db2.gz IXCQSWRRXBKFER-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)ccc1N(C)C ZINC000815061265 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/nfs/dbraw/zinc/74/22/97/1136742297.db2.gz VJPZXNNSGRUUOR-FQEVSTJZSA-N 1 1 337.467 3.501 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000816666320 1136747304 /nfs/dbraw/zinc/74/73/04/1136747304.db2.gz KGFAZMIHUHQQMS-SFTDATJTSA-N 1 1 326.484 3.820 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@@H](O)CC23CCC3)ccc1N1CCCCC1 ZINC000817290502 1136791638 /nfs/dbraw/zinc/79/16/38/1136791638.db2.gz JIWVPNHSXQERKK-LJQANCHMSA-N 1 1 328.500 3.865 20 10 EHCDMO CCC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938355 1136847902 /nfs/dbraw/zinc/84/79/02/1136847902.db2.gz JHOZNJQFZXRXDY-RTWAWAEBSA-N 1 1 341.499 3.892 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817944380 1136849526 /nfs/dbraw/zinc/84/95/26/1136849526.db2.gz ZZNYHCXFQOTMQK-RTBURBONSA-N 1 1 329.875 3.683 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccccc2OC(F)F)cc1F ZINC000858090728 1136938785 /nfs/dbraw/zinc/93/87/85/1136938785.db2.gz QNSZXDDOGXLPIJ-UHFFFAOYSA-N 1 1 342.336 3.922 20 10 EHCDMO COc1cc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000858245467 1136951912 /nfs/dbraw/zinc/95/19/12/1136951912.db2.gz JGIHNRUDMVHJDA-HNNXBMFYSA-N 1 1 334.504 3.520 20 10 EHCDMO Cc1cc(C[NH2+]Cc2c(Cl)cnn2C)c(C)n1-c1ccccc1 ZINC000858293832 1136955840 /nfs/dbraw/zinc/95/58/40/1136955840.db2.gz QSHBBTAEVXVMIT-UHFFFAOYSA-N 1 1 328.847 3.771 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CCc3cccc(F)c3C1)CCC2 ZINC001171004509 1137084776 /nfs/dbraw/zinc/08/47/76/1137084776.db2.gz GJALHTFALHCYDX-MRXNPFEDSA-N 1 1 327.399 3.543 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000777220613 1137122221 /nfs/dbraw/zinc/12/22/21/1137122221.db2.gz GGDGPRHKMUQDHR-OAQYLSRUSA-N 1 1 339.435 3.582 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000862023889 1137127346 /nfs/dbraw/zinc/12/73/46/1137127346.db2.gz KDJMAHOQZXSORT-DLBZAZTESA-N 1 1 333.520 3.658 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000862402778 1137142757 /nfs/dbraw/zinc/14/27/57/1137142757.db2.gz RKYGQFJUUYGUCE-ZDUSSCGKSA-N 1 1 340.261 3.688 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CC2(C)COC2)cc1 ZINC000862479732 1137146174 /nfs/dbraw/zinc/14/61/74/1137146174.db2.gz ZMLJIKBJXXZCFB-UHFFFAOYSA-N 1 1 330.497 3.853 20 10 EHCDMO COC[C@]1(C)C[N@@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000863339916 1137181532 /nfs/dbraw/zinc/18/15/32/1137181532.db2.gz GHICRSHNCCMNFH-FQEVSTJZSA-N 1 1 341.407 3.529 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)cc2)CC1 ZINC000844469032 1137226906 /nfs/dbraw/zinc/22/69/06/1137226906.db2.gz UBLSDNPFYMZVPW-GOSISDBHSA-N 1 1 336.426 3.533 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CN1C(=O)CC12CCCC2 ZINC000844680807 1137246613 /nfs/dbraw/zinc/24/66/13/1137246613.db2.gz LLSRIGBXFLRJNI-UHFFFAOYSA-N 1 1 341.499 3.611 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)CN1C(=O)CC12CCCC2 ZINC000844680807 1137246615 /nfs/dbraw/zinc/24/66/15/1137246615.db2.gz LLSRIGBXFLRJNI-UHFFFAOYSA-N 1 1 341.499 3.611 20 10 EHCDMO CCn1ncnc1C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000794836525 1137276399 /nfs/dbraw/zinc/27/63/99/1137276399.db2.gz OUYAJXXKRUZEDD-MRXNPFEDSA-N 1 1 327.476 3.529 20 10 EHCDMO COc1c(O)c(C[NH2+]C2(c3ccccc3C)CCC2)ccc1[N+](=O)[O-] ZINC000845994723 1137327071 /nfs/dbraw/zinc/32/70/71/1137327071.db2.gz JOARDFLCJJHYKO-UHFFFAOYSA-N 1 1 342.395 3.786 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1O ZINC000846116452 1137333768 /nfs/dbraw/zinc/33/37/68/1137333768.db2.gz HUUXNTJYQBQBHZ-ZDUSSCGKSA-N 1 1 332.188 3.694 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000846118172 1137334204 /nfs/dbraw/zinc/33/42/04/1137334204.db2.gz UYCQDTXXAZPYPK-CYBMUJFWSA-N 1 1 332.188 3.694 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000846118172 1137334205 /nfs/dbraw/zinc/33/42/05/1137334205.db2.gz UYCQDTXXAZPYPK-CYBMUJFWSA-N 1 1 332.188 3.694 20 10 EHCDMO COc1ccc(C[NH2+][C@H](C)c2ncc(C)s2)cc1Cn1cccn1 ZINC000873071969 1137589464 /nfs/dbraw/zinc/58/94/64/1137589464.db2.gz 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Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)c(O)c1 ZINC000877523728 1137679573 /nfs/dbraw/zinc/67/95/73/1137679573.db2.gz MRZZLJHXWRTOSK-DOTOQJQBSA-N 1 1 343.427 3.662 20 10 EHCDMO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)c(O)c1 ZINC000877523728 1137679574 /nfs/dbraw/zinc/67/95/74/1137679574.db2.gz MRZZLJHXWRTOSK-DOTOQJQBSA-N 1 1 343.427 3.662 20 10 EHCDMO Cc1ccc(C[N@H+](C)C2CCN(CCC(F)(F)F)CC2)c(O)c1 ZINC000877575885 1137681672 /nfs/dbraw/zinc/68/16/72/1137681672.db2.gz BTOXJHQUQNFLMV-UHFFFAOYSA-N 1 1 330.394 3.549 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@@H](C4CCCC4)C3)cc2)CC1 ZINC000877594827 1137682313 /nfs/dbraw/zinc/68/23/13/1137682313.db2.gz KNMXVNNHZBDUSV-LJQANCHMSA-N 1 1 328.500 3.660 20 10 EHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2cc(Cl)c(F)cc2[O-])c1C ZINC000877663701 1137684902 /nfs/dbraw/zinc/68/49/02/1137684902.db2.gz GCVNUDHXXVJYEA-UHFFFAOYSA-N 1 1 325.815 3.650 20 10 EHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)c1C ZINC000877663701 1137684904 /nfs/dbraw/zinc/68/49/04/1137684904.db2.gz GCVNUDHXXVJYEA-UHFFFAOYSA-N 1 1 325.815 3.650 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC000877810546 1137690865 /nfs/dbraw/zinc/69/08/65/1137690865.db2.gz WBDRIGQKZAQWOJ-LBPRGKRZSA-N 1 1 330.428 3.755 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCC2(CCOCC2)O1 ZINC000877975602 1137697937 /nfs/dbraw/zinc/69/79/37/1137697937.db2.gz AMPCYHZDGSVEAF-HXUWFJFHSA-N 1 1 346.515 3.691 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cc1 ZINC000878906000 1137731777 /nfs/dbraw/zinc/73/17/77/1137731777.db2.gz ZUQPQANPLOWBNO-SFHVURJKSA-N 1 1 332.451 3.685 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1c(F)cccc1Cl ZINC000883025952 1137841871 /nfs/dbraw/zinc/84/18/71/1137841871.db2.gz CRYCKRPOZWHNQT-GLEZIHRCSA-N 1 1 345.748 3.675 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(OC)c1OC ZINC000883197254 1137848080 /nfs/dbraw/zinc/84/80/80/1137848080.db2.gz HLSINQSDWRXELB-OAHLLOKOSA-N 1 1 337.366 3.929 20 10 EHCDMO Cc1cc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c(C)s1 ZINC000883289476 1137852859 /nfs/dbraw/zinc/85/28/59/1137852859.db2.gz PUUDOBMREZABPK-INIZCTEOSA-N 1 1 343.540 3.968 20 10 EHCDMO C[C@H](Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1)c1ccccc1O ZINC000883347826 1137856783 /nfs/dbraw/zinc/85/67/83/1137856783.db2.gz ZTLDKCZHWHKLFV-QFBILLFUSA-N 1 1 337.467 3.850 20 10 EHCDMO F[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000883384275 1137858650 /nfs/dbraw/zinc/85/86/50/1137858650.db2.gz OEVDBMAATFBINJ-NHCUHLMSSA-N 1 1 340.442 3.638 20 10 EHCDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1OC ZINC000215913223 1137964629 /nfs/dbraw/zinc/96/46/29/1137964629.db2.gz JXZNCXPCDNDUKY-UHFFFAOYSA-N 1 1 328.456 3.710 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1c(O)cccc1F ZINC000886512630 1138087196 /nfs/dbraw/zinc/08/71/96/1138087196.db2.gz JUJZSGZUBSFCLA-LSDHHAIUSA-N 1 1 344.430 3.780 20 10 EHCDMO CC(=O)N1CC[C@@H]([NH2+][C@H](C)c2c(O)cccc2F)c2ccccc21 ZINC000886556745 1138096031 /nfs/dbraw/zinc/09/60/31/1138096031.db2.gz JJRHZYCRJWZMTF-MLGOLLRUSA-N 1 1 328.387 3.680 20 10 EHCDMO C[C@H](CCCNC(=O)OC(C)(C)C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886615986 1138102425 /nfs/dbraw/zinc/10/24/25/1138102425.db2.gz SBBYHGMCKYBLMK-OLZOCXBDSA-N 1 1 340.439 3.875 20 10 EHCDMO C[C@@H](CCCNC(=O)OC(C)(C)C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886615988 1138102439 /nfs/dbraw/zinc/10/24/39/1138102439.db2.gz SBBYHGMCKYBLMK-STQMWFEESA-N 1 1 340.439 3.875 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(Cl)nc1)C[C@H]1CCCO1 ZINC000072629256 1138106675 /nfs/dbraw/zinc/10/66/75/1138106675.db2.gz OMEHCPOGHGCMRB-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO CCOc1cccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)c1O ZINC000092436663 1138228132 /nfs/dbraw/zinc/22/81/32/1138228132.db2.gz AAJLWANVVJOEQT-KRWDZBQOSA-N 1 1 331.412 3.565 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc(OC)c(OC)c2)c1 ZINC000179660505 1139772513 /nfs/dbraw/zinc/77/25/13/1139772513.db2.gz UUPLHTILJUFVFF-KRWDZBQOSA-N 1 1 343.423 3.755 20 10 EHCDMO CCC[N@H+](Cc1nnc(C2CC2)n1C1CC1)Cc1ccccc1O ZINC000181403740 1139905481 /nfs/dbraw/zinc/90/54/81/1139905481.db2.gz MQTVCZGISXFCQO-UHFFFAOYSA-N 1 1 326.444 3.608 20 10 EHCDMO CCC[N@@H+](Cc1nnc(C2CC2)n1C1CC1)Cc1ccccc1O ZINC000181403740 1139905483 /nfs/dbraw/zinc/90/54/83/1139905483.db2.gz MQTVCZGISXFCQO-UHFFFAOYSA-N 1 1 326.444 3.608 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1ccc(F)cc1O ZINC000185019413 1140131956 /nfs/dbraw/zinc/13/19/56/1140131956.db2.gz ANBAVYSQBODBJA-ZDUSSCGKSA-N 1 1 328.387 3.509 20 10 EHCDMO CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Br)ccc2[O-])C1 ZINC000185112028 1140136450 /nfs/dbraw/zinc/13/64/50/1140136450.db2.gz YMVFLQLOYRAMHF-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Br)ccc2[O-])C1 ZINC000185112028 1140136453 /nfs/dbraw/zinc/13/64/53/1140136453.db2.gz YMVFLQLOYRAMHF-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO CC(C)Oc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185470393 1140151473 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CC1([C@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)OCCO1 ZINC000183238070 1125481507 /nfs/dbraw/zinc/48/15/07/1125481507.db2.gz ZBIFCLQOXWKSQC-IBGZPJMESA-N 1 1 344.499 3.652 20 10 EHCDMO Cn1ccc([C@H]([NH2+]Cc2ccccc2O)c2ccc(Cl)cc2)n1 ZINC000376897332 1017186669 /nfs/dbraw/zinc/18/66/69/1017186669.db2.gz RCAVXOOAODIVHI-GOSISDBHSA-N 1 1 327.815 3.658 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCn3cccc3[C@H]1c1ccccc1)OCO2 ZINC000158697098 1018962792 /nfs/dbraw/zinc/96/27/92/1018962792.db2.gz VOMXIVHYRYSLPH-OAQYLSRUSA-N 1 1 348.402 3.528 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCn3cccc3[C@H]1c1ccccc1)OCO2 ZINC000158697098 1018962801 /nfs/dbraw/zinc/96/28/01/1018962801.db2.gz VOMXIVHYRYSLPH-OAQYLSRUSA-N 1 1 348.402 3.528 20 10 EHCDMO Cc1noc(C[C@H]2CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)n1 ZINC000897576228 1032810553 /nfs/dbraw/zinc/81/05/53/1032810553.db2.gz CDJXDKZDRGUJQW-OAHLLOKOSA-N 1 1 337.423 3.692 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2nccn2CC)c1 ZINC000280748508 1020611818 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CO[C@@]1(C)CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894621727 1022634407 /nfs/dbraw/zinc/63/44/07/1022634407.db2.gz JCTFXCPFXZEACB-HNNXBMFYSA-N 1 1 346.240 3.685 20 10 EHCDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891914820 1023392011 /nfs/dbraw/zinc/39/20/11/1023392011.db2.gz BVXODLPNIMHOAS-MRXNPFEDSA-N 1 1 343.423 3.755 20 10 EHCDMO C[N@@H+](CCc1ccccc1Cl)Cc1ccc(N2CCOCC2)cc1 ZINC000729542429 1024574240 /nfs/dbraw/zinc/57/42/40/1024574240.db2.gz DTHZBNATDVQINP-UHFFFAOYSA-N 1 1 344.886 3.851 20 10 EHCDMO CSc1ccccc1NC(=O)C[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000119686360 1024801724 /nfs/dbraw/zinc/80/17/24/1024801724.db2.gz MJZKDEMVDJJEIB-UHFFFAOYSA-N 1 1 344.480 3.801 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3cccc(Cl)c3[O-])[C@H]2C(C)C)C1 ZINC000895989756 1025046723 /nfs/dbraw/zinc/04/67/23/1025046723.db2.gz OTTQKMNHGAUQQO-INIZCTEOSA-N 1 1 339.863 3.655 20 10 EHCDMO CCC(C)(C)NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435649536 1025060476 /nfs/dbraw/zinc/06/04/76/1025060476.db2.gz WUQVDEULGZXKOI-UHFFFAOYSA-N 1 1 341.499 3.713 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2cnc(Cl)s2)c1 ZINC000895152447 1025191807 /nfs/dbraw/zinc/19/18/07/1025191807.db2.gz CRIZTZNENFROFN-UHFFFAOYSA-N 1 1 347.665 3.863 20 10 EHCDMO CCOc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1OC(F)F ZINC000896641498 1025795292 /nfs/dbraw/zinc/79/52/92/1025795292.db2.gz SDVPAJYHUVHOAS-UHFFFAOYSA-N 1 1 341.329 3.821 20 10 EHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000121292778 1026576441 /nfs/dbraw/zinc/57/64/41/1026576441.db2.gz VBRCOJZKBQTPSF-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO C[N@@H+](Cc1coc2ccccc12)Cc1ccc(N2CCOCC2)cc1 ZINC000121299498 1026686068 /nfs/dbraw/zinc/68/60/68/1026686068.db2.gz YRLZHMYIBDOWAI-UHFFFAOYSA-N 1 1 336.435 3.901 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000273384872 1027405650 /nfs/dbraw/zinc/40/56/50/1027405650.db2.gz JDQQDIMNMLCEIN-WDEREUQCSA-N 1 1 335.350 3.869 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(OC)cc2)c1 ZINC000273462142 1027438986 /nfs/dbraw/zinc/43/89/86/1027438986.db2.gz CWAKOJOPRAYUJI-OLZOCXBDSA-N 1 1 329.396 3.599 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c1 ZINC000273511680 1027468637 /nfs/dbraw/zinc/46/86/37/1027468637.db2.gz RVJNOYFPYNAVKS-ZBFHGGJFSA-N 1 1 347.455 3.711 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCc2csc(C(C)C)n2)c1 ZINC000273605182 1027516117 /nfs/dbraw/zinc/51/61/17/1027516117.db2.gz TXNLDOZUAJDVNW-LBPRGKRZSA-N 1 1 348.468 3.652 20 10 EHCDMO Cc1cc(-c2noc(C[N@@H+](C)Cc3ccccc3O)n2)ccc1F ZINC000137277806 1028305717 /nfs/dbraw/zinc/30/57/17/1028305717.db2.gz KEQMCMAMKYPKFG-UHFFFAOYSA-N 1 1 327.359 3.522 20 10 EHCDMO Cc1cc(-c2noc(C[N@H+](C)Cc3ccccc3O)n2)ccc1F ZINC000137277806 1028305734 /nfs/dbraw/zinc/30/57/34/1028305734.db2.gz KEQMCMAMKYPKFG-UHFFFAOYSA-N 1 1 327.359 3.522 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000093336112 1028721669 /nfs/dbraw/zinc/72/16/69/1028721669.db2.gz KUTLCVOOZKUHQX-UHFFFAOYSA-N 1 1 332.469 3.758 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000093336112 1028721688 /nfs/dbraw/zinc/72/16/88/1028721688.db2.gz KUTLCVOOZKUHQX-UHFFFAOYSA-N 1 1 332.469 3.758 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2cccs2)C2CC2)ccc1[N+](=O)[O-] ZINC000278189636 1029577591 /nfs/dbraw/zinc/57/75/91/1029577591.db2.gz HUKZBZZLQGJXGU-UHFFFAOYSA-N 1 1 334.397 3.535 20 10 EHCDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@H](C)c1cccc(O)c1 ZINC000278310061 1030099806 /nfs/dbraw/zinc/09/98/06/1030099806.db2.gz WTBAZDRCRUOMCA-GFCCVEGCSA-N 1 1 346.383 3.598 20 10 EHCDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@H](C)c1cccc(O)c1 ZINC000278310061 1030099825 /nfs/dbraw/zinc/09/98/25/1030099825.db2.gz WTBAZDRCRUOMCA-GFCCVEGCSA-N 1 1 346.383 3.598 20 10 EHCDMO COC1CCN(c2ccc(C[N@@H+](C)Cc3cccc(O)c3)cc2)CC1 ZINC000827972818 1031909816 /nfs/dbraw/zinc/90/98/16/1031909816.db2.gz CIVCOZLUINNSTM-UHFFFAOYSA-N 1 1 340.467 3.639 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC000904354013 1031972397 /nfs/dbraw/zinc/97/23/97/1031972397.db2.gz UFZWHEFTCBFUQD-KRWDZBQOSA-N 1 1 337.389 3.619 20 10 EHCDMO C[C@@H](COc1ccccc1)[NH2+]Cc1cccc(Br)c1O ZINC000725849675 1035639114 /nfs/dbraw/zinc/63/91/14/1035639114.db2.gz UMXJKPVWUGYMGM-LBPRGKRZSA-N 1 1 336.229 3.712 20 10 EHCDMO CC(C)c1nnc(C[NH2+]Cc2ccc(N3CCSCC3)cc2)s1 ZINC000892612362 1036648665 /nfs/dbraw/zinc/64/86/65/1036648665.db2.gz HQNGXPCZHADEGJ-UHFFFAOYSA-N 1 1 348.541 3.505 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761511227 1037081770 /nfs/dbraw/zinc/08/17/70/1037081770.db2.gz MZRIZOICOBQIBV-UHFFFAOYSA-N 1 1 333.819 3.946 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000183372212 1038703394 /nfs/dbraw/zinc/70/33/94/1038703394.db2.gz LLGQVWDTFOWONO-UHFFFAOYSA-N 1 1 339.391 3.902 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1O ZINC000323758672 1038920595 /nfs/dbraw/zinc/92/05/95/1038920595.db2.gz UWNKHEVQMRLVAJ-MLGOLLRUSA-N 1 1 339.863 3.764 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1O ZINC000323758672 1038920605 /nfs/dbraw/zinc/92/06/05/1038920605.db2.gz UWNKHEVQMRLVAJ-MLGOLLRUSA-N 1 1 339.863 3.764 20 10 EHCDMO Cc1[nH]c2ccccc2c1C1=CCN(c2cc(CO)cc(C)[nH+]2)CC1 ZINC000663738541 1043874611 /nfs/dbraw/zinc/87/46/11/1043874611.db2.gz CNCVYWDQMZXXRL-UHFFFAOYSA-N 1 1 333.435 3.966 20 10 EHCDMO C[C@H]([NH2+]CCSCc1ccccc1C#N)c1ccc(F)cc1O ZINC000185169721 1126801866 /nfs/dbraw/zinc/80/18/66/1126801866.db2.gz XJVUHJRPRFPLKZ-ZDUSSCGKSA-N 1 1 330.428 3.987 20 10 EHCDMO Cc1ccc([C@H](C[NH2+][C@H](C)c2ccc(F)cc2O)N2CCCC2)o1 ZINC000185297982 1126857245 /nfs/dbraw/zinc/85/72/45/1126857245.db2.gz WGVUKILOUFRYPV-PBHICJAKSA-N 1 1 332.419 3.920 20 10 EHCDMO Cc1ccc([C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)N2CCCC2)o1 ZINC000185297924 1126857403 /nfs/dbraw/zinc/85/74/03/1126857403.db2.gz WGVUKILOUFRYPV-WMLDXEAASA-N 1 1 332.419 3.920 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1O ZINC000185680859 1126982020 /nfs/dbraw/zinc/98/20/20/1126982020.db2.gz IMCOGSPXHLPRHI-WCQYABFASA-N 1 1 336.357 3.739 20 10 EHCDMO COc1ccc([C@@H]2C[C@H]([N@H+]3CCc4cccc(O)c4C3)CCO2)cc1 ZINC001168665237 1128744686 /nfs/dbraw/zinc/74/46/86/1128744686.db2.gz NRZPMFUCNCPERH-UTKZUKDTSA-N 1 1 339.435 3.679 20 10 EHCDMO C[C@@H](CCN(C)C)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001648986294 1120323705 /nfs/dbraw/zinc/32/37/05/1120323705.db2.gz RDJMJOSWQRBZJA-INIZCTEOSA-N 1 1 331.529 3.814 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@@H]1c1ccccc1)[C@H](O)CO2 ZINC000762468916 1121314185 /nfs/dbraw/zinc/31/41/85/1121314185.db2.gz XUCCYGLFTPTCEY-IEBWSBKVSA-N 1 1 325.408 3.545 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1c(F)cccc1F ZINC000324453703 1121897279 /nfs/dbraw/zinc/89/72/79/1121897279.db2.gz HGXPBKPKNAJEAV-AWEZNQCLSA-N 1 1 332.394 3.652 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)c2c(F)cccc2F)cc1 ZINC000917020453 1122441397 /nfs/dbraw/zinc/44/13/97/1122441397.db2.gz NNZHQTULYFZRIT-LJQANCHMSA-N 1 1 348.437 3.976 20 10 EHCDMO 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CN(C)c1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000771935386 1133616464 /nfs/dbraw/zinc/61/64/64/1133616464.db2.gz QXJWPLRASZJMTH-UHFFFAOYSA-N 1 1 344.528 3.831 20 10 EHCDMO Cc1ncc(C[N@H+](C)Cc2ccc(N(C)C)cc2)n1-c1ccccc1 ZINC000771935128 1133616921 /nfs/dbraw/zinc/61/69/21/1133616921.db2.gz JAPBITVZOLRQQJ-UHFFFAOYSA-N 1 1 334.467 3.879 20 10 EHCDMO C[C@@H]([NH2+]CCOCC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774147103 1133622857 /nfs/dbraw/zinc/62/28/57/1133622857.db2.gz KIUNJFWOOFQJEC-SSDOTTSWSA-N 1 1 332.149 3.929 20 10 EHCDMO C[C@H]([NH2+]CCNC(=O)OC(C)(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774153611 1133623955 /nfs/dbraw/zinc/62/39/55/1133623955.db2.gz AUANFPXKYSHXRM-VIFPVBQESA-N 1 1 349.258 3.874 20 10 EHCDMO C[C@H]([NH2+]CCCNc1ncccn1)c1cc(Cl)c(Cl)cc1O ZINC000774219553 1133641167 /nfs/dbraw/zinc/64/11/67/1133641167.db2.gz RSVLTGYTAUDVMN-JTQLQIEISA-N 1 1 341.242 3.642 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CC(=O)N(C(C)(C)C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774258308 1133647514 /nfs/dbraw/zinc/64/75/14/1133647514.db2.gz MXKRGRHOAPPQIU-NXEZZACHSA-N 1 1 345.270 3.749 20 10 EHCDMO C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cc(Cl)cc(F)c1[O-] ZINC001183509963 1133820128 /nfs/dbraw/zinc/82/01/28/1133820128.db2.gz BGWIPONJWJIWLF-UHFFFAOYSA-N 1 1 328.859 3.883 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCOCC4(CCCC4)C3)c2c1 ZINC000774655506 1133834875 /nfs/dbraw/zinc/83/48/75/1133834875.db2.gz LPIUMOHWZLSDJX-UHFFFAOYSA-N 1 1 341.451 3.947 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOCC3(CCCC3)C2)c1 ZINC000774659271 1133838561 /nfs/dbraw/zinc/83/85/61/1133838561.db2.gz SAATUZHAFJLVST-UHFFFAOYSA-N 1 1 333.472 3.788 20 10 EHCDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc(OC)ccc1O ZINC000787333293 1133990775 /nfs/dbraw/zinc/99/07/75/1133990775.db2.gz UEALREKZCOFJIF-KRWDZBQOSA-N 1 1 335.831 3.874 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](CCOC)Cc2scnc2C)cc1 ZINC000787308026 1133993996 /nfs/dbraw/zinc/99/39/96/1133993996.db2.gz CIUTVCXZEWSHSZ-UHFFFAOYSA-N 1 1 347.528 3.946 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775005776 1134198047 /nfs/dbraw/zinc/19/80/47/1134198047.db2.gz VIQLHLYBIWKVPQ-ZDUSSCGKSA-N 1 1 344.411 3.765 20 10 EHCDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775070044 1134283972 /nfs/dbraw/zinc/28/39/72/1134283972.db2.gz HDJPQOUKMSAVSO-INIZCTEOSA-N 1 1 342.395 3.646 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc(N2CCCCC2)nc1 ZINC000790948754 1134483824 /nfs/dbraw/zinc/48/38/24/1134483824.db2.gz IBYWIANQIFOMRS-UHFFFAOYSA-N 1 1 349.837 3.860 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc2c(c1)CCC(=O)N2 ZINC000790949540 1134484114 /nfs/dbraw/zinc/48/41/14/1134484114.db2.gz UQURIVMAXLKQLE-SNVBAGLBSA-N 1 1 348.805 3.920 20 10 EHCDMO COc1ccccc1OCCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790960597 1134485560 /nfs/dbraw/zinc/48/55/60/1134485560.db2.gz XIFHZFOTUBGZBT-UHFFFAOYSA-N 1 1 339.794 3.752 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc([S@](C)=O)cc1 ZINC000790982876 1134496247 /nfs/dbraw/zinc/49/62/47/1134496247.db2.gz LFVFKKIFBIEJDT-MGUXCZDKSA-N 1 1 341.835 3.773 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCSCC[C@H]2C)c1 ZINC000792195068 1134667225 /nfs/dbraw/zinc/66/72/25/1134667225.db2.gz CGBRMCPYSFUVJN-LLVKDONJSA-N 1 1 330.291 3.791 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCSCC[C@H]2C)c1 ZINC000792195068 1134667223 /nfs/dbraw/zinc/66/72/23/1134667223.db2.gz CGBRMCPYSFUVJN-LLVKDONJSA-N 1 1 330.291 3.791 20 10 EHCDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000793092400 1134850227 /nfs/dbraw/zinc/85/02/27/1134850227.db2.gz KPLCFMOAKZRWIY-QGZVFWFLSA-N 1 1 344.421 3.756 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1 ZINC000793340546 1134901971 /nfs/dbraw/zinc/90/19/71/1134901971.db2.gz QJBPCWAIZGDZNN-MRXNPFEDSA-N 1 1 342.277 3.854 20 10 EHCDMO CC1(C)CCC[C@H](C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)O1 ZINC001192014981 1134956897 /nfs/dbraw/zinc/95/68/97/1134956897.db2.gz XUKUOTIOYNTUQH-ZWKOTPCHSA-N 1 1 333.472 3.721 20 10 EHCDMO C[C@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc(F)cc1O ZINC000775562955 1135098713 /nfs/dbraw/zinc/09/87/13/1135098713.db2.gz OOOAGBRFDRZJJA-JTQLQIEISA-N 1 1 333.794 3.922 20 10 EHCDMO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647450 1135390559 /nfs/dbraw/zinc/39/05/59/1135390559.db2.gz WEEVZRIMKLFFBX-INIZCTEOSA-N 1 1 341.524 3.619 20 10 EHCDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647450 1135390565 /nfs/dbraw/zinc/39/05/65/1135390565.db2.gz WEEVZRIMKLFFBX-INIZCTEOSA-N 1 1 341.524 3.619 20 10 EHCDMO C[C@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000806172534 1135398296 /nfs/dbraw/zinc/39/82/96/1135398296.db2.gz NSLORTDUAYKCSX-YWZLYKJASA-N 1 1 329.463 3.845 20 10 EHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@H](C)Cc1ccc(OC)cc1 ZINC000775649964 1135416953 /nfs/dbraw/zinc/41/69/53/1135416953.db2.gz VNQIQHLUQQOXFT-OAHLLOKOSA-N 1 1 329.440 3.863 20 10 EHCDMO C[C@H](O)c1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000809574739 1135853100 /nfs/dbraw/zinc/85/31/00/1135853100.db2.gz SQBUVDVSKNUKRQ-ZDUSSCGKSA-N 1 1 332.469 3.847 20 10 EHCDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)Cc1cccc(C)c1O ZINC000809736411 1135874167 /nfs/dbraw/zinc/87/41/67/1135874167.db2.gz TWOHHVAHSDIDQT-FQEVSTJZSA-N 1 1 339.483 3.582 20 10 EHCDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000809767386 1135879664 /nfs/dbraw/zinc/87/96/64/1135879664.db2.gz JQQSMZPROFLMJX-LJQANCHMSA-N 1 1 343.467 3.810 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000809758528 1135887536 /nfs/dbraw/zinc/88/75/36/1135887536.db2.gz PHJHLLVTOWBWSZ-QWHCGFSZSA-N 1 1 327.827 3.823 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000809758528 1135887539 /nfs/dbraw/zinc/88/75/39/1135887539.db2.gz PHJHLLVTOWBWSZ-QWHCGFSZSA-N 1 1 327.827 3.823 20 10 EHCDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000809765508 1135888771 /nfs/dbraw/zinc/88/87/71/1135888771.db2.gz NHERAFWQBXMSTO-SUMWQHHRSA-N 1 1 343.437 3.543 20 10 EHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000809766385 1135888877 /nfs/dbraw/zinc/88/88/77/1135888877.db2.gz XIHHGESIRJPBOR-IBGZPJMESA-N 1 1 343.446 3.640 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1OC ZINC000776012897 1135917588 /nfs/dbraw/zinc/91/75/88/1135917588.db2.gz KLYHYEGZIJUGGP-ZYHUDNBSSA-N 1 1 333.350 3.572 20 10 EHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000776012574 1135919894 /nfs/dbraw/zinc/91/98/94/1135919894.db2.gz HQUDLTAWDZENQT-YOEHRIQHSA-N 1 1 342.405 3.686 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1O ZINC000810211078 1135943365 /nfs/dbraw/zinc/94/33/65/1135943365.db2.gz LNUYZAFSEBHCPJ-IUODEOHRSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211078 1135943368 /nfs/dbraw/zinc/94/33/68/1135943368.db2.gz LNUYZAFSEBHCPJ-IUODEOHRSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211078 1135943370 /nfs/dbraw/zinc/94/33/70/1135943370.db2.gz LNUYZAFSEBHCPJ-IUODEOHRSA-N 1 1 330.394 3.794 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)c1O ZINC000811519675 1136098431 /nfs/dbraw/zinc/09/84/31/1136098431.db2.gz BOENMKFZSJHZGK-AWEZNQCLSA-N 1 1 326.227 3.651 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC(C)(C)[C@H]3[C@@H]3CCCO3)c2c1 ZINC000811777886 1136134157 /nfs/dbraw/zinc/13/41/57/1136134157.db2.gz KPEBBMCFJBQBQW-VQTJNVASSA-N 1 1 341.451 3.943 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1O ZINC000811778250 1136134284 /nfs/dbraw/zinc/13/42/84/1136134284.db2.gz JFNAQOFFFHDTEM-LBPRGKRZSA-N 1 1 349.377 3.809 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1O ZINC000811781464 1136134793 /nfs/dbraw/zinc/13/47/93/1136134793.db2.gz BLHQCRZTFRNSEZ-OAQYLSRUSA-N 1 1 339.435 3.679 20 10 EHCDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3cc(C)cc(C(C)(C)C)c3O)C2)c1 ZINC000811800581 1136138204 /nfs/dbraw/zinc/13/82/04/1136138204.db2.gz AIZCHVAGQMBORH-QGZVFWFLSA-N 1 1 327.472 3.950 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000812776169 1136245932 /nfs/dbraw/zinc/24/59/32/1136245932.db2.gz JDZXSQJUDRKJQR-KRWDZBQOSA-N 1 1 347.459 3.584 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)ccc1N(C)C ZINC000852522309 1136462365 /nfs/dbraw/zinc/46/23/65/1136462365.db2.gz ICHGOPMKGPCIIU-LEWJYISDSA-N 1 1 338.495 3.659 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743913 1136482497 /nfs/dbraw/zinc/48/24/97/1136482497.db2.gz OAQFHZGTCNNCNF-ZFWWWQNUSA-N 1 1 330.394 3.603 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743913 1136482498 /nfs/dbraw/zinc/48/24/98/1136482498.db2.gz OAQFHZGTCNNCNF-ZFWWWQNUSA-N 1 1 330.394 3.603 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1N(C)C ZINC000815012398 1136537800 /nfs/dbraw/zinc/53/78/00/1136537800.db2.gz CYUCNVYRUAMKFW-KRWDZBQOSA-N 1 1 349.482 3.835 20 10 EHCDMO COc1ccc(N2CC[C@@H](Nc3[nH+]ccc4c(N)cccc43)C2)cc1 ZINC000853760152 1136561122 /nfs/dbraw/zinc/56/11/22/1136561122.db2.gz IROMETDHKPMRFE-CQSZACIVSA-N 1 1 334.423 3.516 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@](O)(c3ccc(F)cc3)C1)CCCC2 ZINC000776766048 1136655415 /nfs/dbraw/zinc/65/54/15/1136655415.db2.gz PFCDPSLUIXEHMB-OAQYLSRUSA-N 1 1 341.426 3.504 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2conc2Cc2ccccc2)cc1 ZINC000816477687 1136723101 /nfs/dbraw/zinc/72/31/01/1136723101.db2.gz HCHLSRVBTJGHEF-UHFFFAOYSA-N 1 1 335.451 3.963 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2conc2Cc2ccccc2)cc1 ZINC000816477687 1136723105 /nfs/dbraw/zinc/72/31/05/1136723105.db2.gz HCHLSRVBTJGHEF-UHFFFAOYSA-N 1 1 335.451 3.963 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000816513931 1136729162 /nfs/dbraw/zinc/72/91/62/1136729162.db2.gz HRDWAMUZELXKHX-AWEZNQCLSA-N 1 1 326.843 3.635 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@H](C(F)(F)F)O1 ZINC000816515793 1136729992 /nfs/dbraw/zinc/72/99/92/1136729992.db2.gz KZDSWEDSASHTOF-XHDPSFHLSA-N 1 1 325.330 3.697 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C[C@H](C(F)(F)F)O1 ZINC000816515793 1136729993 /nfs/dbraw/zinc/72/99/93/1136729993.db2.gz KZDSWEDSASHTOF-XHDPSFHLSA-N 1 1 325.330 3.697 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(F)cc1 ZINC000816536479 1136731427 /nfs/dbraw/zinc/73/14/27/1136731427.db2.gz YPZDOZLZVYVFCF-MRXNPFEDSA-N 1 1 340.801 3.716 20 10 EHCDMO Cc1cccc2oc(CC[NH2+]Cc3cc(Cl)c(F)cc3O)nc21 ZINC000816554243 1136736009 /nfs/dbraw/zinc/73/60/09/1136736009.db2.gz SMEFSBWQBMJVDK-UHFFFAOYSA-N 1 1 334.778 3.967 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC1([C@@H](O)c2ccccc2)CC1 ZINC000816558373 1136736630 /nfs/dbraw/zinc/73/66/30/1136736630.db2.gz WCCQMWHOWBEIBL-KRWDZBQOSA-N 1 1 335.806 3.788 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(-n2ccnn2)cc1 ZINC000816559370 1136736766 /nfs/dbraw/zinc/73/67/66/1136736766.db2.gz HURQKESEDHTKIM-LLVKDONJSA-N 1 1 346.793 3.616 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1cccs1 ZINC000816561229 1136736852 /nfs/dbraw/zinc/73/68/52/1136736852.db2.gz PSCLNKBPHGUOBY-ZDUSSCGKSA-N 1 1 328.840 3.639 20 10 EHCDMO OCC[N@H+](Cc1ccc2ccccc2c1O)Cc1cccnc1Cl ZINC000816597001 1136739851 /nfs/dbraw/zinc/73/98/51/1136739851.db2.gz ZXAPLRRYHOLVPP-UHFFFAOYSA-N 1 1 342.826 3.588 20 10 EHCDMO OCC[N@@H+](Cc1ccc2ccccc2c1O)Cc1cccnc1Cl ZINC000816597001 1136739852 /nfs/dbraw/zinc/73/98/52/1136739852.db2.gz ZXAPLRRYHOLVPP-UHFFFAOYSA-N 1 1 342.826 3.588 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1cc(F)c(F)c(F)c1 ZINC000817938112 1136847590 /nfs/dbraw/zinc/84/75/90/1136847590.db2.gz DUPQJZCQCSOLFR-APPDUMDISA-N 1 1 337.389 3.521 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000817943538 1136849282 /nfs/dbraw/zinc/84/92/82/1136849282.db2.gz VEGANQWJEVKXPV-ZWKOTPCHSA-N 1 1 327.472 3.649 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Br)ccc1[O-] ZINC000817949874 1136850685 /nfs/dbraw/zinc/85/06/85/1136850685.db2.gz SUQMBFQHVTYTKN-GFCCVEGCSA-N 1 1 349.272 3.507 20 10 EHCDMO CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966464 1136853352 /nfs/dbraw/zinc/85/33/52/1136853352.db2.gz OJPBQIHOUUUDBW-HOCLYGCPSA-N 1 1 330.394 3.841 20 10 EHCDMO CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000817985083 1136855387 /nfs/dbraw/zinc/85/53/87/1136855387.db2.gz GRRBYLSLKZAIDM-OAHLLOKOSA-N 1 1 339.277 3.505 20 10 EHCDMO CCn1nc(C)c(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)n1 ZINC000818220976 1136867354 /nfs/dbraw/zinc/86/73/54/1136867354.db2.gz LMIGBZSMPBPMDJ-UHFFFAOYSA-N 1 1 337.471 3.612 20 10 EHCDMO CCC(C)(C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000857758602 1136905718 /nfs/dbraw/zinc/90/57/18/1136905718.db2.gz MRAFXEHBARXWPO-QGZVFWFLSA-N 1 1 345.531 3.802 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cn(C(C)(C)C)nn2)c(C)n1-c1ccccc1 ZINC000858292711 1136955317 /nfs/dbraw/zinc/95/53/17/1136955317.db2.gz DKJYSNPNEAOKKF-UHFFFAOYSA-N 1 1 337.471 3.730 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@@H]1C1CCOCC1)CCC2 ZINC000819905355 1136966060 /nfs/dbraw/zinc/96/60/60/1136966060.db2.gz ZJMBPBUBUVCEBD-FQEVSTJZSA-N 1 1 327.468 3.662 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)c1ncc(Br)cn1)c1ccccc1O ZINC000805749037 1136994837 /nfs/dbraw/zinc/99/48/37/1136994837.db2.gz UMNQMQJYAHNWBK-GXFFZTMASA-N 1 1 336.233 3.747 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F)c1nccs1 ZINC000862322507 1137138060 /nfs/dbraw/zinc/13/80/60/1137138060.db2.gz MJRHUKCBJPPPOA-NSHDSACASA-N 1 1 325.428 3.723 20 10 EHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Br)[C@H]1[C@H]1CCCO1 ZINC000862371903 1137140991 /nfs/dbraw/zinc/14/09/91/1137140991.db2.gz NSHMPTKDVDKKNU-CABCVRRESA-N 1 1 340.261 3.544 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c1O ZINC000862481999 1137146380 /nfs/dbraw/zinc/14/63/80/1137146380.db2.gz CHRYJPYUFBBYKE-IBGZPJMESA-N 1 1 347.842 3.538 20 10 EHCDMO CS[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000824683619 1137148175 /nfs/dbraw/zinc/14/81/75/1137148175.db2.gz SMTLACLMVWXBPB-SFHVURJKSA-N 1 1 329.465 3.909 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCO[C@@H](CCF)C1 ZINC000862529400 1137148337 /nfs/dbraw/zinc/14/83/37/1137148337.db2.gz DFBRZJWACKRBAS-IBGZPJMESA-N 1 1 345.414 3.532 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@@H](CCF)C1 ZINC000862529400 1137148338 /nfs/dbraw/zinc/14/83/38/1137148338.db2.gz DFBRZJWACKRBAS-IBGZPJMESA-N 1 1 345.414 3.532 20 10 EHCDMO Cc1ncsc1C[N@H+](C)Cc1ccc(Br)cc1O ZINC000824710216 1137149691 /nfs/dbraw/zinc/14/96/91/1137149691.db2.gz UWZZLIDFDRNBTL-UHFFFAOYSA-N 1 1 327.247 3.552 20 10 EHCDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000825005570 1137159944 /nfs/dbraw/zinc/15/99/44/1137159944.db2.gz PLAJWUKJTXMVFP-LLVKDONJSA-N 1 1 338.249 3.530 20 10 EHCDMO CCn1cc([C@@H](C)[NH2+]Cc2cc(C)cc(Br)c2O)cn1 ZINC000825130229 1137167022 /nfs/dbraw/zinc/16/70/22/1137167022.db2.gz QBNDJJWPQCFAIF-LLVKDONJSA-N 1 1 338.249 3.530 20 10 EHCDMO CCc1cc(C[N@H+]2C[C@@H](C)O[C@@]3(CCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794702894 1137236179 /nfs/dbraw/zinc/23/61/79/1137236179.db2.gz KPCMZYXFKOSXTP-VFNWGFHPSA-N 1 1 347.499 3.632 20 10 EHCDMO CCc1cc(C[N@H+]2C[C@@H](C)O[C@]3(CCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794702893 1137236285 /nfs/dbraw/zinc/23/62/85/1137236285.db2.gz KPCMZYXFKOSXTP-QVKFZJNVSA-N 1 1 347.499 3.632 20 10 EHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)c1cccc(OC)c1 ZINC000120162666 1137239492 /nfs/dbraw/zinc/23/94/92/1137239492.db2.gz LIHVDBKYCSMZGV-CYBMUJFWSA-N 1 1 329.396 3.713 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000844760672 1137250135 /nfs/dbraw/zinc/25/01/35/1137250135.db2.gz RRBJOEHYVZANMI-QGZVFWFLSA-N 1 1 325.399 3.929 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2CNc3ccccc3C2)c1 ZINC000844908128 1137264495 /nfs/dbraw/zinc/26/44/95/1137264495.db2.gz RDJDHXGWGOIRQW-CQSZACIVSA-N 1 1 347.256 3.590 20 10 EHCDMO COc1cccc([C@H]2CCCC[N@H+]2Cc2c(O)cc(O)cc2O)c1 ZINC001144508839 1137303456 /nfs/dbraw/zinc/30/34/56/1137303456.db2.gz AAWLODOVVOHHCZ-QGZVFWFLSA-N 1 1 329.396 3.539 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nn(C)cc2C(F)F)cc1F ZINC000865808342 1137313577 /nfs/dbraw/zinc/31/35/77/1137313577.db2.gz IGKZPWMPMLAPCX-UHFFFAOYSA-N 1 1 340.393 3.633 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc2cnccc2o1)C[C@@H]1CCCO1 ZINC000845903665 1137319204 /nfs/dbraw/zinc/31/92/04/1137319204.db2.gz RIIWQGAWKCBUGY-KRWDZBQOSA-N 1 1 338.407 3.715 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC000866482226 1137358357 /nfs/dbraw/zinc/35/83/57/1137358357.db2.gz VSLHDSRHXSQFQC-KSSFIOAISA-N 1 1 347.455 3.569 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CCc3c(F)cc(F)cc3C1)CCC2 ZINC001171387473 1137467306 /nfs/dbraw/zinc/46/73/06/1137467306.db2.gz HRIOPUHZFIZIEW-MRXNPFEDSA-N 1 1 345.389 3.682 20 10 EHCDMO Cc1cc(N2CCOCC2)[nH+]cc1NCc1cc2ccccc2cc1O ZINC001171404685 1137472649 /nfs/dbraw/zinc/47/26/49/1137472649.db2.gz ISDVAMVIAJGPKY-UHFFFAOYSA-N 1 1 349.434 3.698 20 10 EHCDMO C[C@@H]([NH2+]Cc1ncc(Br)s1)c1cc(F)ccc1O ZINC000714933396 1137474337 /nfs/dbraw/zinc/47/43/37/1137474337.db2.gz PASMEHCPSYENFX-SSDOTTSWSA-N 1 1 331.210 3.601 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)ccc1N1CCCCC1 ZINC001171841094 1137515555 /nfs/dbraw/zinc/51/55/55/1137515555.db2.gz JVRVFHHACGCZIP-OYRHEFFESA-N 1 1 328.500 3.844 20 10 EHCDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 ZINC000871200598 1137526583 /nfs/dbraw/zinc/52/65/83/1137526583.db2.gz HNXULOGKZXMISE-UHFFFAOYSA-N 1 1 338.451 3.780 20 10 EHCDMO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000872135631 1137573575 /nfs/dbraw/zinc/57/35/75/1137573575.db2.gz XNADQJLFWCOXBQ-KOLCDFICSA-N 1 1 325.334 3.921 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000873270091 1137595891 /nfs/dbraw/zinc/59/58/91/1137595891.db2.gz WYTGIXHTEKLPIA-ABAIWWIYSA-N 1 1 341.293 3.584 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccc(F)c(F)c1 ZINC000876573148 1137655891 /nfs/dbraw/zinc/65/58/91/1137655891.db2.gz NWXNIXRLXAAJRG-UHFFFAOYSA-N 1 1 346.421 3.558 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)n1 ZINC000877473002 1137677415 /nfs/dbraw/zinc/67/74/15/1137677415.db2.gz CVFBPKATVYUCKF-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@H+]2Cc2ccc(C)cc2O)n1 ZINC000877473002 1137677416 /nfs/dbraw/zinc/67/74/16/1137677416.db2.gz CVFBPKATVYUCKF-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2cc(Cl)cc(OC)c2O)c1C ZINC000877664396 1137684804 /nfs/dbraw/zinc/68/48/04/1137684804.db2.gz QBVNSOBUUQOIQY-UHFFFAOYSA-N 1 1 337.851 3.519 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1noc2c1CC(C)(C)CC2 ZINC000877810419 1137690845 /nfs/dbraw/zinc/69/08/45/1137690845.db2.gz UTFBCWDHGGBZHV-UHFFFAOYSA-N 1 1 327.472 3.854 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000127755685 1137747663 /nfs/dbraw/zinc/74/76/63/1137747663.db2.gz YUAILSQYTPJKLK-CVEARBPZSA-N 1 1 345.512 3.710 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000882939316 1137839039 /nfs/dbraw/zinc/83/90/39/1137839039.db2.gz WABZCPKUKYDBKL-IAGOWNOFSA-N 1 1 337.341 3.819 20 10 EHCDMO COC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)cc1 ZINC000883105585 1137844670 /nfs/dbraw/zinc/84/46/70/1137844670.db2.gz PBSRCSCPHQWQNG-HNNXBMFYSA-N 1 1 327.758 3.801 20 10 EHCDMO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Br)cc1O ZINC000883312062 1137854189 /nfs/dbraw/zinc/85/41/89/1137854189.db2.gz SJBSMPFGVSHMQK-LLVKDONJSA-N 1 1 348.244 3.675 20 10 EHCDMO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000883328946 1137855227 /nfs/dbraw/zinc/85/52/27/1137855227.db2.gz AIIZSWMBMAMSFC-HNNXBMFYSA-N 1 1 335.350 3.683 20 10 EHCDMO c1coc([C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)c2ccccc2)c1 ZINC000066236388 1138074402 /nfs/dbraw/zinc/07/44/02/1138074402.db2.gz FUSDTOOBLGEAFR-JOCHJYFZSA-N 1 1 348.446 3.995 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1c(O)cccc1F ZINC000886495039 1138083393 /nfs/dbraw/zinc/08/33/93/1138083393.db2.gz GDJMSSRNYXUZEP-CYBMUJFWSA-N 1 1 328.387 3.509 20 10 EHCDMO COc1ccccc1N1CC[C@@H](C[NH2+][C@@H](C)c2c(O)cccc2F)C1 ZINC000886519358 1138088838 /nfs/dbraw/zinc/08/88/38/1138088838.db2.gz TWUUEMOCPMDCQD-GJZGRUSLSA-N 1 1 344.430 3.717 20 10 EHCDMO COc1ccccc1N1CCC([NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886518921 1138088903 /nfs/dbraw/zinc/08/89/03/1138088903.db2.gz JNAQPUNSEJJQER-CQSZACIVSA-N 1 1 344.430 3.860 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@H]2C)O1)c1ccc(F)cc1O ZINC000886768667 1138136578 /nfs/dbraw/zinc/13/65/78/1138136578.db2.gz FYPYAHMUSWZFKR-LONGPJICSA-N 1 1 337.435 3.545 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2cc(Br)cs2)c1O ZINC000091888175 1138222830 /nfs/dbraw/zinc/22/28/30/1138222830.db2.gz YDEYKILZLQVBEP-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2sccc2-n2c(C)ccc2C)C1 ZINC000174490330 1139424249 /nfs/dbraw/zinc/42/42/49/1139424249.db2.gz WOWXNRCLXUHBHE-MRXNPFEDSA-N 1 1 345.512 3.569 20 10 EHCDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183114457 1140014565 /nfs/dbraw/zinc/01/45/65/1140014565.db2.gz KAHOYCSFMSDIHL-GOSISDBHSA-N 1 1 341.451 3.830 20 10 EHCDMO COc1ccc(O)c([C@@H](C)N[C@@H](C[NH+]2CCCC2)c2ccccc2)c1 ZINC000184919674 1140125712 /nfs/dbraw/zinc/12/57/12/1140125712.db2.gz UQOGDCNJDSDTDB-UZLBHIALSA-N 1 1 340.467 3.889 20 10 EHCDMO C[C@H]([NH2+]Cc1ccnc(OCC(F)(F)F)c1)c1ccc(F)cc1O ZINC000185018900 1140132093 /nfs/dbraw/zinc/13/20/93/1140132093.db2.gz QTPBEFPFBJEYGI-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)c1ccc(F)cc1O ZINC000186148429 1140188874 /nfs/dbraw/zinc/18/88/74/1140188874.db2.gz ZHHCLFJHNUTFHN-KDOFPFPSSA-N 1 1 331.431 3.984 20 10 EHCDMO COc1ccc(N(CCn2cc[nH+]c2C)Cc2ccco2)cc1F ZINC000270632004 1141248087 /nfs/dbraw/zinc/24/80/87/1141248087.db2.gz GXHYXIHALKGNPR-UHFFFAOYSA-N 1 1 329.375 3.639 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1O ZINC000271053151 1141301858 /nfs/dbraw/zinc/30/18/58/1141301858.db2.gz XJCMGWBYRIQUKW-UHFFFAOYSA-N 1 1 349.434 3.957 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccc(F)cc1[O-] ZINC000359872334 201113872 /nfs/dbraw/zinc/11/38/72/201113872.db2.gz OSMCEVXXPSLTOJ-UVFQYZLESA-N 1 1 328.431 3.875 20 10 EHCDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000183174180 1125462935 /nfs/dbraw/zinc/46/29/35/1125462935.db2.gz OTOLFCZUQYZEQC-MRXNPFEDSA-N 1 1 328.431 3.855 20 10 EHCDMO COCC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)[C@H]1CCOC1 ZINC000782959958 1016861258 /nfs/dbraw/zinc/86/12/58/1016861258.db2.gz DTPVIBNABQKBQR-HNNXBMFYSA-N 1 1 341.407 3.529 20 10 EHCDMO CCC[C@H](C)NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000683437209 1017078561 /nfs/dbraw/zinc/07/85/61/1017078561.db2.gz HSBSIXXXUMQGPI-INIZCTEOSA-N 1 1 341.499 3.713 20 10 EHCDMO COc1cccc(CNC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1O ZINC000377618637 1018072450 /nfs/dbraw/zinc/07/24/50/1018072450.db2.gz BWUHMKCGCKOJFC-QAPCUYQASA-N 1 1 332.488 3.534 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccc3c(c1)OCO3)CCC2 ZINC000728284554 1018617855 /nfs/dbraw/zinc/61/78/55/1018617855.db2.gz FSCLZKILIQQKNI-GOSISDBHSA-N 1 1 337.419 3.947 20 10 EHCDMO COCC1=CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000280006489 1019963884 /nfs/dbraw/zinc/96/38/84/1019963884.db2.gz UCPYBXXTNLAKFG-UHFFFAOYSA-N 1 1 328.378 3.550 20 10 EHCDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000760400591 1032925301 /nfs/dbraw/zinc/92/53/01/1032925301.db2.gz QFPDNMDVCFYBLW-OAHLLOKOSA-N 1 1 345.483 3.825 20 10 EHCDMO Cn1cc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C2CC2)n1 ZINC000891399324 1020919925 /nfs/dbraw/zinc/91/99/25/1020919925.db2.gz LHCPCTWNFGGWJU-UHFFFAOYSA-N 1 1 338.499 3.920 20 10 EHCDMO CC(C)(C)c1coc(C[NH2+]Cc2cc(Br)ccc2O)n1 ZINC000894432719 1022277098 /nfs/dbraw/zinc/27/70/98/1022277098.db2.gz TZLQOCMVYDUWGO-UHFFFAOYSA-N 1 1 339.233 3.730 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c(O)c1OC ZINC000894568644 1022570282 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CCOCc1cc(CNC[C@H]2CC[N@H+]2C2CCCCC2)ccc1OC ZINC000527753304 1031208581 /nfs/dbraw/zinc/20/85/81/1031208581.db2.gz TZJXCJNMBUJFEN-HXUWFJFHSA-N 1 1 346.515 3.728 20 10 EHCDMO COc1cccc([C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)OC)c1 ZINC000529637807 1034324031 /nfs/dbraw/zinc/32/40/31/1034324031.db2.gz FPKVBMVNLNKINA-KRWDZBQOSA-N 1 1 339.794 3.671 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)CCCOc2ccccc2)c1O ZINC000761192663 1034376807 /nfs/dbraw/zinc/37/68/07/1034376807.db2.gz XUTGUCQRPGHMDS-UHFFFAOYSA-N 1 1 335.831 3.955 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)CCN(C)c2ccccc2)c1O ZINC000761199373 1034388720 /nfs/dbraw/zinc/38/87/20/1034388720.db2.gz MFHKOYKAGOUQFL-UHFFFAOYSA-N 1 1 334.847 3.622 20 10 EHCDMO COc1cccc([C@H]2C[N@@H+](Cc3cc(C)cc(C)c3O)CCO2)c1 ZINC000164521933 1035651643 /nfs/dbraw/zinc/65/16/43/1035651643.db2.gz NMHIGCLREQDTDH-LJQANCHMSA-N 1 1 327.424 3.591 20 10 EHCDMO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3cc(C)cc(C(C)(C)C)c3O)[C@H]2C1 ZINC000165224950 1036339838 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EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1O ZINC000775740354 1135598706 /nfs/dbraw/zinc/59/87/06/1135598706.db2.gz VGXGBWKSPJOHQP-RDTXWAMCSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1O ZINC000775740354 1135598711 /nfs/dbraw/zinc/59/87/11/1135598711.db2.gz VGXGBWKSPJOHQP-RDTXWAMCSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1O ZINC000775740354 1135598714 /nfs/dbraw/zinc/59/87/14/1135598714.db2.gz VGXGBWKSPJOHQP-RDTXWAMCSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1O ZINC000775746161 1135620242 /nfs/dbraw/zinc/62/02/42/1135620242.db2.gz CGYDHGNIGKYOIR-CYBMUJFWSA-N 1 1 346.862 3.729 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1O ZINC000775746161 1135620245 /nfs/dbraw/zinc/62/02/45/1135620245.db2.gz CGYDHGNIGKYOIR-CYBMUJFWSA-N 1 1 346.862 3.729 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1O ZINC000775746161 1135620248 /nfs/dbraw/zinc/62/02/48/1135620248.db2.gz CGYDHGNIGKYOIR-CYBMUJFWSA-N 1 1 346.862 3.729 20 10 EHCDMO C[C@H]([NH2+]Cc1nc2c3ccccc3oc2c(=O)[nH]1)c1ccccc1O ZINC001197005059 1135639335 /nfs/dbraw/zinc/63/93/35/1135639335.db2.gz XLSVZAMUXKMFMB-NSHDSACASA-N 1 1 335.363 3.638 20 10 EHCDMO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)cc1O ZINC000808727131 1135723070 /nfs/dbraw/zinc/72/30/70/1135723070.db2.gz BUUPFHZWBALIKM-NSHDSACASA-N 1 1 343.358 3.814 20 10 EHCDMO Cc1ccccc1-c1noc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000775834556 1135798232 /nfs/dbraw/zinc/79/82/32/1135798232.db2.gz AHUBMYHNAMSEBF-HNNXBMFYSA-N 1 1 336.439 3.962 20 10 EHCDMO Cc1cccc(-c2noc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)n2)c1 ZINC000775834236 1135798487 /nfs/dbraw/zinc/79/84/87/1135798487.db2.gz PYWLJRTVRXMZTD-OAHLLOKOSA-N 1 1 336.439 3.962 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)Cc2ccc(O)cc2)c1 ZINC000809753817 1135886323 /nfs/dbraw/zinc/88/63/23/1135886323.db2.gz RODXSFOYHAHTJP-UHFFFAOYSA-N 1 1 336.229 3.801 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)Cc2ccc(O)cc2)c1 ZINC000809753817 1135886327 /nfs/dbraw/zinc/88/63/27/1135886327.db2.gz RODXSFOYHAHTJP-UHFFFAOYSA-N 1 1 336.229 3.801 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1O ZINC000809758078 1135888155 /nfs/dbraw/zinc/88/81/55/1135888155.db2.gz BSOIEZPSDBGUPZ-UONOGXRCSA-N 1 1 339.863 3.693 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](Sc3ccncc3)C2)cc1 ZINC001203933565 1135899101 /nfs/dbraw/zinc/89/91/01/1135899101.db2.gz ABLBWZPIXWGUSL-IBGZPJMESA-N 1 1 327.497 3.904 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000810209793 1135943312 /nfs/dbraw/zinc/94/33/12/1135943312.db2.gz VVCBOEXVWSOIFM-LRDDRELGSA-N 1 1 342.405 3.936 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810209793 1135943316 /nfs/dbraw/zinc/94/33/16/1135943316.db2.gz VVCBOEXVWSOIFM-LRDDRELGSA-N 1 1 342.405 3.936 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000810841264 1136012908 /nfs/dbraw/zinc/01/29/08/1136012908.db2.gz NKHNDBLTKDPHLJ-JKSUJKDBSA-N 1 1 344.480 3.939 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)c1O ZINC000811512941 1136103364 /nfs/dbraw/zinc/10/33/64/1136103364.db2.gz BDNFNZMASLEILH-HNNXBMFYSA-N 1 1 340.261 3.784 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1F ZINC000811513577 1136103773 /nfs/dbraw/zinc/10/37/73/1136103773.db2.gz WVGMXBCFRXCSDB-SFHVURJKSA-N 1 1 339.458 3.529 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC(C)(C)[C@@H]3[C@@H]3CCCO3)c2c1 ZINC000811777880 1136134298 /nfs/dbraw/zinc/13/42/98/1136134298.db2.gz KPEBBMCFJBQBQW-PMACEKPBSA-N 1 1 341.451 3.943 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CCC[C@H](C)O2)c1 ZINC000850379296 1136245893 /nfs/dbraw/zinc/24/58/93/1136245893.db2.gz KIBMNSMCWPYRHA-AAEUAGOBSA-N 1 1 328.250 3.510 20 10 EHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCC(=O)O1 ZINC000851879305 1136415205 /nfs/dbraw/zinc/41/52/05/1136415205.db2.gz HYMVJSAEMXDCDH-MAUKXSAKSA-N 1 1 325.408 3.661 20 10 EHCDMO C[C@H](NC(=O)[C@@H](c1cccc(Cl)c1)[NH+](C)C)c1ccccc1O ZINC000827978436 1136434205 /nfs/dbraw/zinc/43/42/05/1136434205.db2.gz SYOWGCZEMDWHJE-YVEFUNNKSA-N 1 1 332.831 3.526 20 10 EHCDMO CC(C)[C@H]1CCN(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000853488798 1136536782 /nfs/dbraw/zinc/53/67/82/1136536782.db2.gz SUQWEOZCQCZDMT-HXUWFJFHSA-N 1 1 343.515 3.571 20 10 EHCDMO CC(C)[C@H]1CCN(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000853488798 1136536786 /nfs/dbraw/zinc/53/67/86/1136536786.db2.gz SUQWEOZCQCZDMT-HXUWFJFHSA-N 1 1 343.515 3.571 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccccc2)[C@H](C)CCO)ccc1N(C)C ZINC000815078489 1136548544 /nfs/dbraw/zinc/54/85/44/1136548544.db2.gz ACDRCPRJMWNMDB-GOSISDBHSA-N 1 1 326.484 3.834 20 10 EHCDMO COCC1(CC[NH2+]Cc2cc(C)cc(Br)c2O)CCC1 ZINC000815147935 1136562982 /nfs/dbraw/zinc/56/29/82/1136562982.db2.gz HXXBKPIKHRLBEM-UHFFFAOYSA-N 1 1 342.277 3.760 20 10 EHCDMO Cc1ccc([C@@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC000854225165 1136599530 /nfs/dbraw/zinc/59/95/30/1136599530.db2.gz XEFPJPMWSJZZAK-NIKGAXFTSA-N 1 1 328.431 3.636 20 10 EHCDMO C[N@@H+](Cc1ccc2ccccc2c1O)Cc1nc2ccccc2c(=O)[nH]1 ZINC000816481309 1136722674 /nfs/dbraw/zinc/72/26/74/1136722674.db2.gz PYAFDYNGSRIINF-UHFFFAOYSA-N 1 1 345.402 3.826 20 10 EHCDMO C[N@H+](Cc1ccc2ccccc2c1O)Cc1nc2ccccc2c(=O)[nH]1 ZINC000816481309 1136722676 /nfs/dbraw/zinc/72/26/76/1136722676.db2.gz PYAFDYNGSRIINF-UHFFFAOYSA-N 1 1 345.402 3.826 20 10 EHCDMO C[C@H](CNC(=O)OC(C)(C)C)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816509599 1136728827 /nfs/dbraw/zinc/72/88/27/1136728827.db2.gz WHJCEVPNKUYMNY-SNVBAGLBSA-N 1 1 346.830 3.530 20 10 EHCDMO C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816509599 1136728828 /nfs/dbraw/zinc/72/88/28/1136728828.db2.gz WHJCEVPNKUYMNY-SNVBAGLBSA-N 1 1 346.830 3.530 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1ccn(-c2ccccc2)n1 ZINC000816544311 1136731863 /nfs/dbraw/zinc/73/18/63/1136731863.db2.gz DFPOFZJCTYBOQL-UHFFFAOYSA-N 1 1 345.805 3.703 20 10 EHCDMO CCN(CC)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccco1 ZINC000816543711 1136731928 /nfs/dbraw/zinc/73/19/28/1136731928.db2.gz LFFCNKYFHZYWKT-OAHLLOKOSA-N 1 1 340.826 3.950 20 10 EHCDMO Oc1c(C[N@@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc2ccccc21 ZINC000816592383 1136735519 /nfs/dbraw/zinc/73/55/19/1136735519.db2.gz IILAFPLJMWYKOY-RHSMWYFYSA-N 1 1 339.357 3.681 20 10 EHCDMO CC1([C@H]2CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)OCCO1 ZINC000816568235 1136738318 /nfs/dbraw/zinc/73/83/18/1136738318.db2.gz AZWBSJGUGKYTHC-KRWDZBQOSA-N 1 1 327.424 3.520 20 10 EHCDMO COCC[C@@H](Cc1ccco1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816567591 1136738377 /nfs/dbraw/zinc/73/83/77/1136738377.db2.gz GMRVNMGLCXKCDI-LBPRGKRZSA-N 1 1 327.783 3.515 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)c(C(F)(F)F)c1 ZINC000816630392 1136739191 /nfs/dbraw/zinc/73/91/91/1136739191.db2.gz CKVJDVXDQSDBPS-INIZCTEOSA-N 1 1 342.405 3.651 20 10 EHCDMO C[NH+](C)CCN(Cc1cccs1)Cc1cc(Cl)c(F)cc1O ZINC000816611844 1136740838 /nfs/dbraw/zinc/74/08/38/1136740838.db2.gz YOKYHWXLUXQKDI-UHFFFAOYSA-N 1 1 342.867 3.810 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000816614846 1136741881 /nfs/dbraw/zinc/74/18/81/1136741881.db2.gz HDMRVQKHTVLZRB-HNNXBMFYSA-N 1 1 346.833 3.822 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000816614846 1136741885 /nfs/dbraw/zinc/74/18/85/1136741885.db2.gz HDMRVQKHTVLZRB-HNNXBMFYSA-N 1 1 346.833 3.822 20 10 EHCDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000816661873 1136746564 /nfs/dbraw/zinc/74/65/64/1136746564.db2.gz AUJQYQCATGCHNP-OAQYLSRUSA-N 1 1 330.516 3.907 20 10 EHCDMO O[C@H]1CCC[N@@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC000816667641 1136746826 /nfs/dbraw/zinc/74/68/26/1136746826.db2.gz SORKRUMMVBNHNF-NRFANRHFSA-N 1 1 336.479 3.596 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000816666319 1136746922 /nfs/dbraw/zinc/74/69/22/1136746922.db2.gz KGFAZMIHUHQQMS-RTWAWAEBSA-N 1 1 326.484 3.820 20 10 EHCDMO Oc1ccc(Br)cc1C[N@@H+]1CCOC[C@H]1CC1CCC1 ZINC000816667551 1136747040 /nfs/dbraw/zinc/74/70/40/1136747040.db2.gz POQZTBCOFHQOEF-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCOC[C@H]1CC1CCC1 ZINC000816667551 1136747045 /nfs/dbraw/zinc/74/70/45/1136747045.db2.gz POQZTBCOFHQOEF-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO CCOc1cccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817944123 1136849231 /nfs/dbraw/zinc/84/92/31/1136849231.db2.gz XJKJANUVRSPCLX-YWZLYKJASA-N 1 1 327.472 3.502 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C(=O)OC)s2)cc1 ZINC000818357694 1136875512 /nfs/dbraw/zinc/87/55/12/1136875512.db2.gz HWIRLOSUYVELHZ-CHWSQXEVSA-N 1 1 347.484 3.798 20 10 EHCDMO Fc1cc(CNc2[nH+]ccc3ccccc32)ccc1N1CCOCC1 ZINC000858355630 1136961259 /nfs/dbraw/zinc/96/12/59/1136961259.db2.gz RDEIXNDEMUWVSQ-UHFFFAOYSA-N 1 1 337.398 3.823 20 10 EHCDMO Cc1cc(O)c(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1Cl ZINC000825554979 1137015624 /nfs/dbraw/zinc/01/56/24/1137015624.db2.gz BOFRELDLAFOSRA-UHFFFAOYSA-N 1 1 338.835 3.947 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)ccc1N1CCCCC1 ZINC000859925453 1137036926 /nfs/dbraw/zinc/03/69/26/1137036926.db2.gz JXIRYXADCIINQE-PZJWPPBQSA-N 1 1 328.500 3.580 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C)cc1C(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC001136598032 1137064998 /nfs/dbraw/zinc/06/49/98/1137064998.db2.gz QPROJLKVNLHMDU-KRWDZBQOSA-N 1 1 339.483 3.615 20 10 EHCDMO Oc1ccccc1C[N@@H+](CC[C@H]1CC1(Cl)Cl)C[C@@H]1CCCO1 ZINC000822739726 1137072630 /nfs/dbraw/zinc/07/26/30/1137072630.db2.gz HFJMZTGZJCRSRF-GJZGRUSLSA-N 1 1 344.282 3.957 20 10 EHCDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)c1 ZINC000117864436 1137085447 /nfs/dbraw/zinc/08/54/47/1137085447.db2.gz FPPPNFXJOYVZHA-KRWDZBQOSA-N 1 1 340.423 3.524 20 10 EHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)ccc1N(C)C ZINC000823661420 1137108754 /nfs/dbraw/zinc/10/87/54/1137108754.db2.gz YFCAEURRBJJCHK-FQEVSTJZSA-N 1 1 328.500 3.842 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCC2CCOCC2)c1 ZINC000824477300 1137139057 /nfs/dbraw/zinc/13/90/57/1137139057.db2.gz PBOIVSQCVSVRQR-UHFFFAOYSA-N 1 1 342.277 3.760 20 10 EHCDMO CC[N@@H+](Cc1cc(F)c(N(C)C)cc1F)[C@@H]1CCOC(C)(C)C1 ZINC000862370685 1137140999 /nfs/dbraw/zinc/14/09/99/1137140999.db2.gz QDMBJVRBQRSNMC-CQSZACIVSA-N 1 1 326.431 3.810 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000824522622 1137141323 /nfs/dbraw/zinc/14/13/23/1137141323.db2.gz YZIGTUGVEXTRRC-UHFFFAOYSA-N 1 1 327.827 3.702 20 10 EHCDMO C[C@@H]1CC2(C[N@H+]1Cc1c(O)cccc1Br)CCOCC2 ZINC000862400212 1137142732 /nfs/dbraw/zinc/14/27/32/1137142732.db2.gz PYFSHVNKQCMGCM-GFCCVEGCSA-N 1 1 340.261 3.546 20 10 EHCDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)ccc1F ZINC000824548360 1137144131 /nfs/dbraw/zinc/14/41/31/1137144131.db2.gz GXRAOSXUZARUKG-QGZVFWFLSA-N 1 1 341.474 3.737 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@]3(CC(=O)c4ccccc4O3)C2)c1 ZINC000862482888 1137146177 /nfs/dbraw/zinc/14/61/77/1137146177.db2.gz YVUKPMFMSVCGOD-NRFANRHFSA-N 1 1 337.419 3.701 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215577 1137169071 /nfs/dbraw/zinc/16/90/71/1137169071.db2.gz RCDHCABHQPANCG-OAHLLOKOSA-N 1 1 342.302 3.874 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215577 1137169073 /nfs/dbraw/zinc/16/90/73/1137169073.db2.gz RCDHCABHQPANCG-OAHLLOKOSA-N 1 1 342.302 3.874 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)ccc1[N+](=O)[O-] ZINC000825300203 1137172060 /nfs/dbraw/zinc/17/20/60/1137172060.db2.gz XPMCFURKAKXCRG-UHFFFAOYSA-N 1 1 330.384 3.558 20 10 EHCDMO COc1cc(C[N@@H+](C)CCc2ccncc2)c(O)c(C(C)(C)C)c1 ZINC000825500764 1137179884 /nfs/dbraw/zinc/17/98/84/1137179884.db2.gz HPFBNUKJSBRNRN-UHFFFAOYSA-N 1 1 328.456 3.768 20 10 EHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(C)cc(OC)c3O)C2)cc1F ZINC000863334600 1137181239 /nfs/dbraw/zinc/18/12/39/1137181239.db2.gz GUGVFGLRMVVUCZ-HNNXBMFYSA-N 1 1 345.414 3.846 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)c(C)cn1)Cc1ccccc1O ZINC001143661866 1137187324 /nfs/dbraw/zinc/18/73/24/1137187324.db2.gz JAGAWYYXFWLBRF-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1[O-] ZINC001144306968 1137270788 /nfs/dbraw/zinc/27/07/88/1137270788.db2.gz YDADRSYMKIYLAA-AWEZNQCLSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306968 1137270789 /nfs/dbraw/zinc/27/07/89/1137270789.db2.gz YDADRSYMKIYLAA-AWEZNQCLSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306968 1137270790 /nfs/dbraw/zinc/27/07/90/1137270790.db2.gz YDADRSYMKIYLAA-AWEZNQCLSA-N 1 1 346.240 3.683 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[NH+]1CC2CCC(CC2)C1 ZINC001144308464 1137271236 /nfs/dbraw/zinc/27/12/36/1137271236.db2.gz ZAHBWZNVSPBNIC-UHFFFAOYSA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(O)c(C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)c(O)c1 ZINC001144519915 1137302907 /nfs/dbraw/zinc/30/29/07/1137302907.db2.gz DMRZBMZVLDCGJB-UHFFFAOYSA-N 1 1 340.206 3.669 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)c(O)c1 ZINC001144519915 1137302908 /nfs/dbraw/zinc/30/29/08/1137302908.db2.gz DMRZBMZVLDCGJB-UHFFFAOYSA-N 1 1 340.206 3.669 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1O ZINC000846167135 1137337415 /nfs/dbraw/zinc/33/74/15/1137337415.db2.gz GUPBTRZVTZCYPO-QMMMGPOBSA-N 1 1 329.293 3.808 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]CC[C@@H](C)N(C)Cc2ccccc2)c1O ZINC000846144596 1137338969 /nfs/dbraw/zinc/33/89/69/1137338969.db2.gz IAXZTHGPZILSFL-SJORKVTESA-N 1 1 342.483 3.962 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000866450638 1137355996 /nfs/dbraw/zinc/35/59/96/1137355996.db2.gz JFFBCINCBGDUDW-JEYLPNPQSA-N 1 1 349.471 3.956 20 10 EHCDMO COCC[C@H](c1ccccc1)[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001171729020 1137506905 /nfs/dbraw/zinc/50/69/05/1137506905.db2.gz FADYCGFPYWSUCW-OAQYLSRUSA-N 1 1 342.483 3.841 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000825903857 1137661723 /nfs/dbraw/zinc/66/17/23/1137661723.db2.gz USURIGJZTZQRAJ-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000825903857 1137661724 /nfs/dbraw/zinc/66/17/24/1137661724.db2.gz USURIGJZTZQRAJ-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2nnn(-c3ccccc3)c2C2CC2)cc1 ZINC000876906260 1137665136 /nfs/dbraw/zinc/66/51/36/1137665136.db2.gz UZCZFZYLVWGAMU-UHFFFAOYSA-N 1 1 347.466 3.501 20 10 EHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC12CC=CC2 ZINC000877608380 1137682867 /nfs/dbraw/zinc/68/28/67/1137682867.db2.gz UBZVBDHBPOVVSD-OAQYLSRUSA-N 1 1 340.511 3.824 20 10 EHCDMO C[C@H]([NH2+]Cc1ncccc1Br)c1ccc(N(C)C)cc1 ZINC000878455195 1137716701 /nfs/dbraw/zinc/71/67/01/1137716701.db2.gz RUNRHXHSZFAOQX-LBPRGKRZSA-N 1 1 334.261 3.761 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000130784318 1137842133 /nfs/dbraw/zinc/84/21/33/1137842133.db2.gz MFVZKHXIVWZXNV-UHFFFAOYSA-N 1 1 326.440 3.503 20 10 EHCDMO C[C@H](c1cccc(NCc2cc(F)cc(F)c2O)c1)[NH+]1CCOCC1 ZINC000883062375 1137843170 /nfs/dbraw/zinc/84/31/70/1137843170.db2.gz AEACUOYKHRVZPB-CYBMUJFWSA-N 1 1 348.393 3.676 20 10 EHCDMO Cc1cc(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000131077472 1137846044 /nfs/dbraw/zinc/84/60/44/1137846044.db2.gz TXZABCSNMPEMGN-IRXDYDNUSA-N 1 1 335.513 3.704 20 10 EHCDMO Oc1cccc2c1[C@H](Nc1ccc(N3CC[N@H+]4CCC[C@H]4C3)cc1)CC2 ZINC000883347515 1137856631 /nfs/dbraw/zinc/85/66/31/1137856631.db2.gz UEHXKNRJGSDZTK-VQTJNVASSA-N 1 1 349.478 3.776 20 10 EHCDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000101905921 1137872025 /nfs/dbraw/zinc/87/20/25/1137872025.db2.gz PLMPMXLGMPMXRC-MRXNPFEDSA-N 1 1 340.467 3.674 20 10 EHCDMO COc1cccc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000133710732 1137906621 /nfs/dbraw/zinc/90/66/21/1137906621.db2.gz FJGFCXYFUQQUAD-QGZVFWFLSA-N 1 1 340.467 3.725 20 10 EHCDMO CCOc1cccc(C[N@H+](C)CC(=O)Nc2cccc(Cl)c2)c1O ZINC000134023020 1137933043 /nfs/dbraw/zinc/93/30/43/1137933043.db2.gz ZAQQMOYAFPSAAU-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)CC(=O)Nc2cccc(Cl)c2)c1O ZINC000134023020 1137933044 /nfs/dbraw/zinc/93/30/44/1137933044.db2.gz ZAQQMOYAFPSAAU-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO COc1ccc(N2CCC([NH2+][C@@H](C)c3c(O)cccc3F)CC2)cc1 ZINC000886520452 1138088917 /nfs/dbraw/zinc/08/89/17/1138088917.db2.gz FFKFTSPNPZLVRJ-AWEZNQCLSA-N 1 1 344.430 3.860 20 10 EHCDMO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2c(O)cccc2F)c2ccccc2)n1 ZINC000886601263 1138100631 /nfs/dbraw/zinc/10/06/31/1138100631.db2.gz NUYPMFWNJNUDQT-BLLLJJGKSA-N 1 1 341.386 3.857 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000826534448 1138195343 /nfs/dbraw/zinc/19/53/43/1138195343.db2.gz GLGKTBKDRVZWTI-HNNXBMFYSA-N 1 1 340.261 3.688 20 10 EHCDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)s1 ZINC000093612609 1138239281 /nfs/dbraw/zinc/23/92/81/1138239281.db2.gz CJLDEKDYKIGJEM-NSHDSACASA-N 1 1 334.441 3.641 20 10 EHCDMO C[N@@H+](Cc1cccc(Cl)c1[O-])Cc1ccccc1N1CCOCC1 ZINC000179616517 1139769788 /nfs/dbraw/zinc/76/97/88/1139769788.db2.gz QADGVRYCPPRMCN-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185050913 1140133872 /nfs/dbraw/zinc/13/38/72/1140133872.db2.gz UZQKCPHHMJBRBE-KBPBESRZSA-N 1 1 344.430 3.910 20 10 EHCDMO CCCCNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185176792 1140138754 /nfs/dbraw/zinc/13/87/54/1140138754.db2.gz GNADSRLECUUVGJ-CQSZACIVSA-N 1 1 344.430 3.912 20 10 EHCDMO C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(Cl)ccc1[O-] ZINC000185231836 1140140622 /nfs/dbraw/zinc/14/06/22/1140140622.db2.gz SDWYCRJPGGFMJF-AWEZNQCLSA-N 1 1 348.874 3.837 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)n1 ZINC000191826608 1140488331 /nfs/dbraw/zinc/48/83/31/1140488331.db2.gz KZUIHNNYFHWNMN-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@H+]2Cc2cc(C)ccc2O)n1 ZINC000191826608 1140488335 /nfs/dbraw/zinc/48/83/35/1140488335.db2.gz KZUIHNNYFHWNMN-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CC2(CCC2)C(=O)O1 ZINC000191895432 1140492194 /nfs/dbraw/zinc/49/21/94/1140492194.db2.gz QUNHHNGYGCKMNY-LJQANCHMSA-N 1 1 342.483 3.595 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1)c1cscn1 ZINC000271069979 1141303556 /nfs/dbraw/zinc/30/35/56/1141303556.db2.gz DWGRMFNVAVRDMJ-MJBXVCDLSA-N 1 1 349.475 3.747 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2noc(C3CC3)n2)C1 ZINC000271231306 1141330151 /nfs/dbraw/zinc/33/01/51/1141330151.db2.gz UOGNGXTWLWBZJN-GFCCVEGCSA-N 1 1 333.819 3.686 20 10 EHCDMO Fc1ccc(Br)c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000038039190 202092621 /nfs/dbraw/zinc/09/26/21/202092621.db2.gz RHCCCBVAJVFGAH-UHFFFAOYSA-N 1 1 336.204 3.813 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ncccc1Cl)C[C@H]1CCCO1 ZINC000528417729 1032258673 /nfs/dbraw/zinc/25/86/73/1032258673.db2.gz IUDRWVWDFLOXDW-OAHLLOKOSA-N 1 1 332.831 3.622 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ncccc1Cl)C[C@H]1CCCO1 ZINC000528417729 1032258684 /nfs/dbraw/zinc/25/86/84/1032258684.db2.gz IUDRWVWDFLOXDW-OAHLLOKOSA-N 1 1 332.831 3.622 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nccc(Cl)c2Cl)c1 ZINC001307628317 1032673755 /nfs/dbraw/zinc/67/37/55/1032673755.db2.gz HLWVOYDLBNETFD-SECBINFHSA-N 1 1 327.211 3.953 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c(O)c1 ZINC001140947990 1017210698 /nfs/dbraw/zinc/21/06/98/1017210698.db2.gz ONJDOENJRISRTJ-CTNGQTDRSA-N 1 1 336.479 3.797 20 10 EHCDMO Cc1ccc(CN2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(O)c1 ZINC001140947990 1017210712 /nfs/dbraw/zinc/21/07/12/1017210712.db2.gz ONJDOENJRISRTJ-CTNGQTDRSA-N 1 1 336.479 3.797 20 10 EHCDMO Cc1ccc(CN2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c(O)c1 ZINC001140947990 1017210723 /nfs/dbraw/zinc/21/07/23/1017210723.db2.gz ONJDOENJRISRTJ-CTNGQTDRSA-N 1 1 336.479 3.797 20 10 EHCDMO COCC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@@H](C)c1ccccc1 ZINC000891677858 1022287566 /nfs/dbraw/zinc/28/75/66/1022287566.db2.gz NIKYIJQNDPFAGN-HNNXBMFYSA-N 1 1 345.439 3.619 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cc1OC ZINC000160205443 1024408468 /nfs/dbraw/zinc/40/84/68/1024408468.db2.gz LMPXHXLTHAKSHM-GOEBONIOSA-N 1 1 327.424 3.787 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC[S@](=O)c2ccccc2)C2CC2)cc1 ZINC000729542310 1024547985 /nfs/dbraw/zinc/54/79/85/1024547985.db2.gz DIJDLOOYFDYSQR-DEOSSOPVSA-N 1 1 342.508 3.525 20 10 EHCDMO CC(C)c1noc([C@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001142527150 1033271789 /nfs/dbraw/zinc/27/17/89/1033271789.db2.gz MGBHTSYFCQUFTP-NSHDSACASA-N 1 1 337.370 3.556 20 10 EHCDMO CC(C)c1noc([C@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001142527150 1033271798 /nfs/dbraw/zinc/27/17/98/1033271798.db2.gz MGBHTSYFCQUFTP-NSHDSACASA-N 1 1 337.370 3.556 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@@H](COCCOC)C2)c(O)c(C(C)(C)C)c1 ZINC000173391038 1033274738 /nfs/dbraw/zinc/27/47/38/1033274738.db2.gz ZELYEQBHFWDOQD-QGZVFWFLSA-N 1 1 349.515 3.737 20 10 EHCDMO C[C@@]1(c2ccc(F)cc2)CN(Cc2cc(F)c(F)cc2[O-])CCO1 ZINC001142527478 1033277447 /nfs/dbraw/zinc/27/74/47/1033277447.db2.gz WHMOBCCXKJHTTL-SFHVURJKSA-N 1 1 337.341 3.557 20 10 EHCDMO Cc1nn(-c2ccccc2C)c(C)c1C[NH2+]Cc1c(O)cccc1F ZINC000896641893 1025797992 /nfs/dbraw/zinc/79/79/92/1025797992.db2.gz OMGGMBKNXQGVIB-UHFFFAOYSA-N 1 1 339.414 3.932 20 10 EHCDMO CSc1ccccc1NC(=O)C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000007361033 1026049350 /nfs/dbraw/zinc/04/93/50/1026049350.db2.gz JISPCKOBCCVQQL-UHFFFAOYSA-N 1 1 343.496 3.545 20 10 EHCDMO CSc1ccccc1NC(=O)C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000007361033 1026049366 /nfs/dbraw/zinc/04/93/66/1026049366.db2.gz JISPCKOBCCVQQL-UHFFFAOYSA-N 1 1 343.496 3.545 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1 ZINC000273364217 1027395255 /nfs/dbraw/zinc/39/52/55/1027395255.db2.gz AZAYVHXUHLDHJX-RDTXWAMCSA-N 1 1 342.439 3.930 20 10 EHCDMO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000121314831 1027580032 /nfs/dbraw/zinc/58/00/32/1027580032.db2.gz MCLITDIKYKOMIR-NSCUHMNNSA-N 1 1 340.442 3.808 20 10 EHCDMO CC[C@@H](C[NH2+]Cc1ccc(N2CCN(C)CC2)cc1)CC(F)(F)F ZINC000840960083 1028061554 /nfs/dbraw/zinc/06/15/54/1028061554.db2.gz FBTKRHIYBZROSJ-OAHLLOKOSA-N 1 1 343.437 3.507 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000159909970 1030433417 /nfs/dbraw/zinc/43/34/17/1030433417.db2.gz MSUVLWQNPMRNPZ-UHFFFAOYSA-N 1 1 346.515 3.889 20 10 EHCDMO CCCNc1ccc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)cc1 ZINC000278393847 1030565765 /nfs/dbraw/zinc/56/57/65/1030565765.db2.gz DYXBGRHBGRWIRM-CQSZACIVSA-N 1 1 342.439 3.852 20 10 EHCDMO Cc1cccc(C)c1NC(=O)C[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000160924641 1031180188 /nfs/dbraw/zinc/18/01/88/1031180188.db2.gz LBEDFVFHDWSTSV-UHFFFAOYSA-N 1 1 343.446 3.579 20 10 EHCDMO Cc1cccc(C)c1NC(=O)C[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000160924641 1031180195 /nfs/dbraw/zinc/18/01/95/1031180195.db2.gz LBEDFVFHDWSTSV-UHFFFAOYSA-N 1 1 343.446 3.579 20 10 EHCDMO Cc1ncccc1C[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000527988035 1031604556 /nfs/dbraw/zinc/60/45/56/1031604556.db2.gz RHSDYVYNWKOKJC-SNVBAGLBSA-N 1 1 339.208 3.848 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000278625048 1031694387 /nfs/dbraw/zinc/69/43/87/1031694387.db2.gz GGGXNFGAQXDJED-SNVBAGLBSA-N 1 1 336.775 3.813 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)cc1O ZINC000185718413 1035523393 /nfs/dbraw/zinc/52/33/93/1035523393.db2.gz QGERBXRSNDQNPX-AAEUAGOBSA-N 1 1 335.810 3.509 20 10 EHCDMO C[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1cc(F)cc(F)c1O ZINC000756372055 1038128776 /nfs/dbraw/zinc/12/87/76/1038128776.db2.gz NVGSKKMEJPQVRV-IINYFYTJSA-N 1 1 326.412 3.685 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1O ZINC000894090108 1040068571 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CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]2CN2CCCCC2)c1 ZINC000738097899 1131461090 /nfs/dbraw/zinc/46/10/90/1131461090.db2.gz VDBMXKDWKCICAT-GOSISDBHSA-N 1 1 346.515 3.846 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)Nc2ccccc2)cc1 ZINC000741678458 1131634707 /nfs/dbraw/zinc/63/47/07/1131634707.db2.gz RGFCKIBVOHAMJT-UHFFFAOYSA-N 1 1 325.456 3.603 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2)cc1 ZINC000741678458 1131634710 /nfs/dbraw/zinc/63/47/10/1131634710.db2.gz RGFCKIBVOHAMJT-UHFFFAOYSA-N 1 1 325.456 3.603 20 10 EHCDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000741724486 1131637116 /nfs/dbraw/zinc/63/71/16/1131637116.db2.gz MJFUJMGJLCVBOA-MAUKXSAKSA-N 1 1 339.483 3.615 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@@H](C(=O)OC)CC1 ZINC001172807160 1131848090 /nfs/dbraw/zinc/84/80/90/1131848090.db2.gz MMKCFKHELPFOQP-IEBWSBKVSA-N 1 1 332.488 3.696 20 10 EHCDMO CCCOC1CCC([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001173099475 1131978881 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O=[N+]([O-])c1cc(C[N@H+]2CCC3(CCC3)C2)ccc1N1CCCCC1 ZINC000769445896 1133291558 /nfs/dbraw/zinc/29/15/58/1133291558.db2.gz HOZFPLLLINDTFW-UHFFFAOYSA-N 1 1 329.444 3.961 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000769459322 1133295429 /nfs/dbraw/zinc/29/54/29/1133295429.db2.gz CSQLKQBBEGOAOP-SFHVURJKSA-N 1 1 326.440 3.804 20 10 EHCDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769469413 1133297136 /nfs/dbraw/zinc/29/71/36/1133297136.db2.gz XZMGTXGGYWLXDI-INIZCTEOSA-N 1 1 340.442 3.782 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)CC1(OC)CCC1 ZINC001180141250 1133330231 /nfs/dbraw/zinc/33/02/31/1133330231.db2.gz FAYUAYJXOZFRGO-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO CCCOc1ccc2c(c1)CC[N@H+](Cc1cccc(OC)c1O)C2 ZINC000770278659 1133403753 /nfs/dbraw/zinc/40/37/53/1133403753.db2.gz BPXIQGJZYVLUSQ-UHFFFAOYSA-N 1 1 327.424 3.748 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1F ZINC000770328866 1133412654 /nfs/dbraw/zinc/41/26/54/1133412654.db2.gz XODIWMHFTUTOMV-JXFKEZNVSA-N 1 1 344.478 3.952 20 10 EHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001181456017 1133488739 /nfs/dbraw/zinc/48/87/39/1133488739.db2.gz KKYCZEGUBRCEFB-KRWDZBQOSA-N 1 1 348.437 3.720 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](CCN(C)C)CC2CCCCC2)c1O ZINC001181470997 1133491247 /nfs/dbraw/zinc/49/12/47/1133491247.db2.gz AHKNXLWHIOHEGG-UHFFFAOYSA-N 1 1 334.504 3.653 20 10 EHCDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001182203219 1133592696 /nfs/dbraw/zinc/59/26/96/1133592696.db2.gz IFSYMAUFTJIMHV-QGZVFWFLSA-N 1 1 343.826 3.738 20 10 EHCDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001182203219 1133592698 /nfs/dbraw/zinc/59/26/98/1133592698.db2.gz IFSYMAUFTJIMHV-QGZVFWFLSA-N 1 1 343.826 3.738 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCC[C@@H](CO)C2)cc1 ZINC000771929275 1133610883 /nfs/dbraw/zinc/61/08/83/1133610883.db2.gz VTZSXJGRDAUTQS-OAQYLSRUSA-N 1 1 338.495 3.917 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1cc(Cl)c(Cl)cc1O ZINC000774205696 1133633008 /nfs/dbraw/zinc/63/30/08/1133633008.db2.gz WFRUXLGTBALQMG-YPMHNXCESA-N 1 1 340.250 3.953 20 10 EHCDMO OC[C@@H](C1CCC1)[N@H+](Cc1ccccc1)Cc1cccc(F)c1O ZINC001182566131 1133700505 /nfs/dbraw/zinc/70/05/05/1133700505.db2.gz LNLKBBXCXYFRJR-IBGZPJMESA-N 1 1 329.415 3.695 20 10 EHCDMO OC[C@@H](C1CCC1)[N@@H+](Cc1ccccc1)Cc1cccc(F)c1O ZINC001182566131 1133700509 /nfs/dbraw/zinc/70/05/09/1133700509.db2.gz LNLKBBXCXYFRJR-IBGZPJMESA-N 1 1 329.415 3.695 20 10 EHCDMO C[C@@]1(C[NH2+]Cc2cc(Cl)c(F)cc2O)OCCc2ccccc21 ZINC001183519080 1133813639 /nfs/dbraw/zinc/81/36/39/1133813639.db2.gz ABBJCZDPYWZOKK-SFHVURJKSA-N 1 1 335.806 3.762 20 10 EHCDMO CC(C)C[N@@H+](CC(=O)N(C)Cc1ccc(N(C)C)cc1)C1CCCC1 ZINC000746658509 1133965605 /nfs/dbraw/zinc/96/56/05/1133965605.db2.gz LKSYZDXJHNZZSB-UHFFFAOYSA-N 1 1 345.531 3.612 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccncc1Cl)C[C@H]1CCCO1 ZINC000746665237 1133980940 /nfs/dbraw/zinc/98/09/40/1133980940.db2.gz ASNZUSHAMLHBFX-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccncc1Cl)C[C@H]1CCCO1 ZINC000746665237 1133980944 /nfs/dbraw/zinc/98/09/44/1133980944.db2.gz ASNZUSHAMLHBFX-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cccc(C(F)(F)F)c1O ZINC000788526336 1134143433 /nfs/dbraw/zinc/14/34/33/1134143433.db2.gz PTDUZJQBBRPIPM-HZMBPMFUSA-N 1 1 339.361 3.873 20 10 EHCDMO CCOC(CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)OCC ZINC000788758937 1134165946 /nfs/dbraw/zinc/16/59/46/1134165946.db2.gz SKFWEMZFNVTXHH-NSHDSACASA-N 1 1 335.366 3.851 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000775024449 1134226772 /nfs/dbraw/zinc/22/67/72/1134226772.db2.gz AJGOHPNTQLNVLD-UHFFFAOYSA-N 1 1 344.411 3.685 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(Cl)c(C)c2)ccc1[N+](=O)[O-] ZINC000775063342 1134272025 /nfs/dbraw/zinc/27/20/25/1134272025.db2.gz RLMKETLXYXWPIE-UHFFFAOYSA-N 1 1 336.775 3.561 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)c2c1 ZINC000789504267 1134286878 /nfs/dbraw/zinc/28/68/78/1134286878.db2.gz JAVLNDDLESOWJB-AZUAARDMSA-N 1 1 327.424 3.697 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H]3[C@@H]3CCCO3)c2c1 ZINC000789504269 1134287419 /nfs/dbraw/zinc/28/74/19/1134287419.db2.gz JAVLNDDLESOWJB-ICSRJNTNSA-N 1 1 327.424 3.697 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000775138282 1134369170 /nfs/dbraw/zinc/36/91/70/1134369170.db2.gz NVMOMVWLGSRYNP-WBVHZDCISA-N 1 1 344.421 3.668 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000790709300 1134456136 /nfs/dbraw/zinc/45/61/36/1134456136.db2.gz DLZPLFBTINRUPW-CYBMUJFWSA-N 1 1 325.408 3.907 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000790951238 1134483747 /nfs/dbraw/zinc/48/37/47/1134483747.db2.gz YPXBMONCWOMNEM-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(c3cccc4cnccc43)C[C@H]2C)c1 ZINC000775203066 1134516784 /nfs/dbraw/zinc/51/67/84/1134516784.db2.gz JDSSFOZESWFDSK-QGZVFWFLSA-N 1 1 347.462 3.960 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(-c3ccc(C)cc3)no2)c1 ZINC000775370326 1134675542 /nfs/dbraw/zinc/67/55/42/1134675542.db2.gz LMCDWQBRJPQMEF-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)C[C@H]1CCOC1 ZINC000792788416 1134788849 /nfs/dbraw/zinc/78/88/49/1134788849.db2.gz DSMQUFNEMQFWEL-CYBMUJFWSA-N 1 1 330.394 3.630 20 10 EHCDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2C(F)(F)F)CCN1C ZINC000792829680 1134797794 /nfs/dbraw/zinc/79/77/94/1134797794.db2.gz RAQLGFODZQMNKP-CJNGLKHVSA-N 1 1 343.437 3.686 20 10 EHCDMO C[C@@H]1C[C@@H](N(C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC[N@@H+]1C ZINC000792829680 1134797798 /nfs/dbraw/zinc/79/77/98/1134797798.db2.gz RAQLGFODZQMNKP-CJNGLKHVSA-N 1 1 343.437 3.686 20 10 EHCDMO C[C@@H]1C[C@@H](N(C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC[N@H+]1C ZINC000792829680 1134797803 /nfs/dbraw/zinc/79/78/03/1134797803.db2.gz RAQLGFODZQMNKP-CJNGLKHVSA-N 1 1 343.437 3.686 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2ccccn2)c(C(F)(F)F)c1 ZINC000793075570 1134846924 /nfs/dbraw/zinc/84/69/24/1134846924.db2.gz DPVGMXHXCVKTIX-UHFFFAOYSA-N 1 1 337.389 3.841 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](OCC(F)(F)F)C2)c1O ZINC000775654132 1135423469 /nfs/dbraw/zinc/42/34/69/1135423469.db2.gz GURALXPRYMNHOO-ZDUSSCGKSA-N 1 1 337.769 3.897 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)cc1OC ZINC000775699842 1135532593 /nfs/dbraw/zinc/53/25/93/1135532593.db2.gz IFCSKEIGAXSBEG-LBPRGKRZSA-N 1 1 331.387 3.668 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1O ZINC000775737071 1135593626 /nfs/dbraw/zinc/59/36/26/1135593626.db2.gz AHRQLYJCHBJEIQ-HNNXBMFYSA-N 1 1 342.277 3.710 20 10 EHCDMO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3cn(C)cn3)cc2Cl)C1 ZINC000808411733 1135664564 /nfs/dbraw/zinc/66/45/64/1135664564.db2.gz IONURMOSEUJYFP-AWEZNQCLSA-N 1 1 332.879 3.600 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc(C(=O)OC)oc2C)cc1 ZINC000747533161 1135749076 /nfs/dbraw/zinc/74/90/76/1135749076.db2.gz NFWWJLJVQLZOSM-UHFFFAOYSA-N 1 1 344.455 3.853 20 10 EHCDMO Cn1cc(C[N@@H+](C)Cc2ccc3c(c2)CCN3Cc2ccccc2)cn1 ZINC000809540212 1135849088 /nfs/dbraw/zinc/84/90/88/1135849088.db2.gz NKCKNRDPVHIEFJ-UHFFFAOYSA-N 1 1 346.478 3.615 20 10 EHCDMO CN(C)Cc1cnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000809574583 1135852973 /nfs/dbraw/zinc/85/29/73/1135852973.db2.gz QFNKFVBSFJOYGZ-UHFFFAOYSA-N 1 1 345.512 3.855 20 10 EHCDMO OCC[C@H]1CCC[N@H+]1Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000809646224 1135865307 /nfs/dbraw/zinc/86/53/07/1135865307.db2.gz WNLSMNVESSENPZ-OAQYLSRUSA-N 1 1 336.479 3.596 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1O ZINC000809700568 1135869389 /nfs/dbraw/zinc/86/93/89/1135869389.db2.gz JILCGCXASGFSQM-IUODEOHRSA-N 1 1 327.852 3.570 20 10 EHCDMO [O-]c1c(Br)cccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000809728811 1135872585 /nfs/dbraw/zinc/87/25/85/1135872585.db2.gz IPEBJXMTRWZYSZ-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2CCNC(=O)OC(C)(C)C)c1 ZINC000809723535 1135878896 /nfs/dbraw/zinc/87/88/96/1135878896.db2.gz JWRBIQACEYAQOV-KRWDZBQOSA-N 1 1 348.487 3.970 20 10 EHCDMO Cc1ccc(CN(CC[NH+](C)C)Cc2c(O)ccc(Cl)c2F)o1 ZINC000809735744 1135882307 /nfs/dbraw/zinc/88/23/07/1135882307.db2.gz QWUJLDKFPOPKHJ-UHFFFAOYSA-N 1 1 340.826 3.650 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)c1O ZINC000809752378 1135885585 /nfs/dbraw/zinc/88/55/85/1135885585.db2.gz QGGSGFFBLCLSEI-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1O ZINC000809758076 1135887505 /nfs/dbraw/zinc/88/75/05/1135887505.db2.gz BSOIEZPSDBGUPZ-KBPBESRZSA-N 1 1 339.863 3.693 20 10 EHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(Br)ccc1O ZINC000809787841 1135892131 /nfs/dbraw/zinc/89/21/31/1135892131.db2.gz KNDOVEZGEPTHHE-UHFFFAOYSA-N 1 1 349.272 3.853 20 10 EHCDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000776012572 1135919651 /nfs/dbraw/zinc/91/96/51/1135919651.db2.gz HQUDLTAWDZENQT-WMLDXEAASA-N 1 1 342.405 3.686 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1 ZINC000810171941 1135930353 /nfs/dbraw/zinc/93/03/53/1135930353.db2.gz ZEAABLFWZGFWEV-QGZVFWFLSA-N 1 1 326.488 3.683 20 10 EHCDMO CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810207855 1135943040 /nfs/dbraw/zinc/94/30/40/1135943040.db2.gz PTLVSGRREHNAQP-HNNXBMFYSA-N 1 1 330.394 3.938 20 10 EHCDMO Cc1nnc(CC[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)s1 ZINC000810243573 1135947455 /nfs/dbraw/zinc/94/74/55/1135947455.db2.gz QKMNCESZWXBPER-ZETCQYMHSA-N 1 1 332.256 3.752 20 10 EHCDMO CCOc1ccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c(O)c1 ZINC000811508461 1136101530 /nfs/dbraw/zinc/10/15/30/1136101530.db2.gz RFAACQINBOAJNU-GOSISDBHSA-N 1 1 338.451 3.776 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2CCc3ccc(O)cc32)c1 ZINC000850386618 1136247107 /nfs/dbraw/zinc/24/71/07/1136247107.db2.gz KELAUWGYYRGRFP-INIZCTEOSA-N 1 1 348.240 3.946 20 10 EHCDMO CC[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C[C@@H](C)OC ZINC000812806954 1136254199 /nfs/dbraw/zinc/25/41/99/1136254199.db2.gz ASFGUABXSYNYHV-MRXNPFEDSA-N 1 1 329.440 3.828 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000850483439 1136267352 /nfs/dbraw/zinc/26/73/52/1136267352.db2.gz YQUCHHKZCBCHRV-RYUDHWBXSA-N 1 1 330.394 3.934 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C1CCOCC1 ZINC000850492407 1136270848 /nfs/dbraw/zinc/27/08/48/1136270848.db2.gz BETIMSULYVODSH-BMIGLBTASA-N 1 1 348.270 3.791 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000747830864 1136279372 /nfs/dbraw/zinc/27/93/72/1136279372.db2.gz MQWDIFBZODDARH-GJZGRUSLSA-N 1 1 333.472 3.644 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813884423 1136372431 /nfs/dbraw/zinc/37/24/31/1136372431.db2.gz VZXPWZPNYZXHOB-WMLDXEAASA-N 1 1 332.394 3.990 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813884424 1136372716 /nfs/dbraw/zinc/37/27/16/1136372716.db2.gz VZXPWZPNYZXHOB-YOEHRIQHSA-N 1 1 332.394 3.990 20 10 EHCDMO COC[C@@H](C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1)OC ZINC000851880078 1136415130 /nfs/dbraw/zinc/41/51/30/1136415130.db2.gz SVUAQRJGZMHTKP-QFBILLFUSA-N 1 1 329.440 3.617 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000852485705 1136459449 /nfs/dbraw/zinc/45/94/49/1136459449.db2.gz PVJUQGOKHKFLQQ-LJQANCHMSA-N 1 1 326.440 3.699 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743911 1136482264 /nfs/dbraw/zinc/48/22/64/1136482264.db2.gz OAQFHZGTCNNCNF-HIFRSBDPSA-N 1 1 330.394 3.603 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743911 1136482267 /nfs/dbraw/zinc/48/22/67/1136482267.db2.gz OAQFHZGTCNNCNF-HIFRSBDPSA-N 1 1 330.394 3.603 20 10 EHCDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(O)c(=O)c1 ZINC000853488612 1136537161 /nfs/dbraw/zinc/53/71/61/1136537161.db2.gz MOQUAIUUBGRYJB-UHFFFAOYSA-N 1 1 340.467 3.574 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)ccc1N(C)C ZINC000815021988 1136538315 /nfs/dbraw/zinc/53/83/15/1136538315.db2.gz LGMCAIOLJPRLCP-BGYRXZFFSA-N 1 1 335.495 3.629 20 10 EHCDMO CCC[N@@H+](Cc1ccnc(Br)c1)Cc1ccccc1O ZINC000815055386 1136541116 /nfs/dbraw/zinc/54/11/16/1136541116.db2.gz YVRBVCSEBQLQJH-UHFFFAOYSA-N 1 1 335.245 3.962 20 10 EHCDMO Cc1cc(C[N@@H+]2[C@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)ccc1N(C)C ZINC000815121151 1136553500 /nfs/dbraw/zinc/55/35/00/1136553500.db2.gz RKYLXISFZDQFBS-CALCHBBNSA-N 1 1 345.531 3.528 20 10 EHCDMO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c(O)c1 ZINC000854222941 1136599195 /nfs/dbraw/zinc/59/91/95/1136599195.db2.gz ORKUNXFXBLGYTI-GDIGMMSISA-N 1 1 328.431 3.636 20 10 EHCDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)c1 ZINC000815634293 1136621937 /nfs/dbraw/zinc/62/19/37/1136621937.db2.gz HYZIIQRTMPXCLJ-QWRGUYRKSA-N 1 1 336.233 3.665 20 10 EHCDMO COc1cc2c(cc1F)C[N@@H+](Cc1cc3c(cc1O)CCC3)CC2 ZINC000776779713 1136664809 /nfs/dbraw/zinc/66/48/09/1136664809.db2.gz JXHNWTBFCAREHM-UHFFFAOYSA-N 1 1 327.399 3.587 20 10 EHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@H]1COc2ccccc2O1 ZINC000816482091 1136722876 /nfs/dbraw/zinc/72/28/76/1136722876.db2.gz UHFURDQTNVCENH-KRWDZBQOSA-N 1 1 335.403 3.817 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1nnc(-c2ccccc2)o1 ZINC000816558417 1136736655 /nfs/dbraw/zinc/73/66/55/1136736655.db2.gz YFSVKRVEHYLWOR-UHFFFAOYSA-N 1 1 347.777 3.567 20 10 EHCDMO C[C@](O)(C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1Cl ZINC000816570463 1136738204 /nfs/dbraw/zinc/73/82/04/1136738204.db2.gz VBQMYNSRPIPWJQ-INIZCTEOSA-N 1 1 344.213 3.835 20 10 EHCDMO C[C@@](O)(C[NH2+]Cc1cc(Cl)c(F)cc1O)c1cccc(Cl)c1 ZINC000816570328 1136738211 /nfs/dbraw/zinc/73/82/11/1136738211.db2.gz QGOTWRPUHKPWIM-MRXNPFEDSA-N 1 1 344.213 3.835 20 10 EHCDMO OCC1(c2ccccc2)CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816624887 1136739359 /nfs/dbraw/zinc/73/93/59/1136739359.db2.gz KITMMRXCJODHBO-UHFFFAOYSA-N 1 1 349.833 3.711 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c(O)c1 ZINC000816642967 1136743882 /nfs/dbraw/zinc/74/38/82/1136743882.db2.gz QUAMFMCDFWJMQT-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c(O)c1 ZINC000816642967 1136743886 /nfs/dbraw/zinc/74/38/86/1136743886.db2.gz QUAMFMCDFWJMQT-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO COC1([C@H](C)[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CCOCC1 ZINC000817588086 1136826623 /nfs/dbraw/zinc/82/66/23/1136826623.db2.gz LOJGEJYTNNNHKZ-MNOVXSKESA-N 1 1 348.270 3.934 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000817938555 1136847843 /nfs/dbraw/zinc/84/78/43/1136847843.db2.gz MXAQCSBBFYEKMT-UGSOOPFHSA-N 1 1 349.425 3.705 20 10 EHCDMO C[C@H]1CCCN(c2ccc(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2Cl)C1 ZINC000817930284 1136852804 /nfs/dbraw/zinc/85/28/04/1136852804.db2.gz NSFNIXXVKBYESA-QTXGHNMQSA-N 1 1 347.934 3.949 20 10 EHCDMO CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817979732 1136855071 /nfs/dbraw/zinc/85/50/71/1136855071.db2.gz DRHDKAOXKGSIGG-UKRRQHHQSA-N 1 1 330.394 3.984 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1c2ccccc2CN(C)C1=O)c1ccc(N(C)C)cc1 ZINC000857875034 1136916525 /nfs/dbraw/zinc/91/65/25/1136916525.db2.gz UPAFLACANVRBMA-VQTJNVASSA-N 1 1 337.467 3.507 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858011173 1136929948 /nfs/dbraw/zinc/92/99/48/1136929948.db2.gz RFLYBFXUUPFWQP-GOSISDBHSA-N 1 1 342.414 3.847 20 10 EHCDMO C[C@@H]([NH2+]C[C@@]1(C)COc2ccccc2O1)c1cc(F)cc(F)c1O ZINC000858447881 1136968533 /nfs/dbraw/zinc/96/85/33/1136968533.db2.gz XSAZDWVNSNQZCX-ZMZPIMSZSA-N 1 1 335.350 3.551 20 10 EHCDMO Cc1nnc(C[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)s1 ZINC000824135460 1137125479 /nfs/dbraw/zinc/12/54/79/1137125479.db2.gz PFOSAAHJDURGQL-UHFFFAOYSA-N 1 1 344.509 3.834 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@@H]2CCO)cc1 ZINC000824215075 1137128438 /nfs/dbraw/zinc/12/84/38/1137128438.db2.gz LJXXPQBJMPUXHQ-GOSISDBHSA-N 1 1 330.497 3.731 20 10 EHCDMO COc1ccc(O)c(C[N@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)c1 ZINC000013993990 1137133926 /nfs/dbraw/zinc/13/39/26/1137133926.db2.gz DMQJZHQLMGQPSG-LJQANCHMSA-N 1 1 345.414 3.721 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000862403527 1137142933 /nfs/dbraw/zinc/14/29/33/1137142933.db2.gz RHMLKRLGVYOVRS-ZDUSSCGKSA-N 1 1 332.188 3.776 20 10 EHCDMO Cc1nc(C[NH2+]Cc2cc(Cl)ccc2O)sc1Br ZINC000824589133 1137144393 /nfs/dbraw/zinc/14/43/93/1137144393.db2.gz AYLHXUWYPVRUNB-UHFFFAOYSA-N 1 1 347.665 3.863 20 10 EHCDMO Cc1ncc(C[N@H+](C)Cc2ccc(Br)cc2O)s1 ZINC000824596897 1137144646 /nfs/dbraw/zinc/14/46/46/1137144646.db2.gz JXLCKBATWDSDAP-UHFFFAOYSA-N 1 1 327.247 3.552 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CCc3nc(C4CC4)ncc3C2)cc1 ZINC000862507230 1137147487 /nfs/dbraw/zinc/14/74/87/1137147487.db2.gz WNDKTBZVLDLJFL-UHFFFAOYSA-N 1 1 336.483 3.759 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCc3nc(C4CC4)ncc3C2)cc1 ZINC000862507230 1137147489 /nfs/dbraw/zinc/14/74/89/1137147489.db2.gz WNDKTBZVLDLJFL-UHFFFAOYSA-N 1 1 336.483 3.759 20 10 EHCDMO CS[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000824683379 1137148255 /nfs/dbraw/zinc/14/82/55/1137148255.db2.gz GPXRBYXPBOKOEI-OAHLLOKOSA-N 1 1 335.473 3.522 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3cc(Cl)ccc3O)CC2)nn1 ZINC000824738350 1137148660 /nfs/dbraw/zinc/14/86/60/1137148660.db2.gz LSRBNRJYAVEIKL-UHFFFAOYSA-N 1 1 346.862 3.897 20 10 EHCDMO Oc1ccc([C@H]2CC[N@H+](Cc3cccc(Br)c3O)C2)cc1 ZINC000862540461 1137149378 /nfs/dbraw/zinc/14/93/78/1137149378.db2.gz FWYRMBOHVLYEJR-ZDUSSCGKSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3cccc(Br)c3O)C2)cc1 ZINC000862540461 1137149380 /nfs/dbraw/zinc/14/93/80/1137149380.db2.gz FWYRMBOHVLYEJR-ZDUSSCGKSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccc(OCC(F)F)cc1)CCC2 ZINC001136940689 1137154184 /nfs/dbraw/zinc/15/41/84/1137154184.db2.gz JPDMNWIFVNXYKM-UHFFFAOYSA-N 1 1 349.377 3.690 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCOCC23CCCCC3)c1O ZINC000825098175 1137163273 /nfs/dbraw/zinc/16/32/73/1137163273.db2.gz BXMZDPYHYWQLRG-UHFFFAOYSA-N 1 1 325.836 3.589 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCOCC23CCCCC3)c1O ZINC000825098175 1137163275 /nfs/dbraw/zinc/16/32/75/1137163275.db2.gz BXMZDPYHYWQLRG-UHFFFAOYSA-N 1 1 325.836 3.589 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@H](C)c2nnc3n2CCCCC3)cc1Cl ZINC000825097789 1137165303 /nfs/dbraw/zinc/16/53/03/1137165303.db2.gz ZOAKRHBILJOUCN-GFCCVEGCSA-N 1 1 334.851 3.523 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@H]2COc3cc(F)cc(F)c32)cc1Cl ZINC000825500729 1137179892 /nfs/dbraw/zinc/17/98/92/1137179892.db2.gz HHJMLWGZIKRYNJ-ZDUSSCGKSA-N 1 1 325.742 3.856 20 10 EHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(C)cc(OC)c3O)C2)cc1F ZINC000863334601 1137181300 /nfs/dbraw/zinc/18/13/00/1137181300.db2.gz GUGVFGLRMVVUCZ-OAHLLOKOSA-N 1 1 345.414 3.846 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)O[C@@H](C4CC4)C3)c2c1 ZINC000794647085 1137220538 /nfs/dbraw/zinc/22/05/38/1137220538.db2.gz KMPLKRATGSDYNA-ZUOKHONESA-N 1 1 327.424 3.553 20 10 EHCDMO [O-]c1cc(F)c(Br)cc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001144306937 1137270727 /nfs/dbraw/zinc/27/07/27/1137270727.db2.gz XDROFDTWKRVWRX-MRVPVSSYSA-N 1 1 338.167 3.771 20 10 EHCDMO CC[N@@H+](Cc1c(O)cc(O)cc1O)Cc1c(F)cccc1Cl ZINC001144515353 1137304297 /nfs/dbraw/zinc/30/42/97/1137304297.db2.gz KYGBKOCTRWFOAR-UHFFFAOYSA-N 1 1 325.767 3.618 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)c(O)c1 ZINC001144515024 1137304398 /nfs/dbraw/zinc/30/43/98/1137304398.db2.gz BPUZHSBZALEKLV-HNNXBMFYSA-N 1 1 349.814 3.500 20 10 EHCDMO CC(C)([NH2+]Cc1cccc(Br)c1O)[C@H]1CCCCO1 ZINC000865746881 1137308299 /nfs/dbraw/zinc/30/82/99/1137308299.db2.gz QLRHIEIIFNLBOW-CYBMUJFWSA-N 1 1 328.250 3.592 20 10 EHCDMO COc1cc(OC)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1F ZINC000845903116 1137319287 /nfs/dbraw/zinc/31/92/87/1137319287.db2.gz LPPAWCRFNLXSEX-UHFFFAOYSA-N 1 1 332.419 3.541 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@]3(CCCOC3)C2)cc1C(C)C ZINC000794903630 1137332777 /nfs/dbraw/zinc/33/27/77/1137332777.db2.gz VCXPGKDLHAEYIU-JXFKEZNVSA-N 1 1 333.472 3.594 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1O ZINC000846116451 1137333672 /nfs/dbraw/zinc/33/36/72/1137333672.db2.gz HUUXNTJYQBQBHZ-CYBMUJFWSA-N 1 1 332.188 3.694 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1O ZINC000846116495 1137333747 /nfs/dbraw/zinc/33/37/47/1137333747.db2.gz CBGHFORFJIWPAN-BJLQDIEVSA-N 1 1 339.435 3.895 20 10 EHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c(OC)c1 ZINC000121010031 1137346178 /nfs/dbraw/zinc/34/61/78/1137346178.db2.gz ZXZRWBROMUEULG-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000773257100 1137482199 /nfs/dbraw/zinc/48/21/99/1137482199.db2.gz COWFZTGSRSADTH-HZPDHXFCSA-N 1 1 326.440 3.579 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CCc3cc(F)c(F)cc3C1)CCC2 ZINC001171496266 1137491893 /nfs/dbraw/zinc/49/18/93/1137491893.db2.gz NXWDDVROGXYFKN-MRXNPFEDSA-N 1 1 345.389 3.682 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(Br)cc2O)CC1 ZINC000825748506 1137621649 /nfs/dbraw/zinc/62/16/49/1137621649.db2.gz CZRSSJJXYCEOIA-HNNXBMFYSA-N 1 1 328.250 3.546 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000876531273 1137654633 /nfs/dbraw/zinc/65/46/33/1137654633.db2.gz AWENODLQWSMJBQ-KRWDZBQOSA-N 1 1 327.424 3.587 20 10 EHCDMO CC[N@@H+](CCc1ccccc1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876580805 1137656224 /nfs/dbraw/zinc/65/62/24/1137656224.db2.gz QYBDJWJCEVMTMU-UHFFFAOYSA-N 1 1 338.495 3.712 20 10 EHCDMO Cc1ccc(C[N@H+](C)[C@@H](c2cnn(C)c2)c2cccc(F)c2)c(O)c1 ZINC000876660759 1137658564 /nfs/dbraw/zinc/65/85/64/1137658564.db2.gz HBLMHQCIRWEUPK-HXUWFJFHSA-N 1 1 339.414 3.795 20 10 EHCDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876729936 1137659721 /nfs/dbraw/zinc/65/97/21/1137659721.db2.gz BCWMYIFQWBODQG-FQEVSTJZSA-N 1 1 348.556 3.755 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC=C(c4ccco4)C3)cc2)CC1 ZINC000877514958 1137679228 /nfs/dbraw/zinc/67/92/28/1137679228.db2.gz RKVAWKIRTZXJBB-UHFFFAOYSA-N 1 1 338.451 3.530 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCC3(CCOCC3)O2)cc1 ZINC000877922958 1137695875 /nfs/dbraw/zinc/69/58/75/1137695875.db2.gz YDHXULINBRMUSF-HXUWFJFHSA-N 1 1 346.515 3.693 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nccn1CC(F)F)C1CCCC1 ZINC000878103968 1137702478 /nfs/dbraw/zinc/70/24/78/1137702478.db2.gz PCVNKTKCNUEBCU-UHFFFAOYSA-N 1 1 335.398 3.799 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000882988999 1137840620 /nfs/dbraw/zinc/84/06/20/1137840620.db2.gz TZFYNZKGYOYOJH-CQSZACIVSA-N 1 1 347.283 3.512 20 10 EHCDMO CCC[N@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1O ZINC000130731710 1137841500 /nfs/dbraw/zinc/84/15/00/1137841500.db2.gz RMCCHQDRAYFSRB-UHFFFAOYSA-N 1 1 337.423 3.778 20 10 EHCDMO CCC[N@@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1O ZINC000130731710 1137841501 /nfs/dbraw/zinc/84/15/01/1137841501.db2.gz RMCCHQDRAYFSRB-UHFFFAOYSA-N 1 1 337.423 3.778 20 10 EHCDMO COC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)cc1 ZINC000883105586 1137844787 /nfs/dbraw/zinc/84/47/87/1137844787.db2.gz PBSRCSCPHQWQNG-OAHLLOKOSA-N 1 1 327.758 3.801 20 10 EHCDMO CC[N@H+](Cc1nc(C)cs1)Cc1cc(Br)ccc1O ZINC000131066680 1137845938 /nfs/dbraw/zinc/84/59/38/1137845938.db2.gz XOFSJFCBGDKHGN-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO CC[N@@H+](Cc1nc(C)cs1)Cc1cc(Br)ccc1O ZINC000131066680 1137845939 /nfs/dbraw/zinc/84/59/39/1137845939.db2.gz XOFSJFCBGDKHGN-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)s1 ZINC000883289199 1137852861 /nfs/dbraw/zinc/85/28/61/1137852861.db2.gz HLMVXWIRXQYFMX-MRXNPFEDSA-N 1 1 329.513 3.659 20 10 EHCDMO CC[N@H+](Cc1nccn1CC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000132221237 1137864252 /nfs/dbraw/zinc/86/42/52/1137864252.db2.gz SZZLVQSSSPRHLS-UHFFFAOYSA-N 1 1 340.393 3.534 20 10 EHCDMO CC[N@@H+](Cc1nccn1CC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000132221237 1137864253 /nfs/dbraw/zinc/86/42/53/1137864253.db2.gz SZZLVQSSSPRHLS-UHFFFAOYSA-N 1 1 340.393 3.534 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(O[C@H]2CCOC2)c1 ZINC000886538151 1138092953 /nfs/dbraw/zinc/09/29/53/1138092953.db2.gz CHCGOHRGBXAWQV-HOCLYGCPSA-N 1 1 345.414 3.858 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)c1 ZINC000092437261 1138227991 /nfs/dbraw/zinc/22/79/91/1138227991.db2.gz BZKQLFHMWDUWEC-SFHVURJKSA-N 1 1 331.412 3.565 20 10 EHCDMO C[C@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1ccc(F)cc1O ZINC000184984699 1140129864 /nfs/dbraw/zinc/12/98/64/1140129864.db2.gz WUWLKNXILUSYPP-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1ccc(F)cc1O ZINC000186148464 1140188818 /nfs/dbraw/zinc/18/88/18/1140188818.db2.gz ZHHCLFJHNUTFHN-RDTXWAMCSA-N 1 1 331.431 3.984 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCSC3(CCOCC3)C2)cc1 ZINC000186493858 1140207289 /nfs/dbraw/zinc/20/72/89/1140207289.db2.gz IKBZEUNSARIQSV-UHFFFAOYSA-N 1 1 334.529 3.631 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000186831498 1140224090 /nfs/dbraw/zinc/22/40/90/1140224090.db2.gz PHNHPOLIOSVAAJ-LBPRGKRZSA-N 1 1 334.416 3.555 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1O ZINC000777439855 1140280886 /nfs/dbraw/zinc/28/08/86/1140280886.db2.gz PICCXRSJYSXQHC-GOSISDBHSA-N 1 1 335.806 3.587 20 10 EHCDMO C[C@@H]([NH2+]CCC(=O)N1CCCCC1)c1cc(Cl)c(Cl)cc1O ZINC000192693180 1140544455 /nfs/dbraw/zinc/54/44/55/1140544455.db2.gz UBHKQMAZDGRRBA-LLVKDONJSA-N 1 1 345.270 3.752 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc2cc[nH]c21 ZINC000271053097 1141301691 /nfs/dbraw/zinc/30/16/91/1141301691.db2.gz XKYGPRSWGQJDKK-UHFFFAOYSA-N 1 1 335.451 3.637 20 10 EHCDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000271225209 1141329157 /nfs/dbraw/zinc/32/91/57/1141329157.db2.gz QNUCHOPFKYYBGP-BSEYFRJRSA-N 1 1 348.487 3.822 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@H](c3ccc(F)c(F)c3)C1)CCC2 ZINC000066794767 1018026894 /nfs/dbraw/zinc/02/68/94/1018026894.db2.gz OGWRFLUKZUFBLX-FQEVSTJZSA-N 1 1 345.389 3.733 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3ccc(F)c(F)c3)C1)CCC2 ZINC000066794767 1018026905 /nfs/dbraw/zinc/02/69/05/1018026905.db2.gz OGWRFLUKZUFBLX-FQEVSTJZSA-N 1 1 345.389 3.733 20 10 EHCDMO C[C@H]([NH2+]Cc1cccnc1)c1cc(Br)c(F)cc1O ZINC000756343029 1018586105 /nfs/dbraw/zinc/58/61/05/1018586105.db2.gz MLCNPFHGAWBEQP-VIFPVBQESA-N 1 1 325.181 3.540 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cc1OC ZINC000160377509 1018651031 /nfs/dbraw/zinc/65/10/31/1018651031.db2.gz GHEYMNXCALYCMZ-WMLDXEAASA-N 1 1 327.424 3.787 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cn1nccc1-c1ccncc1 ZINC000729265054 1019256589 /nfs/dbraw/zinc/25/65/89/1019256589.db2.gz QWPDMJFUAUVSFU-UHFFFAOYSA-N 1 1 349.482 3.879 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cn(C(C)C)nn2)cc1F ZINC000925016472 1021554128 /nfs/dbraw/zinc/55/41/28/1021554128.db2.gz ZJBIHKVPACVBMU-CQSZACIVSA-N 1 1 333.455 3.695 20 10 EHCDMO COCCOc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)o1 ZINC000891595976 1022071323 /nfs/dbraw/zinc/07/13/23/1022071323.db2.gz HNCNHEBJNOVXPJ-UHFFFAOYSA-N 1 1 344.455 3.535 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2cccnc21 ZINC000101596013 1022303616 /nfs/dbraw/zinc/30/36/16/1022303616.db2.gz DGPOJEQTVGIEFI-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO CC(=O)N1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000280859280 1024342784 /nfs/dbraw/zinc/34/27/84/1024342784.db2.gz CBGZWHIQEBQWQM-CMPLNLGQSA-N 1 1 345.270 3.608 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3ccc(N(C)C)cc3C)[C@H]2C(C)C)C1 ZINC000895989256 1025046540 /nfs/dbraw/zinc/04/65/40/1025046540.db2.gz QJNUVRBEWBJZGS-IBGZPJMESA-N 1 1 346.515 3.671 20 10 EHCDMO CC[N@@H+](CCC(=O)OC)Cc1cc2oc3ccccc3c2cc1O ZINC000738096004 1025931699 /nfs/dbraw/zinc/93/16/99/1025931699.db2.gz FZVAOWXILDEFCP-UHFFFAOYSA-N 1 1 327.380 3.677 20 10 EHCDMO C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1[O-] ZINC000273410847 1027416923 /nfs/dbraw/zinc/41/69/23/1027416923.db2.gz HUMSFNWBAFFJRR-LBPRGKRZSA-N 1 1 341.293 3.537 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000278634369 1031747263 /nfs/dbraw/zinc/74/72/63/1031747263.db2.gz HHQLVZXIGDORFS-UHFFFAOYSA-N 1 1 330.384 3.722 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)ccc1N1CCCCC1 ZINC000827972825 1031915234 /nfs/dbraw/zinc/91/52/34/1031915234.db2.gz COCXHWWVIYZVJF-UYAOXDASSA-N 1 1 329.532 3.900 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)c1O ZINC000761201221 1034405601 /nfs/dbraw/zinc/40/56/01/1034405601.db2.gz FFPOAQMQAFNXHH-INIZCTEOSA-N 1 1 335.831 3.610 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@H](CCC(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000066080611 1035213834 /nfs/dbraw/zinc/21/38/34/1035213834.db2.gz LDHFNMRGCDBJPV-MRXNPFEDSA-N 1 1 346.515 3.730 20 10 EHCDMO COCCOc1cccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)c1 ZINC000756433693 1038735681 /nfs/dbraw/zinc/73/56/81/1038735681.db2.gz XJJUJRYDHHBLIL-GFCCVEGCSA-N 1 1 337.366 3.546 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000905679263 1039037185 /nfs/dbraw/zinc/03/71/85/1039037185.db2.gz VDWZXDOFMSLNKM-HNNXBMFYSA-N 1 1 340.320 3.807 20 10 EHCDMO Cc1cccc(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1O ZINC000364098680 1039738931 /nfs/dbraw/zinc/73/89/31/1039738931.db2.gz FOGWELFTZBGEBF-GOSISDBHSA-N 1 1 341.842 3.967 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cc(F)cc(F)c1O)C[C@H]1CCCO1 ZINC000893879805 1039784782 /nfs/dbraw/zinc/78/47/82/1039784782.db2.gz JNSMCHFFMNWKBO-MRXNPFEDSA-N 1 1 349.377 3.557 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)cc(F)c1O)C[C@H]1CCCO1 ZINC000893879805 1039784798 /nfs/dbraw/zinc/78/47/98/1039784798.db2.gz JNSMCHFFMNWKBO-MRXNPFEDSA-N 1 1 349.377 3.557 20 10 EHCDMO COC(=O)c1nc([C@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)sc1C ZINC000279679302 1044406344 /nfs/dbraw/zinc/40/63/44/1044406344.db2.gz OMXPRYCXYFVIPS-CQSZACIVSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@H]2CCC[N@H+]2Cc2cc(C)ccc2O)sc1C ZINC000279679302 1044406351 /nfs/dbraw/zinc/40/63/51/1044406351.db2.gz OMXPRYCXYFVIPS-CQSZACIVSA-N 1 1 346.452 3.589 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCCc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000279855534 1044754294 /nfs/dbraw/zinc/75/42/94/1044754294.db2.gz SDGIJPUIARFTTJ-HNNXBMFYSA-N 1 1 346.358 3.615 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(F)cc1O ZINC000185399955 1126885750 /nfs/dbraw/zinc/88/57/50/1126885750.db2.gz OBCDBHBLHZZRLH-JSGCOSHPSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872687 1128629319 /nfs/dbraw/zinc/62/93/19/1128629319.db2.gz KOBWENHZFIJXKY-VQIMIIECSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872687 1128629321 /nfs/dbraw/zinc/62/93/21/1128629321.db2.gz KOBWENHZFIJXKY-VQIMIIECSA-N 1 1 345.506 3.951 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1ccc(F)c(F)c1 ZINC000917013922 1122438437 /nfs/dbraw/zinc/43/84/37/1122438437.db2.gz IMSARERJTJRNIM-FQEVSTJZSA-N 1 1 348.437 3.975 20 10 EHCDMO CC(C)[N@@H+](CC(=O)NCC1CCCCC1)Cc1ccc(N(C)C)cc1 ZINC000917074868 1122472153 /nfs/dbraw/zinc/47/21/53/1122472153.db2.gz IZQBZBUXRODNKI-UHFFFAOYSA-N 1 1 345.531 3.660 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cn1c2ccccc2oc1=O ZINC000917411139 1122600081 /nfs/dbraw/zinc/60/00/81/1122600081.db2.gz MXWRHAKLPYPOIC-UHFFFAOYSA-N 1 1 339.439 3.529 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000180322904 1123986640 /nfs/dbraw/zinc/98/66/40/1123986640.db2.gz DXZCQTGPJXDRGN-SFHVURJKSA-N 1 1 326.440 3.502 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(-c3cccc(C)c3)no2)c1 ZINC000182462460 1125299343 /nfs/dbraw/zinc/29/93/43/1125299343.db2.gz ONRHQYXBOCIWML-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO CCCN(Cc1ccccc1O)C(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000731280051 1130782539 /nfs/dbraw/zinc/78/25/39/1130782539.db2.gz FBHFCBKOEQMHFU-IAGOWNOFSA-N 1 1 347.503 3.577 20 10 EHCDMO CC[C@@H]1CCCCN1C(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731845708 1130850289 /nfs/dbraw/zinc/85/02/89/1130850289.db2.gz IDYWPZXYBHPZSQ-GOSISDBHSA-N 1 1 344.499 3.928 20 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/nfs/dbraw/zinc/46/46/80/1131464680.db2.gz PGUCOOPCFJYMRN-QGZVFWFLSA-N 1 1 346.515 3.650 20 10 EHCDMO C[N@H+](CC(=O)NCCC(C)(C)C)Cc1ccc(N2CCCCC2)cc1 ZINC000738299459 1131467252 /nfs/dbraw/zinc/46/72/52/1131467252.db2.gz PSTSERJHSNJIJQ-UHFFFAOYSA-N 1 1 345.531 3.661 20 10 EHCDMO C[N@@H+](CC(=O)NCCC(C)(C)C)Cc1ccc(N2CCCCC2)cc1 ZINC000738299459 1131467257 /nfs/dbraw/zinc/46/72/57/1131467257.db2.gz PSTSERJHSNJIJQ-UHFFFAOYSA-N 1 1 345.531 3.661 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)CC)cc2)C1 ZINC000741754630 1131644347 /nfs/dbraw/zinc/64/43/47/1131644347.db2.gz UFPXJYFQHDVOHF-MJGOQNOKSA-N 1 1 345.531 3.660 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCCn2ccnc2C)cc1 ZINC000767361557 1132989676 /nfs/dbraw/zinc/98/96/76/1132989676.db2.gz OVTNLQUWQZPRME-UHFFFAOYSA-N 1 1 328.504 3.950 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(Br)cc1 ZINC000768169087 1133104281 /nfs/dbraw/zinc/10/42/81/1133104281.db2.gz FMONKXISRCAGMM-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccc(OC)cc2)C2CC2)c1 ZINC000768200092 1133106765 /nfs/dbraw/zinc/10/67/65/1133106765.db2.gz NFLQNWDERVZPBA-UHFFFAOYSA-N 1 1 327.424 3.964 20 10 EHCDMO Cc1cc(O)c(C[N@H+](CC(=O)Nc2ccc(F)cc2)C(C)C)cc1C ZINC000768179298 1133108831 /nfs/dbraw/zinc/10/88/31/1133108831.db2.gz AEOVGUOMYUXFGX-UHFFFAOYSA-N 1 1 344.430 3.997 20 10 EHCDMO Cc1cccc2ncc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)n21 ZINC000768256298 1133118072 /nfs/dbraw/zinc/11/80/72/1133118072.db2.gz BEOIDDOVIQQGBW-UHFFFAOYSA-N 1 1 334.467 3.873 20 10 EHCDMO Cc1ccc(C[N@@H+](Cc2ccc(N3CCOCC3)cc2)C2CC2)o1 ZINC000768258156 1133118200 /nfs/dbraw/zinc/11/82/00/1133118200.db2.gz RDAXKJJWXPCZBC-UHFFFAOYSA-N 1 1 326.440 3.589 20 10 EHCDMO COc1cc(O)c(C[N@@H+](Cc2cccc(F)c2)C(C)C)cc1OC ZINC000768444966 1133140450 /nfs/dbraw/zinc/14/04/50/1133140450.db2.gz ZSOODWDAMVBRSN-UHFFFAOYSA-N 1 1 333.403 3.959 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](c3ccccc3)CC1)[C@H](O)CO2 ZINC000768453570 1133141488 /nfs/dbraw/zinc/14/14/88/1133141488.db2.gz YXQMSZJPGFZUCV-OXQOHEQNSA-N 1 1 339.435 3.588 20 10 EHCDMO CC(C)C[N@@H+]1CCC[C@H](CNCc2ccc(N3CCCC3)cc2)C1 ZINC001178249310 1133145275 /nfs/dbraw/zinc/14/52/75/1133145275.db2.gz MHLLCRGTKPBRAN-HXUWFJFHSA-N 1 1 329.532 3.744 20 10 EHCDMO CC(C)C[N@H+]1CCC[C@H](CNCc2ccc(N3CCCC3)cc2)C1 ZINC001178249310 1133145278 /nfs/dbraw/zinc/14/52/78/1133145278.db2.gz MHLLCRGTKPBRAN-HXUWFJFHSA-N 1 1 329.532 3.744 20 10 EHCDMO CC(C)(C)OC(=O)c1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC001178318530 1133158965 /nfs/dbraw/zinc/15/89/65/1133158965.db2.gz YSTYDPHBIPPGIR-UHFFFAOYSA-N 1 1 349.377 3.916 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1OCc1ccncc1 ZINC000768873629 1133194222 /nfs/dbraw/zinc/19/42/22/1133194222.db2.gz SLYLWFXGYDEBGD-UHFFFAOYSA-N 1 1 334.419 3.998 20 10 EHCDMO C[N@H+](CCc1ccccc1F)Cc1cccc(Br)c1O ZINC000769027409 1133215860 /nfs/dbraw/zinc/21/58/60/1133215860.db2.gz AQNXRLMKOIBBKF-UHFFFAOYSA-N 1 1 338.220 3.968 20 10 EHCDMO C[N@@H+](CCc1ccccc1F)Cc1cccc(Br)c1O ZINC000769027409 1133215862 /nfs/dbraw/zinc/21/58/62/1133215862.db2.gz AQNXRLMKOIBBKF-UHFFFAOYSA-N 1 1 338.220 3.968 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cnc4ccccc4c3)CC2)cc1 ZINC000768999390 1133218919 /nfs/dbraw/zinc/21/89/19/1133218919.db2.gz WTXUXUNZKQHRGN-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO Oc1ccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000769107692 1133228060 /nfs/dbraw/zinc/22/80/60/1133228060.db2.gz ZGJAGCXREDHYCO-OAQYLSRUSA-N 1 1 338.451 3.566 20 10 EHCDMO CCOc1cccc(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000769149210 1133234899 /nfs/dbraw/zinc/23/48/99/1133234899.db2.gz YYUZDEZTAPJPTL-GOSISDBHSA-N 1 1 346.515 3.735 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1O ZINC000769315256 1133261206 /nfs/dbraw/zinc/26/12/06/1133261206.db2.gz IZMRYJAJJAHHKC-LJQANCHMSA-N 1 1 327.424 3.755 20 10 EHCDMO OC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769444812 1133290972 /nfs/dbraw/zinc/29/09/72/1133290972.db2.gz CJUCHZVICHVGNP-QFIPXVFZSA-N 1 1 336.479 3.769 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](CC(C)C)C[C@H](O)c1ccc(F)cc1 ZINC000769444731 1133291180 /nfs/dbraw/zinc/29/11/80/1133291180.db2.gz CVZQUEYUJVNUCL-IBGZPJMESA-N 1 1 347.430 3.732 20 10 EHCDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000769461954 1133295250 /nfs/dbraw/zinc/29/52/50/1133295250.db2.gz CVYCQTPFWBCUJG-IBGZPJMESA-N 1 1 338.495 3.895 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000769504605 1133304557 /nfs/dbraw/zinc/30/45/57/1133304557.db2.gz WBTIWIHSDWGKJG-GOSISDBHSA-N 1 1 326.440 3.867 20 10 EHCDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769542357 1133312152 /nfs/dbraw/zinc/31/21/52/1133312152.db2.gz HABDBDLJOUWRSI-UHFFFAOYSA-N 1 1 328.416 3.545 20 10 EHCDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769542357 1133312156 /nfs/dbraw/zinc/31/21/56/1133312156.db2.gz HABDBDLJOUWRSI-UHFFFAOYSA-N 1 1 328.416 3.545 20 10 EHCDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC001180112748 1133333197 /nfs/dbraw/zinc/33/31/97/1133333197.db2.gz NLRXXZAFEWWNOS-GFCCVEGCSA-N 1 1 341.398 3.614 20 10 EHCDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC001180112748 1133333204 /nfs/dbraw/zinc/33/32/04/1133333204.db2.gz NLRXXZAFEWWNOS-GFCCVEGCSA-N 1 1 341.398 3.614 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1cccc(C(F)(F)F)c1O ZINC000815589676 1133349519 /nfs/dbraw/zinc/34/95/19/1133349519.db2.gz ZYZNAQDBJGZENL-RYUDHWBXSA-N 1 1 343.345 3.506 20 10 EHCDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000770333032 1133406435 /nfs/dbraw/zinc/40/64/35/1133406435.db2.gz VQSZJGDLDFBXAJ-CYBMUJFWSA-N 1 1 339.863 3.989 20 10 EHCDMO Cn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c(C(F)F)n1 ZINC000770666341 1133457065 /nfs/dbraw/zinc/45/70/65/1133457065.db2.gz JLQXYIANYMPZJA-UHFFFAOYSA-N 1 1 347.365 3.859 20 10 EHCDMO Cn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c(C(F)F)n1 ZINC000770666341 1133457068 /nfs/dbraw/zinc/45/70/68/1133457068.db2.gz JLQXYIANYMPZJA-UHFFFAOYSA-N 1 1 347.365 3.859 20 10 EHCDMO COc1cc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c(O)c(C(C)(C)C)c1 ZINC001181391473 1133487305 /nfs/dbraw/zinc/48/73/05/1133487305.db2.gz YTOXFPZHDVQQID-HOCLYGCPSA-N 1 1 335.488 3.824 20 10 EHCDMO C[C@@H](Cc1cnccn1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774154167 1133624584 /nfs/dbraw/zinc/62/45/84/1133624584.db2.gz AKWBRDSXRQCIGO-UWVGGRQHSA-N 1 1 326.227 3.771 20 10 EHCDMO COc1cc(C[N@H+]2CCOC[C@H]2C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001182532282 1133697683 /nfs/dbraw/zinc/69/76/83/1133697683.db2.gz BMURZUOYTMYGBG-SFHVURJKSA-N 1 1 333.472 3.699 20 10 EHCDMO C[N@@H+](Cc1cncc(OCc2ccccc2)c1)Cc1ccccc1O ZINC000785752323 1133747614 /nfs/dbraw/zinc/74/76/14/1133747614.db2.gz HSQSYZJDIYHPDQ-UHFFFAOYSA-N 1 1 334.419 3.998 20 10 EHCDMO CCc1cccc(C[N@H+]2CCO[C@@H](c3ccc(OC)cc3)C2)c1O ZINC001183363760 1133794981 /nfs/dbraw/zinc/79/49/81/1133794981.db2.gz MKQRTCGAUUHLQR-LJQANCHMSA-N 1 1 327.424 3.537 20 10 EHCDMO C[NH+](C)Cc1ccc(NCc2ccccc2O)cc1Br ZINC000786157839 1133808455 /nfs/dbraw/zinc/80/84/55/1133808455.db2.gz WWDUQYWDDJUKPU-UHFFFAOYSA-N 1 1 335.245 3.828 20 10 EHCDMO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)c(O)cc1Br ZINC001250120698 1133837963 /nfs/dbraw/zinc/83/79/63/1133837963.db2.gz NFCCYOHZCKLOLD-UHFFFAOYSA-N 1 1 332.188 3.694 20 10 EHCDMO CC[C@H](C[N@@H+](CC)Cc1cc2c(cc1O)OC[C@H]2O)c1ccccc1 ZINC000774698525 1133880062 /nfs/dbraw/zinc/88/00/62/1133880062.db2.gz CIUQMRIOBZAJGP-FOIQADDNSA-N 1 1 341.451 3.834 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+]2CCn3nc(C(C)(C)C)cc3C2)cc1 ZINC001184106276 1133893478 /nfs/dbraw/zinc/89/34/78/1133893478.db2.gz LWNACLPINQJSLP-VOTSOKGWSA-N 1 1 338.499 3.776 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCn3nc(C(C)(C)C)cc3C2)cc1 ZINC001184106276 1133893485 /nfs/dbraw/zinc/89/34/85/1133893485.db2.gz LWNACLPINQJSLP-VOTSOKGWSA-N 1 1 338.499 3.776 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCOCC(F)(F)C(F)F)C2CC2)cc1 ZINC000787184059 1133970475 /nfs/dbraw/zinc/97/04/75/1133970475.db2.gz MPLIEWVRURZRGW-UHFFFAOYSA-N 1 1 348.384 3.634 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000774874937 1134082563 /nfs/dbraw/zinc/08/25/63/1134082563.db2.gz PYWTVQNSBPKZSU-CQSZACIVSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000774874937 1134082570 /nfs/dbraw/zinc/08/25/70/1134082570.db2.gz PYWTVQNSBPKZSU-CQSZACIVSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCCC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000774889494 1134104787 /nfs/dbraw/zinc/10/47/87/1134104787.db2.gz VGYUXIBEMMYILX-UHFFFAOYSA-N 1 1 334.416 3.855 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCCC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000774889494 1134104790 /nfs/dbraw/zinc/10/47/90/1134104790.db2.gz VGYUXIBEMMYILX-UHFFFAOYSA-N 1 1 334.416 3.855 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000774911150 1134118685 /nfs/dbraw/zinc/11/86/85/1134118685.db2.gz VYUHFZJALAXBIG-BLLLJJGKSA-N 1 1 328.368 3.502 20 10 EHCDMO C[C@@H]([NH2+]CCc1ccc(CO)cc1)c1cccc(C(F)(F)F)c1O ZINC000788690689 1134157628 /nfs/dbraw/zinc/15/76/28/1134157628.db2.gz KTRYTQRQJJSDOC-GFCCVEGCSA-N 1 1 339.357 3.797 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)Cc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000775013335 1134208717 /nfs/dbraw/zinc/20/87/17/1134208717.db2.gz UVKXOQLHDGYIEG-CQSZACIVSA-N 1 1 344.411 3.647 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC001203643522 1134242507 /nfs/dbraw/zinc/24/25/07/1134242507.db2.gz WVVCACIDQGFTHW-CYBMUJFWSA-N 1 1 333.229 3.539 20 10 EHCDMO COc1ccnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1OC ZINC000789309219 1134251938 /nfs/dbraw/zinc/25/19/38/1134251938.db2.gz FSUVOPNMJPQXNP-UHFFFAOYSA-N 1 1 343.471 3.575 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2cccc(C(C)C)c2)ccc1[N+](=O)[O-] ZINC000775072781 1134285056 /nfs/dbraw/zinc/28/50/56/1134285056.db2.gz DQWANQVIQXKKOD-UHFFFAOYSA-N 1 1 330.384 3.722 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789517589 1134290079 /nfs/dbraw/zinc/29/00/79/1134290079.db2.gz WTNKIRKJNNBEKJ-MSOLQXFVSA-N 1 1 333.472 3.842 20 10 EHCDMO CC1(C)CC[N@H+](Cc2cccc(Br)c2O)CCS1 ZINC000789764228 1134329074 /nfs/dbraw/zinc/32/90/74/1134329074.db2.gz VWWSMSDMPOQQON-UHFFFAOYSA-N 1 1 330.291 3.872 20 10 EHCDMO CC1(C)CC[N@@H+](Cc2cccc(Br)c2O)CCS1 ZINC000789764228 1134329080 /nfs/dbraw/zinc/32/90/80/1134329080.db2.gz VWWSMSDMPOQQON-UHFFFAOYSA-N 1 1 330.291 3.872 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775139302 1134370962 /nfs/dbraw/zinc/37/09/62/1134370962.db2.gz YTZBZNJSYLGWMA-SECBINFHSA-N 1 1 338.167 3.929 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775139302 1134370968 /nfs/dbraw/zinc/37/09/68/1134370968.db2.gz YTZBZNJSYLGWMA-SECBINFHSA-N 1 1 338.167 3.929 20 10 EHCDMO COc1ccccc1/C=C\C[NH2+]Cc1cccc(Br)c1O ZINC000775152513 1134397121 /nfs/dbraw/zinc/39/71/21/1134397121.db2.gz NIQZPDWQEDEKHJ-YVMONPNESA-N 1 1 348.240 3.966 20 10 EHCDMO C[C@](O)(C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1Cl 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339.395 3.610 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1nc(C)c(C)s1 ZINC000772799002 1134702431 /nfs/dbraw/zinc/70/24/31/1134702431.db2.gz VPSIRFSRGSWBRF-CYBMUJFWSA-N 1 1 347.484 3.705 20 10 EHCDMO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204703 1134814250 /nfs/dbraw/zinc/81/42/50/1134814250.db2.gz VELSTAYVKMNBOH-QAPCUYQASA-N 1 1 339.863 3.884 20 10 EHCDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204703 1134814261 /nfs/dbraw/zinc/81/42/61/1134814261.db2.gz VELSTAYVKMNBOH-QAPCUYQASA-N 1 1 339.863 3.884 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c(O)c1 ZINC000793611481 1134972020 /nfs/dbraw/zinc/97/20/20/1134972020.db2.gz HFKOTLQIYRUUNK-CABCVRRESA-N 1 1 330.255 3.807 20 10 EHCDMO COC1(C)CC[NH+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1 ZINC000775555961 1135078443 /nfs/dbraw/zinc/07/84/43/1135078443.db2.gz AQJXNIRYGQGYDF-UHFFFAOYSA-N 1 1 340.467 3.778 20 10 EHCDMO CO[C@@]1(C)C[C@@H]([NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C 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C[C@H]([NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)c1nccn1C ZINC000850409624 1136252215 /nfs/dbraw/zinc/25/22/15/1136252215.db2.gz DJYMEQHCTGQXKG-KRWDZBQOSA-N 1 1 346.478 3.834 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(F)cc1O ZINC000850487483 1136269322 /nfs/dbraw/zinc/26/93/22/1136269322.db2.gz NOZXMLNZHWHBCQ-HNAYVOBHSA-N 1 1 344.430 3.860 20 10 EHCDMO CSc1ccccc1NC(=O)CC[N@@H+](C)Cc1ccccc1O ZINC000109770618 1136339977 /nfs/dbraw/zinc/33/99/77/1136339977.db2.gz FTZRBNKTDCZZEZ-UHFFFAOYSA-N 1 1 330.453 3.575 20 10 EHCDMO CO[C@H](C[N@@H+](Cc1ccccc1O)C1CCCCC1)[C@H]1CCOC1 ZINC000851769641 1136406059 /nfs/dbraw/zinc/40/60/59/1136406059.db2.gz KIPLFIZAFLRTMX-FXAWDEMLSA-N 1 1 333.472 3.578 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c1O ZINC000852594304 1136469279 /nfs/dbraw/zinc/46/92/79/1136469279.db2.gz BGHDJTRXNZFKTI-KBXCAEBGSA-N 1 1 335.419 3.515 20 10 EHCDMO C[C@H](Nc1[nH+]ccc2c(N)cccc21)c1ccc(N2CCOCC2)cc1 ZINC000853232846 1136520389 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20 10 EHCDMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)[nH]n1 ZINC000815597051 1136617125 /nfs/dbraw/zinc/61/71/25/1136617125.db2.gz LJFLUYZPNSMSDG-MWLCHTKSSA-N 1 1 327.350 3.724 20 10 EHCDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)c(O)c1 ZINC000815634298 1136622070 /nfs/dbraw/zinc/62/20/70/1136622070.db2.gz ICEWLFZKUNBOQC-MNOVXSKESA-N 1 1 336.233 3.665 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000776779051 1136664832 /nfs/dbraw/zinc/66/48/32/1136664832.db2.gz ZGGGCSYXBNVJSJ-QGZVFWFLSA-N 1 1 333.472 3.786 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000816520321 1136727236 /nfs/dbraw/zinc/72/72/36/1136727236.db2.gz LZWCVSOCZMHZPD-MLGOLLRUSA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000816520321 1136727240 /nfs/dbraw/zinc/72/72/40/1136727240.db2.gz LZWCVSOCZMHZPD-MLGOLLRUSA-N 1 1 339.794 3.866 20 10 EHCDMO C[N@@H+](Cc1ccc2ccccc2c1O)[C@H]1CCN(c2ccccc2)C1=O ZINC000816504445 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3.860 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000823447985 1137100150 /nfs/dbraw/zinc/10/01/50/1137100150.db2.gz QDUWYOCLZCYVTI-UHFFFAOYSA-N 1 1 326.469 3.740 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000823447985 1137100152 /nfs/dbraw/zinc/10/01/52/1137100152.db2.gz QDUWYOCLZCYVTI-UHFFFAOYSA-N 1 1 326.469 3.740 20 10 EHCDMO CCc1nnc(C[NH2+]Cc2ccc(N(CC)Cc3ccccc3)cc2)[nH]1 ZINC000824445526 1137138240 /nfs/dbraw/zinc/13/82/40/1137138240.db2.gz CWRBANXPLHYNIP-UHFFFAOYSA-N 1 1 349.482 3.683 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000824566073 1137143117 /nfs/dbraw/zinc/14/31/17/1137143117.db2.gz FBEXXWWDPINYJK-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000824566073 1137143118 /nfs/dbraw/zinc/14/31/18/1137143118.db2.gz FBEXXWWDPINYJK-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](Cc2ccc(C(N)=O)cc2)C2CC2)cc1Cl ZINC000824575964 1137143366 /nfs/dbraw/zinc/14/33/66/1137143366.db2.gz VVCHKWVCYXOMAO-UHFFFAOYSA-N 1 1 344.842 3.618 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)c1 ZINC000824690416 1137148373 /nfs/dbraw/zinc/14/83/73/1137148373.db2.gz FIERUXVVTIKFPX-QGZVFWFLSA-N 1 1 335.831 3.610 20 10 EHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3ccc(Br)cc3O)C2)cc1 ZINC000862540230 1137148842 /nfs/dbraw/zinc/14/88/42/1137148842.db2.gz BISRANLMUKIWRA-CYBMUJFWSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824893641 1137156034 /nfs/dbraw/zinc/15/60/34/1137156034.db2.gz XKZKPQQCWIJGNY-HIFRSBDPSA-N 1 1 339.838 3.966 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824893641 1137156037 /nfs/dbraw/zinc/15/60/37/1137156037.db2.gz XKZKPQQCWIJGNY-HIFRSBDPSA-N 1 1 339.838 3.966 20 10 EHCDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000825006166 1137160044 /nfs/dbraw/zinc/16/00/44/1137160044.db2.gz YWMPJXUMLFUVTC-GFCCVEGCSA-N 1 1 340.393 3.839 20 10 EHCDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3cc4c(cc3O)OCO4)C2)c1 ZINC000825289914 1137171808 /nfs/dbraw/zinc/17/18/08/1137171808.db2.gz KIOXYXBZLGIPBX-KOMQPUFPSA-N 1 1 341.407 3.508 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1 ZINC000825321994 1137172935 /nfs/dbraw/zinc/17/29/35/1137172935.db2.gz UJZHVNINXJGTDX-CYBMUJFWSA-N 1 1 342.277 3.712 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(Br)cc1O)c1nccs1 ZINC000825501155 1137179938 /nfs/dbraw/zinc/17/99/38/1137179938.db2.gz LRAKXJGAWKPCGZ-JTQLQIEISA-N 1 1 341.274 3.847 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)[C@H](C)c2nc3ccccc3o2)cc1 ZINC000844400497 1137217239 /nfs/dbraw/zinc/21/72/39/1137217239.db2.gz CRZHEHIHBVPYBN-OAHLLOKOSA-N 1 1 339.439 3.966 20 10 EHCDMO CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000844926426 1137263337 /nfs/dbraw/zinc/26/33/37/1137263337.db2.gz UDIGECPBKKTGKE-OAHLLOKOSA-N 1 1 341.293 3.585 20 10 EHCDMO C[C@@H](O)[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1F ZINC000846015652 1137326173 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/nfs/dbraw/zinc/68/42/01/1137684201.db2.gz XWBUFDGWOUCVEB-HNNXBMFYSA-N 1 1 332.831 3.540 20 10 EHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCc2ncnn21 ZINC000878326728 1137711014 /nfs/dbraw/zinc/71/10/14/1137711014.db2.gz UYTIHOUNPTZQHV-QFBILLFUSA-N 1 1 348.450 3.734 20 10 EHCDMO CCC[N@@H+](CC)CCNC(=O)c1cc(C)ccc1-n1c(C)ccc1C ZINC001137138587 1137730681 /nfs/dbraw/zinc/73/06/81/1137730681.db2.gz HLTBIJKIYHWPSB-UHFFFAOYSA-N 1 1 341.499 3.864 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000826090229 1137737435 /nfs/dbraw/zinc/73/74/35/1137737435.db2.gz WXIUFMCGKLZCAI-OAHLLOKOSA-N 1 1 335.488 3.681 20 10 EHCDMO COc1ccc(-c2noc([C@@H](C)[NH2+][C@H](C)c3ccccc3O)n2)cc1 ZINC000879648431 1137753703 /nfs/dbraw/zinc/75/37/03/1137753703.db2.gz ONZSRYBDHJHHKM-CHWSQXEVSA-N 1 1 339.395 3.863 20 10 EHCDMO c1csc(C[N@@H+](Cc2ccc(N3CCOCC3)cc2)C2CC2)c1 ZINC000130247386 1137835777 /nfs/dbraw/zinc/83/57/77/1137835777.db2.gz VHQLZUNGQRZPIO-UHFFFAOYSA-N 1 1 328.481 3.749 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H](c1cccs1)N1CCCC1 ZINC000882878797 1137836431 /nfs/dbraw/zinc/83/64/31/1137836431.db2.gz SPJSUNQXGWAJTK-OAHLLOKOSA-N 1 1 338.423 3.659 20 10 EHCDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)CCO2 ZINC000883090989 1137844361 /nfs/dbraw/zinc/84/43/61/1137844361.db2.gz AGCOCWJDXJGKPQ-INIZCTEOSA-N 1 1 335.350 3.683 20 10 EHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c2ccccc21 ZINC000883290953 1137852952 /nfs/dbraw/zinc/85/29/52/1137852952.db2.gz NYPCEWWVLVVAHQ-HTAPYJJXSA-N 1 1 335.495 3.777 20 10 EHCDMO CC(C)NC(=O)Nc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886508656 1138086424 /nfs/dbraw/zinc/08/64/24/1138086424.db2.gz JERSBVAZXFYDKL-CYBMUJFWSA-N 1 1 345.418 3.912 20 10 EHCDMO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1c(O)cccc1F ZINC000886615451 1138102441 /nfs/dbraw/zinc/10/24/41/1138102441.db2.gz GQQRZFXNDNFTRB-SNVBAGLBSA-N 1 1 328.309 3.838 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2cscc2Cl)c1 ZINC000886656599 1138108948 /nfs/dbraw/zinc/10/89/48/1138108948.db2.gz LJUSJTQUSGCNLW-VIFPVBQESA-N 1 1 325.817 3.745 20 10 EHCDMO C[C@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1c(O)cccc1F ZINC000886713349 1138123256 /nfs/dbraw/zinc/12/32/56/1138123256.db2.gz ZUWBRBCCIZIIQA-LSDHHAIUSA-N 1 1 337.435 3.548 20 10 EHCDMO Cn1nncc1C[N@@H+](Cc1c(O)ccc2ccccc21)C1CCCC1 ZINC000093315134 1138235799 /nfs/dbraw/zinc/23/57/99/1138235799.db2.gz WMAQMROXXAKKJQ-UHFFFAOYSA-N 1 1 336.439 3.619 20 10 EHCDMO COc1ccc(N2CC[NH+]([C@H](C)c3nc4ccccc4o3)CC2)cc1 ZINC000180905980 1139872549 /nfs/dbraw/zinc/87/25/49/1139872549.db2.gz DCXXRWLDQGAUBG-OAHLLOKOSA-N 1 1 337.423 3.720 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(F)cc1O ZINC000185157642 1140138206 /nfs/dbraw/zinc/13/82/06/1140138206.db2.gz YFAKCYMIGOYASO-QWHCGFSZSA-N 1 1 344.386 3.900 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc(N2CCOC2=O)c1 ZINC000185157607 1140138385 /nfs/dbraw/zinc/13/83/85/1140138385.db2.gz YFAKCYMIGOYASO-STQMWFEESA-N 1 1 344.386 3.900 20 10 EHCDMO COc1ccccc1N1CC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2O)C1 ZINC000185269271 1140142685 /nfs/dbraw/zinc/14/26/85/1140142685.db2.gz PWOPPGBRNZQFRZ-CABCVRRESA-N 1 1 344.430 3.717 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2[O-])c1 ZINC000187700456 1140268168 /nfs/dbraw/zinc/26/81/68/1140268168.db2.gz NIXUFMMLQIHYNU-ZDUSSCGKSA-N 1 1 334.410 3.973 20 10 EHCDMO CC[N@@H+](Cc1c(C)noc1C)Cc1cc(Br)ccc1O ZINC000266538762 1140700657 /nfs/dbraw/zinc/70/06/57/1140700657.db2.gz HYZASEWWAIPTFS-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cs1 ZINC000269426827 1141106998 /nfs/dbraw/zinc/10/69/98/1141106998.db2.gz OAJFVZZZIGLMCK-AWEZNQCLSA-N 1 1 345.512 3.511 20 10 EHCDMO Cc1nccn1CCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000269690421 1141136601 /nfs/dbraw/zinc/13/66/01/1141136601.db2.gz HWHALYXOVDRHPE-UHFFFAOYSA-N 1 1 326.488 3.704 20 10 EHCDMO COc1cccc(C[N@H+]2CCCCC[C@@H]2C[C@@H](O)c2ccco2)c1O ZINC000271232887 1141330040 /nfs/dbraw/zinc/33/00/40/1141330040.db2.gz CPLMVHJQFLRMQZ-IAGOWNOFSA-N 1 1 345.439 3.862 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1)c1nccs1 ZINC000271396456 1141357053 /nfs/dbraw/zinc/35/70/53/1141357053.db2.gz KWQFUMLNCVBASB-HZSPNIEDSA-N 1 1 349.475 3.747 20 10 EHCDMO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)[nH]1 ZINC000271599154 1141404470 /nfs/dbraw/zinc/40/44/70/1141404470.db2.gz ZLHABCWOHBAKLH-CABCVRRESA-N 1 1 327.476 3.769 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H](c3cc(C)n[nH]3)C2)c(O)c1 ZINC000283159230 1141564025 /nfs/dbraw/zinc/56/40/25/1141564025.db2.gz YCDNDRQWYBIVGD-HNNXBMFYSA-N 1 1 329.444 3.592 20 10 EHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@H](c3cc(C)[nH]n3)C2)c(O)c1 ZINC000283159230 1141564029 /nfs/dbraw/zinc/56/40/29/1141564029.db2.gz YCDNDRQWYBIVGD-HNNXBMFYSA-N 1 1 329.444 3.592 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H](c3cc(C)[nH]n3)C2)c(O)c1 ZINC000283159230 1141564035 /nfs/dbraw/zinc/56/40/35/1141564035.db2.gz YCDNDRQWYBIVGD-HNNXBMFYSA-N 1 1 329.444 3.592 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)cc(F)c1)C[C@@H]1CCCO1 ZINC000160168073 1014176939 /nfs/dbraw/zinc/17/69/39/1014176939.db2.gz CLDDANIZYHWKHR-SFHVURJKSA-N 1 1 333.378 3.852 20 10 EHCDMO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000160194789 1014310698 /nfs/dbraw/zinc/31/06/98/1014310698.db2.gz OWGKQFRXLDHISX-QGZVFWFLSA-N 1 1 343.471 3.594 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3cccs3)cc2F)CC1 ZINC000155267796 1016385050 /nfs/dbraw/zinc/38/50/50/1016385050.db2.gz MHHDQKAYWFFQDH-HNNXBMFYSA-N 1 1 347.503 3.880 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1C ZINC000066794770 1018027897 /nfs/dbraw/zinc/02/78/97/1018027897.db2.gz NNPZBTTVAQAZFL-LJQANCHMSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1C ZINC000066794770 1018027915 /nfs/dbraw/zinc/02/79/15/1018027915.db2.gz NNPZBTTVAQAZFL-LJQANCHMSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1noc(C[C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000897578838 1032815582 /nfs/dbraw/zinc/81/55/82/1032815582.db2.gz HQWLLESHNJFIEU-OAHLLOKOSA-N 1 1 337.423 3.692 20 10 EHCDMO Cc1ccccc1OCC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000096971021 1021078783 /nfs/dbraw/zinc/07/87/83/1021078783.db2.gz KFCFXSQREIZHLS-IBGZPJMESA-N 1 1 341.451 3.761 20 10 EHCDMO CCc1[nH]nc(Cl)c1C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000891467295 1021700341 /nfs/dbraw/zinc/70/03/41/1021700341.db2.gz FYQRORQIJAGFGO-AWEZNQCLSA-N 1 1 349.862 3.512 20 10 EHCDMO CCc1[nH]nc(Cl)c1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000891467295 1021700348 /nfs/dbraw/zinc/70/03/48/1021700348.db2.gz FYQRORQIJAGFGO-AWEZNQCLSA-N 1 1 349.862 3.512 20 10 EHCDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000894543862 1022517565 /nfs/dbraw/zinc/51/75/65/1022517565.db2.gz XBJUFRUIYMCSLO-ZDUSSCGKSA-N 1 1 345.443 3.991 20 10 EHCDMO NC(=O)c1csc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)c1 ZINC000156783422 1024580248 /nfs/dbraw/zinc/58/02/48/1024580248.db2.gz GLQMWMGUXUHOJC-UHFFFAOYSA-N 1 1 344.480 3.888 20 10 EHCDMO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3ccn(C)n3)cc2Cl)C1 ZINC000281899188 1025672377 /nfs/dbraw/zinc/67/23/77/1025672377.db2.gz FMSBVFBOGFXMJD-CQSZACIVSA-N 1 1 332.879 3.600 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1 ZINC000273364213 1027396113 /nfs/dbraw/zinc/39/61/13/1027396113.db2.gz AZAYVHXUHLDHJX-KDOFPFPSSA-N 1 1 342.439 3.930 20 10 EHCDMO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cc(OC)c1OC ZINC000273441954 1027428386 /nfs/dbraw/zinc/42/83/86/1027428386.db2.gz YVYZXBXSJDKFAI-VXGBXAGGSA-N 1 1 349.402 3.969 20 10 EHCDMO COC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708215989 1028968736 /nfs/dbraw/zinc/96/87/36/1028968736.db2.gz PWLDRXFJGXNQFN-LBPRGKRZSA-N 1 1 348.668 3.809 20 10 EHCDMO COC[C@@H]1CCCCN1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708215989 1028968748 /nfs/dbraw/zinc/96/87/48/1028968748.db2.gz PWLDRXFJGXNQFN-LBPRGKRZSA-N 1 1 348.668 3.809 20 10 EHCDMO c1cncc(O[C@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000093690677 1029337326 /nfs/dbraw/zinc/33/73/26/1029337326.db2.gz GBCUNQXNKYVMST-NRFANRHFSA-N 1 1 337.467 3.725 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(C)c(C)cc3O)CC2)cc1 ZINC000054570295 1030225005 /nfs/dbraw/zinc/22/50/05/1030225005.db2.gz SUROOUCBYMPXIO-UHFFFAOYSA-N 1 1 340.467 3.730 20 10 EHCDMO CCC[N@H+](Cc1nccn1CC(F)(F)F)Cc1ccccc1O ZINC000171383212 1030671564 /nfs/dbraw/zinc/67/15/64/1030671564.db2.gz PNZOOYOBMFURHN-UHFFFAOYSA-N 1 1 327.350 3.563 20 10 EHCDMO CCC[N@@H+](Cc1nccn1CC(F)(F)F)Cc1ccccc1O ZINC000171383212 1030671575 /nfs/dbraw/zinc/67/15/75/1030671575.db2.gz PNZOOYOBMFURHN-UHFFFAOYSA-N 1 1 327.350 3.563 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCc3sccc32)ccc1[N+](=O)[O-] ZINC000278492228 1031095900 /nfs/dbraw/zinc/09/59/00/1031095900.db2.gz LPESJQJMKHWHSO-GFCCVEGCSA-N 1 1 334.397 3.538 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cc(Br)ccc1F ZINC000708445748 1031575178 /nfs/dbraw/zinc/57/51/78/1031575178.db2.gz XYLRLZSNPBGMQF-UHFFFAOYSA-N 1 1 346.146 3.862 20 10 EHCDMO CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1[O-] ZINC000227433977 1034001036 /nfs/dbraw/zinc/00/10/36/1034001036.db2.gz QKXWJKBRVJIVDX-CYBMUJFWSA-N 1 1 343.309 3.755 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)c1O ZINC000761203001 1034407170 /nfs/dbraw/zinc/40/71/70/1034407170.db2.gz HRWYIEXODNCWPE-PXAZEXFGSA-N 1 1 347.842 3.878 20 10 EHCDMO C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)Cc1ccccc1O ZINC000171926243 1034712283 /nfs/dbraw/zinc/71/22/83/1034712283.db2.gz MGIRLMJQAFGZAA-UHFFFAOYSA-N 1 1 325.330 3.965 20 10 EHCDMO OC[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000761225691 1034806161 /nfs/dbraw/zinc/80/61/61/1034806161.db2.gz HCOPPQPIYRQFSK-SFHVURJKSA-N 1 1 331.843 3.819 20 10 EHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000761225280 1034810424 /nfs/dbraw/zinc/81/04/24/1034810424.db2.gz BBIXUUKEQPNUCM-LJQANCHMSA-N 1 1 328.431 3.628 20 10 EHCDMO CCN(Cc1cc(F)ccc1O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000761225280 1034810430 /nfs/dbraw/zinc/81/04/30/1034810430.db2.gz BBIXUUKEQPNUCM-LJQANCHMSA-N 1 1 328.431 3.628 20 10 EHCDMO CCN(Cc1cc(F)ccc1O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000761225280 1034810434 /nfs/dbraw/zinc/81/04/34/1034810434.db2.gz BBIXUUKEQPNUCM-LJQANCHMSA-N 1 1 328.431 3.628 20 10 EHCDMO COc1cccc([C@H]2C[N@@H+](Cc3cc(C)c(C)cc3O)CCO2)c1 ZINC000166163937 1036935649 /nfs/dbraw/zinc/93/56/49/1036935649.db2.gz ULDJWIWMBGIKFW-HXUWFJFHSA-N 1 1 327.424 3.591 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@@]3(C)COC(=O)N3)C2)cc1C(C)C ZINC000905707662 1039046100 /nfs/dbraw/zinc/04/61/00/1039046100.db2.gz LBAFMEJAWIKPDI-OXQOHEQNSA-N 1 1 346.471 3.535 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)c(C)s1 ZINC000898450429 1039049077 /nfs/dbraw/zinc/04/90/77/1039049077.db2.gz RIPSGSYACHRNAM-FZKQIMNGSA-N 1 1 346.544 3.779 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cc(F)cc(F)c1O)C[C@@H]1CCCO1 ZINC000893879804 1039785516 /nfs/dbraw/zinc/78/55/16/1039785516.db2.gz JNSMCHFFMNWKBO-INIZCTEOSA-N 1 1 349.377 3.557 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)cc(F)c1O)C[C@@H]1CCCO1 ZINC000893879804 1039785528 /nfs/dbraw/zinc/78/55/28/1039785528.db2.gz JNSMCHFFMNWKBO-INIZCTEOSA-N 1 1 349.377 3.557 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)CCN1Cc1ccccc1 ZINC000080338646 1041159225 /nfs/dbraw/zinc/15/92/25/1041159225.db2.gz YHSDSXOQNBFBAS-UTKZUKDTSA-N 1 1 336.479 3.764 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000164276760 1041232491 /nfs/dbraw/zinc/23/24/91/1041232491.db2.gz IHZRLBGPOMKZIM-HNAYVOBHSA-N 1 1 327.424 3.671 20 10 EHCDMO CCC[N@@H+](Cc1ccc2c(c1)sc(=O)n2C)Cc1ccccc1O ZINC000194997423 1041363280 /nfs/dbraw/zinc/36/32/80/1041363280.db2.gz AYEDZWYEEQNVEA-UHFFFAOYSA-N 1 1 342.464 3.718 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000278838016 1041595649 /nfs/dbraw/zinc/59/56/49/1041595649.db2.gz JNIHVQSWKQJXHY-JTQLQIEISA-N 1 1 336.775 3.813 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](c3ccc(C)cc3)C2)c(O)c1OC ZINC000893532705 1042396946 /nfs/dbraw/zinc/39/69/46/1042396946.db2.gz WOKXYVSYBQLGRC-INIZCTEOSA-N 1 1 327.424 3.707 20 10 EHCDMO CNC(=O)C1CCC([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000278898700 1042875770 /nfs/dbraw/zinc/87/57/70/1042875770.db2.gz ZFZPQKXGEGLTBB-KPPDAEKUSA-N 1 1 345.270 3.654 20 10 EHCDMO CC[N@@H+](Cc1ccc(Cl)s1)Cc1cc2c(cc1O)OCO2 ZINC000008039803 1042934790 /nfs/dbraw/zinc/93/47/90/1042934790.db2.gz VEXSESVSSLOPRP-UHFFFAOYSA-N 1 1 325.817 3.858 20 10 EHCDMO c1csc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)c1 ZINC000162696310 1043766262 /nfs/dbraw/zinc/76/62/62/1043766262.db2.gz HKKVVCBCJFMNFN-GOSISDBHSA-N 1 1 328.481 3.922 20 10 EHCDMO C[C@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000184967793 1126723822 /nfs/dbraw/zinc/72/38/22/1126723822.db2.gz VLIGYLZUSCUKOJ-AWEZNQCLSA-N 1 1 325.387 3.610 20 10 EHCDMO CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000764898645 1127549642 /nfs/dbraw/zinc/54/96/42/1127549642.db2.gz NZFYPHRLULCMDP-HXUWFJFHSA-N 1 1 343.515 3.508 20 10 EHCDMO 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COC(=O)c1oc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cc1C ZINC001181555186 1133500339 /nfs/dbraw/zinc/50/03/39/1133500339.db2.gz JNXIVUBOLXJAAQ-UHFFFAOYSA-N 1 1 342.439 3.607 20 10 EHCDMO CCC[N@H+](CC)C[C@@H](C)NCc1cc(Br)cc(C)c1O ZINC001182126854 1133575087 /nfs/dbraw/zinc/57/50/87/1133575087.db2.gz KGDVCXQVNHVVPN-CYBMUJFWSA-N 1 1 343.309 3.673 20 10 EHCDMO CCC[N@@H+](CC)C[C@@H](C)NCc1cc(Br)cc(C)c1O ZINC001182126854 1133575092 /nfs/dbraw/zinc/57/50/92/1133575092.db2.gz KGDVCXQVNHVVPN-CYBMUJFWSA-N 1 1 343.309 3.673 20 10 EHCDMO COC(=O)c1cccc2c1CC[N@H+](Cc1c(O)cc(C)cc1Cl)C2 ZINC001182196158 1133590389 /nfs/dbraw/zinc/59/03/89/1133590389.db2.gz NUDZGLCETQPGAU-UHFFFAOYSA-N 1 1 345.826 3.699 20 10 EHCDMO COC(=O)c1cccc2c1CC[N@@H+](Cc1c(O)cc(C)cc1Cl)C2 ZINC001182196158 1133590394 /nfs/dbraw/zinc/59/03/94/1133590394.db2.gz NUDZGLCETQPGAU-UHFFFAOYSA-N 1 1 345.826 3.699 20 10 EHCDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000771865808 1133603151 /nfs/dbraw/zinc/60/31/51/1133603151.db2.gz ZFZPXFMPOCQLLG-CQSZACIVSA-N 1 1 339.391 3.819 20 10 EHCDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000771866132 1133603513 /nfs/dbraw/zinc/60/35/13/1133603513.db2.gz CTGFNDSRMFZPPF-ZDUSSCGKSA-N 1 1 343.423 3.545 20 10 EHCDMO C[C@H](Cc1cnccn1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774154174 1133624885 /nfs/dbraw/zinc/62/48/85/1133624885.db2.gz AKWBRDSXRQCIGO-ZJUUUORDSA-N 1 1 326.227 3.771 20 10 EHCDMO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163575 1133626588 /nfs/dbraw/zinc/62/65/88/1133626588.db2.gz RZLHKKJBVPVLOL-DKUWSORSSA-N 1 1 348.490 3.907 20 10 EHCDMO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163575 1133626592 /nfs/dbraw/zinc/62/65/92/1133626592.db2.gz RZLHKKJBVPVLOL-DKUWSORSSA-N 1 1 348.490 3.907 20 10 EHCDMO CCC(O)(CC)C[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC001183197666 1133778510 /nfs/dbraw/zinc/77/85/10/1133778510.db2.gz ZLBSHXFHGDZGAM-UHFFFAOYSA-N 1 1 343.467 3.954 20 10 EHCDMO CC(C)[N@H+]1CCCC[C@H]1CN(Cc1ccccc1O)C[C@H]1CCCO1 ZINC000787729534 1134036036 /nfs/dbraw/zinc/03/60/36/1134036036.db2.gz IZSNLNWWLQSMDT-VQTJNVASSA-N 1 1 346.515 3.636 20 10 EHCDMO CC(C)N1CCCC[C@H]1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000787729534 1134036043 /nfs/dbraw/zinc/03/60/43/1134036043.db2.gz IZSNLNWWLQSMDT-VQTJNVASSA-N 1 1 346.515 3.636 20 10 EHCDMO CC(C)N1CCCC[C@H]1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000787729534 1134036047 /nfs/dbraw/zinc/03/60/47/1134036047.db2.gz IZSNLNWWLQSMDT-VQTJNVASSA-N 1 1 346.515 3.636 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000774834986 1134037645 /nfs/dbraw/zinc/03/76/45/1134037645.db2.gz HLKLEWUBUJYXPO-HNNXBMFYSA-N 1 1 328.368 3.646 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000774874935 1134083058 /nfs/dbraw/zinc/08/30/58/1134083058.db2.gz PYWTVQNSBPKZSU-AWEZNQCLSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000774874935 1134083066 /nfs/dbraw/zinc/08/30/66/1134083066.db2.gz PYWTVQNSBPKZSU-AWEZNQCLSA-N 1 1 342.395 3.607 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cccc(C(F)(F)F)c1O ZINC000788526341 1134143249 /nfs/dbraw/zinc/14/32/49/1134143249.db2.gz PTDUZJQBBRPIPM-YGRLFVJLSA-N 1 1 339.361 3.873 20 10 EHCDMO C[C@@H]([NH2+]CCCNc1ccccn1)c1cccc(C(F)(F)F)c1O ZINC000788629381 1134153890 /nfs/dbraw/zinc/15/38/90/1134153890.db2.gz UHQWLCJJRAYHPT-GFCCVEGCSA-N 1 1 339.361 3.959 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774961935 1134155561 /nfs/dbraw/zinc/15/55/61/1134155561.db2.gz GLZDBAPLHBETDJ-INIZCTEOSA-N 1 1 344.411 3.838 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000788778618 1134174570 /nfs/dbraw/zinc/17/45/70/1134174570.db2.gz XXSZUXNSNJQLOV-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12 ZINC000790980182 1134495538 /nfs/dbraw/zinc/49/55/38/1134495538.db2.gz JQXXJMPSJADCLC-MPKXVKKWSA-N 1 1 333.881 3.654 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCN(c3cccc4cnccc43)C[C@H]2C)c1O ZINC000775203447 1134512789 /nfs/dbraw/zinc/51/27/89/1134512789.db2.gz KVMRZTPVTSOTFT-QGZVFWFLSA-N 1 1 347.462 3.960 20 10 EHCDMO CCCc1nc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 ZINC000775256145 1134592522 /nfs/dbraw/zinc/59/25/22/1134592522.db2.gz VZPOBTBQMTTWJL-HNNXBMFYSA-N 1 1 345.512 3.783 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000792162121 1134655164 /nfs/dbraw/zinc/65/51/64/1134655164.db2.gz FLTDHZBIMYHLAQ-UHFFFAOYSA-N 1 1 338.499 3.768 20 10 EHCDMO Cc1cc([NH+]2CCCCC2)ccc1NCC(=O)c1ccc(O)c(O)c1 ZINC001170320666 1134746766 /nfs/dbraw/zinc/74/67/66/1134746766.db2.gz IAZWMKREESAQIB-UHFFFAOYSA-N 1 1 340.423 3.691 20 10 EHCDMO CN(C)c1ccc(CN[C@H]2CCC[C@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002783 1134837635 /nfs/dbraw/zinc/83/76/35/1134837635.db2.gz BWOBXWKYKPAFCE-GJZGRUSLSA-N 1 1 343.437 3.734 20 10 EHCDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793190716 1134872196 /nfs/dbraw/zinc/87/21/96/1134872196.db2.gz WESBPROGOJLLIO-BBRMVZONSA-N 1 1 344.421 3.897 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCO[C@]3(CCO[C@H]3C)C2)cc1 ZINC000793230305 1134878408 /nfs/dbraw/zinc/87/84/08/1134878408.db2.gz FVKIAONNUCKPGZ-GHTZIAJQSA-N 1 1 346.515 3.693 20 10 EHCDMO CO[C@]1(C)CCC[N@H+](Cc2cccc(Br)c2O)CC1 ZINC000793341374 1134901952 /nfs/dbraw/zinc/90/19/52/1134901952.db2.gz SSXHTZOKIIROOQ-OAHLLOKOSA-N 1 1 328.250 3.546 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cccc(Br)c2O)CC1 ZINC000793341374 1134901954 /nfs/dbraw/zinc/90/19/54/1134901954.db2.gz SSXHTZOKIIROOQ-OAHLLOKOSA-N 1 1 328.250 3.546 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000793609637 1134971763 /nfs/dbraw/zinc/97/17/63/1134971763.db2.gz QLHZEYRFZWHZKU-CABCVRRESA-N 1 1 340.261 3.607 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000793609637 1134971771 /nfs/dbraw/zinc/97/17/71/1134971771.db2.gz QLHZEYRFZWHZKU-CABCVRRESA-N 1 1 340.261 3.607 20 10 EHCDMO CC[N@@H+](CCOC1CCC1)Cc1cc(Br)ccc1O ZINC000805743417 1135324067 /nfs/dbraw/zinc/32/40/67/1135324067.db2.gz UAPBHAITLXMJEU-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCCc3cc(OC)ccc32)c1 ZINC000775651009 1135415947 /nfs/dbraw/zinc/41/59/47/1135415947.db2.gz JNEOILFTRLOOBY-IBGZPJMESA-N 1 1 327.424 3.919 20 10 EHCDMO Cc1ccc([C@H](C)[N@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000775650007 1135417097 /nfs/dbraw/zinc/41/70/97/1135417097.db2.gz WOHQWYSRXPEYFI-IBGZPJMESA-N 1 1 337.511 3.940 20 10 EHCDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000775650007 1135417099 /nfs/dbraw/zinc/41/70/99/1135417099.db2.gz WOHQWYSRXPEYFI-IBGZPJMESA-N 1 1 337.511 3.940 20 10 EHCDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000101905949 1135418328 /nfs/dbraw/zinc/41/83/28/1135418328.db2.gz QTZGHLVNWPUYIJ-QGZVFWFLSA-N 1 1 346.515 3.952 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)c1O ZINC000775725976 1135577421 /nfs/dbraw/zinc/57/74/21/1135577421.db2.gz NMAVMSGCHXKOOJ-SJORKVTESA-N 1 1 346.471 3.674 20 10 EHCDMO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3cn(C)cn3)cc2Cl)C1 ZINC000808411734 1135664776 /nfs/dbraw/zinc/66/47/76/1135664776.db2.gz IONURMOSEUJYFP-CQSZACIVSA-N 1 1 332.879 3.600 20 10 EHCDMO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000808444582 1135668645 /nfs/dbraw/zinc/66/86/45/1135668645.db2.gz OLZDKBPONZSCMN-ZUZCIYMTSA-N 1 1 334.213 3.767 20 10 EHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2n[nH]cc2Br)c1O ZINC000808697822 1135725742 /nfs/dbraw/zinc/72/57/42/1135725742.db2.gz WMLIVFMQBFIKCY-QMMMGPOBSA-N 1 1 344.640 3.690 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cnc([C@H](C)O)s2)cc1 ZINC000809540804 1135849105 /nfs/dbraw/zinc/84/91/05/1135849105.db2.gz IUDKCRLNEDVWQO-AWEZNQCLSA-N 1 1 333.501 3.675 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnc([C@H](C)O)s2)cc1 ZINC000809540804 1135849109 /nfs/dbraw/zinc/84/91/09/1135849109.db2.gz IUDKCRLNEDVWQO-AWEZNQCLSA-N 1 1 333.501 3.675 20 10 EHCDMO Fc1cc(C[N@H+]2CCC=C(c3ccco3)C2)ccc1N1CCOCC1 ZINC000809689119 1135872188 /nfs/dbraw/zinc/87/21/88/1135872188.db2.gz UXDYFCJMMWKUKS-UHFFFAOYSA-N 1 1 342.414 3.545 20 10 EHCDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1c(O)cccc1Cl ZINC000809772449 1135881194 /nfs/dbraw/zinc/88/11/94/1135881194.db2.gz XTLKGZFEGJYTRE-FZMZJTMJSA-N 1 1 340.851 3.533 20 10 EHCDMO C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001199328689 1135898078 /nfs/dbraw/zinc/89/80/78/1135898078.db2.gz DLCXVKQQNNPRBD-BETUJISGSA-N 1 1 328.859 3.642 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000810209794 1135943287 /nfs/dbraw/zinc/94/32/87/1135943287.db2.gz VVCBOEXVWSOIFM-MLGOLLRUSA-N 1 1 342.405 3.936 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810209794 1135943291 /nfs/dbraw/zinc/94/32/91/1135943291.db2.gz VVCBOEXVWSOIFM-MLGOLLRUSA-N 1 1 342.405 3.936 20 10 EHCDMO C[C@@H](CCNCc1ccc(N(C)C)c(F)c1)[N@H+](C)Cc1ccccc1 ZINC001200940982 1135971246 /nfs/dbraw/zinc/97/12/46/1135971246.db2.gz BQTYIMONFOKYJP-KRWDZBQOSA-N 1 1 343.490 3.892 20 10 EHCDMO C[C@@H](CCNCc1ccc(N(C)C)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC001200940982 1135971249 /nfs/dbraw/zinc/97/12/49/1135971249.db2.gz BQTYIMONFOKYJP-KRWDZBQOSA-N 1 1 343.490 3.892 20 10 EHCDMO CC(C)Nc1ccc(Nc2ccccc2C[NH+]2CCN(C)CC2)cc1 ZINC001201497545 1136028884 /nfs/dbraw/zinc/02/88/84/1136028884.db2.gz HCHHPMBKIQBNDS-UHFFFAOYSA-N 1 1 338.499 3.998 20 10 EHCDMO COc1ccc(N2CCOC[C@@]3(CCC[N@@H+](CCC(C)C)C3)C2)cc1 ZINC001201614924 1136047272 /nfs/dbraw/zinc/04/72/72/1136047272.db2.gz PIKVLIDQVLDPNJ-OAQYLSRUSA-N 1 1 346.515 3.660 20 10 EHCDMO Oc1ccccc1C[N@@H+](CC1Cc2ccccc2C1)C[C@H]1CCCO1 ZINC000811454247 1136089011 /nfs/dbraw/zinc/08/90/11/1136089011.db2.gz XUQUAJUBXILADP-OAQYLSRUSA-N 1 1 337.463 3.788 20 10 EHCDMO COc1ccc2c(c1)CCCCN2Cc1ncc(C[NH+](C)C)s1 ZINC000811508560 1136102523 /nfs/dbraw/zinc/10/25/23/1136102523.db2.gz WSDPXJJAXZHGLS-UHFFFAOYSA-N 1 1 331.485 3.556 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000811512204 1136103313 /nfs/dbraw/zinc/10/33/13/1136103313.db2.gz HFMDJTQKFTZBRZ-OAQYLSRUSA-N 1 1 339.435 3.761 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@@H]1CCOC(C)(C)C1 ZINC000811511962 1136103317 /nfs/dbraw/zinc/10/33/17/1136103317.db2.gz YLLFMEGZBIIIRA-CQSZACIVSA-N 1 1 342.277 3.934 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)[C@@H]1CCOC1 ZINC000812777040 1136245915 /nfs/dbraw/zinc/24/59/15/1136245915.db2.gz VEKBCANUZUNVRG-OAHLLOKOSA-N 1 1 330.394 3.771 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2C(C)(C)C2(F)F)c1 ZINC000850394285 1136248321 /nfs/dbraw/zinc/24/83/21/1136248321.db2.gz ORVDMFNHWZPGOB-NSHDSACASA-N 1 1 334.204 3.844 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](CO)c2ccc(F)cc2F)cc1 ZINC000850410481 1136252200 /nfs/dbraw/zinc/25/22/00/1136252200.db2.gz NEQZLMVDAFVMHR-LJQANCHMSA-N 1 1 334.410 3.634 20 10 EHCDMO CC[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C[C@H](C)OC ZINC000812806953 1136254341 /nfs/dbraw/zinc/25/43/41/1136254341.db2.gz ASFGUABXSYNYHV-INIZCTEOSA-N 1 1 329.440 3.828 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000850483437 1136267365 /nfs/dbraw/zinc/26/73/65/1136267365.db2.gz YQUCHHKZCBCHRV-NEPJUHHUSA-N 1 1 330.394 3.934 20 10 EHCDMO CCOC(=O)CC(C)(C)C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000813334736 1136319682 /nfs/dbraw/zinc/31/96/82/1136319682.db2.gz XASQHSYSFRKZBU-UHFFFAOYSA-N 1 1 345.439 3.967 20 10 EHCDMO CCOC[C@H]1CC[N@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000747966508 1136486871 /nfs/dbraw/zinc/48/68/71/1136486871.db2.gz IXCQSWRRXBKFER-SFHVURJKSA-N 1 1 340.467 3.635 20 10 EHCDMO CCOC[C@H]1CC[N@@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000747966508 1136486874 /nfs/dbraw/zinc/48/68/74/1136486874.db2.gz IXCQSWRRXBKFER-SFHVURJKSA-N 1 1 340.467 3.635 20 10 EHCDMO CCc1ccc([C@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000111235239 1136524574 /nfs/dbraw/zinc/52/45/74/1136524574.db2.gz HRNDOUQSYQVTNV-HOTGVXAUSA-N 1 1 340.467 3.652 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC4(CCC4)OC[C@@H]3C)c2c1 ZINC000853542020 1136542761 /nfs/dbraw/zinc/54/27/61/1136542761.db2.gz KSKPSMZNLBQLSJ-AWEZNQCLSA-N 1 1 327.424 3.697 20 10 EHCDMO COc1cccc([C@@H]2C[N@H+](Cc3ccc(N(C)C)c(C)c3)CCO2)c1 ZINC000815062252 1136545781 /nfs/dbraw/zinc/54/57/81/1136545781.db2.gz QPNWVDNTXDKGGN-NRFANRHFSA-N 1 1 340.467 3.643 20 10 EHCDMO COc1cccc([C@@H]2C[N@@H+](Cc3ccc(N(C)C)c(C)c3)CCO2)c1 ZINC000815062252 1136545784 /nfs/dbraw/zinc/54/57/84/1136545784.db2.gz QPNWVDNTXDKGGN-NRFANRHFSA-N 1 1 340.467 3.643 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cc(C(F)(F)F)ccn1 ZINC000815149111 1136562731 /nfs/dbraw/zinc/56/27/31/1136562731.db2.gz ZZQHFABELDYLGS-UHFFFAOYSA-N 1 1 348.727 3.931 20 10 EHCDMO C[C@H]([NH2+]CCCOC[C@@H]1CCOC1)c1cccc(C(F)(F)F)c1O ZINC000815582601 1136614559 /nfs/dbraw/zinc/61/45/59/1136614559.db2.gz KRQMPDRMBIENEV-STQMWFEESA-N 1 1 347.377 3.505 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815576427 1136618487 /nfs/dbraw/zinc/61/84/87/1136618487.db2.gz QEENKFOPLIHYFI-GXTWGEPZSA-N 1 1 339.357 3.665 20 10 EHCDMO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1O ZINC000815637257 1136624174 /nfs/dbraw/zinc/62/41/74/1136624174.db2.gz RAZCFXLCAOBSPG-SNVBAGLBSA-N 1 1 328.309 3.838 20 10 EHCDMO Oc1c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521253 1136727022 /nfs/dbraw/zinc/72/70/22/1136727022.db2.gz KRMPHLQOUIKEAU-DYESRHJHSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521253 1136727024 /nfs/dbraw/zinc/72/70/24/1136727024.db2.gz KRMPHLQOUIKEAU-DYESRHJHSA-N 1 1 336.479 3.994 20 10 EHCDMO Cn1cc(-c2ccccc2C[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000816559926 1136736994 /nfs/dbraw/zinc/73/69/94/1136736994.db2.gz ZGRFKKVQTCYTSF-UHFFFAOYSA-N 1 1 345.805 3.875 20 10 EHCDMO CC(C)OC(=O)C[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816569896 1136738410 /nfs/dbraw/zinc/73/84/10/1136738410.db2.gz AGGHMMZLGHJHON-GFCCVEGCSA-N 1 1 343.826 3.738 20 10 EHCDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816569896 1136738413 /nfs/dbraw/zinc/73/84/13/1136738413.db2.gz AGGHMMZLGHJHON-GFCCVEGCSA-N 1 1 343.826 3.738 20 10 EHCDMO C[C@@H]1C[C@]2(CCO1)C[N@@H+](Cc1ccc3ccccc3c1O)C[C@H](C)O2 ZINC000816598216 1136739659 /nfs/dbraw/zinc/73/96/59/1136739659.db2.gz SZLZLODJKUYLCJ-VWKPWSFCSA-N 1 1 341.451 3.704 20 10 EHCDMO COC1([C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000817586718 1136825955 /nfs/dbraw/zinc/82/59/55/1136825955.db2.gz AGTZFDWWEJAHNS-NEPJUHHUSA-N 1 1 347.377 3.646 20 10 EHCDMO COC1([C@H](C)[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CCOCC1 ZINC000817588087 1136826519 /nfs/dbraw/zinc/82/65/19/1136826519.db2.gz LOJGEJYTNNNHKZ-QWRGUYRKSA-N 1 1 348.270 3.934 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000817938744 1136847396 /nfs/dbraw/zinc/84/73/96/1136847396.db2.gz RFHIWOCSRTUEIC-MSOLQXFVSA-N 1 1 345.487 3.718 20 10 EHCDMO Nc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H]3CCC[C@H]32)cc1 ZINC000817957344 1136851732 /nfs/dbraw/zinc/85/17/32/1136851732.db2.gz LCKRVBOPWMMDMS-YTFSRNRJSA-N 1 1 349.522 3.844 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000818358295 1136875931 /nfs/dbraw/zinc/87/59/31/1136875931.db2.gz SXOQBPUUFOLNGH-VXGBXAGGSA-N 1 1 334.441 3.664 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1c2ccccc2CN(C)C1=O)c1ccc(N(C)C)cc1 ZINC000857875036 1136916606 /nfs/dbraw/zinc/91/66/06/1136916606.db2.gz UPAFLACANVRBMA-WOJBJXKFSA-N 1 1 337.467 3.507 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](OC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000858443941 1136968275 /nfs/dbraw/zinc/96/82/75/1136968275.db2.gz XEABKRCUCLBOEL-PKOBYXMFSA-N 1 1 333.403 3.968 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cc(CO)ccc1F ZINC000859059973 1137001566 /nfs/dbraw/zinc/00/15/66/1137001566.db2.gz MCXQQSPFAARZJC-UHFFFAOYSA-N 1 1 342.458 3.940 20 10 EHCDMO COC(=O)c1occc1C[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC000862528486 1137148020 /nfs/dbraw/zinc/14/80/20/1137148020.db2.gz WUALCKOBHSJNES-UHFFFAOYSA-N 1 1 338.407 3.764 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCO[C@H](CCF)C1 ZINC000862529401 1137148348 /nfs/dbraw/zinc/14/83/48/1137148348.db2.gz DFBRZJWACKRBAS-LJQANCHMSA-N 1 1 345.414 3.532 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@H](CCF)C1 ZINC000862529401 1137148349 /nfs/dbraw/zinc/14/83/49/1137148349.db2.gz DFBRZJWACKRBAS-LJQANCHMSA-N 1 1 345.414 3.532 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000824855680 1137154708 /nfs/dbraw/zinc/15/47/08/1137154708.db2.gz ORIGYRIROUUZNV-MRXNPFEDSA-N 1 1 340.261 3.547 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824952670 1137159199 /nfs/dbraw/zinc/15/91/99/1137159199.db2.gz DGPCUSKOJDXESK-CXAGYDPISA-N 1 1 336.794 3.590 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c(O)cc1C ZINC000863303665 1137180485 /nfs/dbraw/zinc/18/04/85/1137180485.db2.gz YEZXBWMTKAKQLT-GDBMZVCRSA-N 1 1 349.471 3.509 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C4CC4)O[C@@H](C)C3)c2c1 ZINC000794646867 1137221080 /nfs/dbraw/zinc/22/10/80/1137221080.db2.gz KMPLKRATGSDYNA-RBZFPXEDSA-N 1 1 327.424 3.553 20 10 EHCDMO Oc1cc(O)c(C[N@@H+](Cc2ccccc2)C2CCSCC2)c(O)c1 ZINC001144515838 1137304424 /nfs/dbraw/zinc/30/44/24/1137304424.db2.gz GPSOKYRZAMWAEV-UHFFFAOYSA-N 1 1 345.464 3.701 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](C[C@H]3CCOC3)C1)CCCC2 ZINC000773263060 1137481953 /nfs/dbraw/zinc/48/19/53/1137481953.db2.gz PJVDFPYPKGOOQD-IAGOWNOFSA-N 1 1 329.484 3.910 20 10 EHCDMO COc1ccccc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000123496688 1137523519 /nfs/dbraw/zinc/52/35/19/1137523519.db2.gz QJIXDNQYLRPPBZ-GOSISDBHSA-N 1 1 327.424 3.582 20 10 EHCDMO CCCOc1ccc(C[NH2+]C(C)(C)c2cn(C(C)C)nn2)cc1C ZINC000873132560 1137590854 /nfs/dbraw/zinc/59/08/54/1137590854.db2.gz XNYWGQBMKHUZRS-UHFFFAOYSA-N 1 1 330.476 3.981 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc2nccnc2c1)C[C@@H]1CCCO1 ZINC000876532087 1137654750 /nfs/dbraw/zinc/65/47/50/1137654750.db2.gz XVQPIQODDQJRFL-SFHVURJKSA-N 1 1 349.434 3.517 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccc(F)cc1F ZINC000876559817 1137655570 /nfs/dbraw/zinc/65/55/70/1137655570.db2.gz HCIZTEQEXDRXDQ-UHFFFAOYSA-N 1 1 346.421 3.558 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccc(F)cc1F ZINC000876559817 1137655571 /nfs/dbraw/zinc/65/55/71/1137655571.db2.gz HCIZTEQEXDRXDQ-UHFFFAOYSA-N 1 1 346.421 3.558 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@@H]1c1ccccc1 ZINC000876793978 1137661524 /nfs/dbraw/zinc/66/15/24/1137661524.db2.gz JZBVRHFILUPKHK-VGSWGCGISA-N 1 1 336.479 3.841 20 10 EHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876797263 1137661675 /nfs/dbraw/zinc/66/16/75/1137661675.db2.gz SXIUQHGLSLJYSJ-QUCCMNQESA-N 1 1 348.556 3.754 20 10 EHCDMO C[NH+](C)CCCOc1cccc(NCc2ccc(F)c(F)c2O)c1 ZINC000876860783 1137663936 /nfs/dbraw/zinc/66/39/36/1137663936.db2.gz JKCUJBGSDNWINE-UHFFFAOYSA-N 1 1 336.382 3.613 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nc(C2CCC2)no1)C1CCCC1 ZINC000878103969 1137702469 /nfs/dbraw/zinc/70/24/69/1137702469.db2.gz PEBDKCCDCBJGEY-UHFFFAOYSA-N 1 1 327.428 3.988 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(NC(=O)C2CC2)cc1 ZINC000882882256 1137836789 /nfs/dbraw/zinc/83/67/89/1137836789.db2.gz BBTZFVHLTSSERR-LLVKDONJSA-N 1 1 346.377 3.870 20 10 EHCDMO COc1cc(F)c([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC000882999878 1137841035 /nfs/dbraw/zinc/84/10/35/1137841035.db2.gz CIVVHKSVIPSEGG-VIFPVBQESA-N 1 1 341.329 3.678 20 10 EHCDMO OC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(C(F)(F)F)cc1 ZINC000883077422 1137843674 /nfs/dbraw/zinc/84/36/74/1137843674.db2.gz JJZVXLNQEDHWPZ-CQSZACIVSA-N 1 1 347.283 3.512 20 10 EHCDMO COc1ccc(C(C)(C)[NH2+]Cc2cc(F)cc(F)c2O)cc1F ZINC000883188446 1137847718 /nfs/dbraw/zinc/84/77/18/1137847718.db2.gz KJXIRFMYFSJGME-UHFFFAOYSA-N 1 1 325.330 3.843 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(C(F)(F)F)nc1 ZINC000883204114 1137848356 /nfs/dbraw/zinc/84/83/56/1137848356.db2.gz SJXPTHXXRWGDSO-QMMMGPOBSA-N 1 1 332.272 3.935 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccccc2N2CCCC2)c1O ZINC000121237203 1137956126 /nfs/dbraw/zinc/95/61/26/1137956126.db2.gz FCXAVHIBOXNMNX-UHFFFAOYSA-N 1 1 326.440 3.633 20 10 EHCDMO COc1cc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc(OC)c1OC ZINC000886504137 1138085230 /nfs/dbraw/zinc/08/52/30/1138085230.db2.gz SPIRTBBKVDPJSN-NWDGAFQWSA-N 1 1 349.402 3.969 20 10 EHCDMO CCC[N@H+](Cc1nc([C@@H](C)OCC(C)C)no1)Cc1ccccc1O ZINC000080633279 1138163719 /nfs/dbraw/zinc/16/37/19/1138163719.db2.gz DPJIPHQXVALTPB-OAHLLOKOSA-N 1 1 347.459 3.921 20 10 EHCDMO CCC[N@@H+](Cc1nc([C@@H](C)OCC(C)C)no1)Cc1ccccc1O ZINC000080633279 1138163720 /nfs/dbraw/zinc/16/37/20/1138163720.db2.gz DPJIPHQXVALTPB-OAHLLOKOSA-N 1 1 347.459 3.921 20 10 EHCDMO COc1ccc(O)c(C[N@H+](Cc2ccccc2)CC2CCOCC2)c1 ZINC000180203798 1139817224 /nfs/dbraw/zinc/81/72/24/1139817224.db2.gz DIZTYJNVJLYLPG-UHFFFAOYSA-N 1 1 341.451 3.830 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1O ZINC000180798515 1139863468 /nfs/dbraw/zinc/86/34/68/1139863468.db2.gz DJBRXZSLANBZSD-AWEZNQCLSA-N 1 1 339.361 3.753 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccnc(OCC(F)(F)F)c1)c1ccc(F)cc1O ZINC000185018923 1140131864 /nfs/dbraw/zinc/13/18/64/1140131864.db2.gz QTPBEFPFBJEYGI-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc(F)cc1O ZINC000185054378 1140133789 /nfs/dbraw/zinc/13/37/89/1140133789.db2.gz WCDAQAAWZATMMJ-CQSZACIVSA-N 1 1 329.419 3.767 20 10 EHCDMO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185478837 1140152136 /nfs/dbraw/zinc/15/21/36/1140152136.db2.gz HXFONSZKOUXFDS-YJYMSZOUSA-N 1 1 333.403 3.703 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000186232164 1140193727 /nfs/dbraw/zinc/19/37/27/1140193727.db2.gz WCSRMWZJVHPHOR-AJPKGMEUSA-N 1 1 337.341 3.990 20 10 EHCDMO Cn1cc([C@H]2CSCC[N@H+]2Cc2c(O)ccc3ccccc32)cn1 ZINC000189875746 1140369030 /nfs/dbraw/zinc/36/90/30/1140369030.db2.gz CDZHJUPUMGAFBR-GOSISDBHSA-N 1 1 339.464 3.569 20 10 EHCDMO C[C@@H]([NH2+]CCCc1cnn(C)c1)c1cc(Cl)c(Cl)cc1O ZINC000192806002 1140551828 /nfs/dbraw/zinc/55/18/28/1140551828.db2.gz BGGYDUYKRJVTKV-SNVBAGLBSA-N 1 1 328.243 3.716 20 10 EHCDMO COc1ccccc1[C@@H](C[NH2+]Cc1cccc(F)c1O)OC(C)C ZINC000274525989 1014189005 /nfs/dbraw/zinc/18/90/05/1014189005.db2.gz ZXUUXLQTFWXSOD-GOSISDBHSA-N 1 1 333.403 3.796 20 10 EHCDMO CCOC1(C)CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000311839994 1017012098 /nfs/dbraw/zinc/01/20/98/1017012098.db2.gz QNQSUZFXXXKLDO-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO Cc1cc(CC(=O)Nc2cc(C)[nH+]c(C)c2)c(C)n1-c1ccccc1 ZINC001267368647 1032447265 /nfs/dbraw/zinc/44/72/65/1032447265.db2.gz YJCMYSNZHBWFRL-UHFFFAOYSA-N 1 1 333.435 3.709 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nccc(Cl)c2Cl)c1 ZINC001307628318 1032725005 /nfs/dbraw/zinc/72/50/05/1032725005.db2.gz HLWVOYDLBNETFD-VIFPVBQESA-N 1 1 327.211 3.953 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)c(O)c1 ZINC000091958732 1032746359 /nfs/dbraw/zinc/74/63/59/1032746359.db2.gz OCMHJFSYIQEWHQ-APWZRJJASA-N 1 1 345.439 3.862 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCn3cccc3[C@@H]1c1ccccc1)OCO2 ZINC000158697236 1018963630 /nfs/dbraw/zinc/96/36/30/1018963630.db2.gz VOMXIVHYRYSLPH-NRFANRHFSA-N 1 1 348.402 3.528 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCn3cccc3[C@@H]1c1ccccc1)OCO2 ZINC000158697236 1018963641 /nfs/dbraw/zinc/96/36/41/1018963641.db2.gz VOMXIVHYRYSLPH-NRFANRHFSA-N 1 1 348.402 3.528 20 10 EHCDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000160465628 1019107428 /nfs/dbraw/zinc/10/74/28/1019107428.db2.gz MDQIPVHIBULURK-SFHVURJKSA-N 1 1 325.456 3.514 20 10 EHCDMO CC[C@H]([NH2+]C1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(C)cc1O ZINC000280265781 1020234643 /nfs/dbraw/zinc/23/46/43/1020234643.db2.gz XNXRHJHSBMZYFS-UFYCRDLUSA-N 1 1 346.515 3.509 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c(O)c1OC ZINC000894977944 1022327968 /nfs/dbraw/zinc/32/79/68/1022327968.db2.gz WMDNLKIDPKVGCQ-LLVKDONJSA-N 1 1 333.350 3.574 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2cccc(Br)c2O)cc1 ZINC000048795286 1022872567 /nfs/dbraw/zinc/87/25/67/1022872567.db2.gz WGACMDRXGPYXSI-UHFFFAOYSA-N 1 1 335.245 3.511 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)S3)c1 ZINC000897748796 1033148913 /nfs/dbraw/zinc/14/89/13/1033148913.db2.gz FUOOTSMODOLRDM-YHWZYXNKSA-N 1 1 342.302 3.979 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000157919033 1033163938 /nfs/dbraw/zinc/16/39/38/1033163938.db2.gz PDMATAAOMUJRTK-DYESRHJHSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000157919033 1033163948 /nfs/dbraw/zinc/16/39/48/1033163948.db2.gz PDMATAAOMUJRTK-DYESRHJHSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC2(CC(OCC3CC3)C2)CC1 ZINC001142520337 1033190754 /nfs/dbraw/zinc/19/07/54/1033190754.db2.gz GSEYFNYNGBAYIP-UHFFFAOYSA-N 1 1 337.410 3.842 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)c(O)c1OC ZINC000892154418 1025051226 /nfs/dbraw/zinc/05/12/26/1025051226.db2.gz YEQMSGSSGBLLGD-DZGCQCFKSA-N 1 1 331.412 3.976 20 10 EHCDMO COc1cc(C[NH2+]Cc2c(O)cccc2F)cc(C(F)(F)F)c1 ZINC000896640451 1025795255 /nfs/dbraw/zinc/79/52/55/1025795255.db2.gz IVONWKAVYNZLHX-UHFFFAOYSA-N 1 1 329.293 3.849 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@H](Cc3nc(C)cs3)C2)c(O)c1 ZINC000897299364 1027403892 /nfs/dbraw/zinc/40/38/92/1027403892.db2.gz ZVDYCZMRZYPPRX-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000273426689 1027421783 /nfs/dbraw/zinc/42/17/83/1027421783.db2.gz ULEZLOZYVSWCFD-STQMWFEESA-N 1 1 329.396 3.599 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2OC)c1 ZINC000273430215 1027421942 /nfs/dbraw/zinc/42/19/42/1027421942.db2.gz VIGWRBKODPIFCY-QWHCGFSZSA-N 1 1 329.396 3.599 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC(C)=C(c3ccco3)C2)cc1OC ZINC000367175158 1028437639 /nfs/dbraw/zinc/43/76/39/1028437639.db2.gz ZADYBVGFBZCSCW-UHFFFAOYSA-N 1 1 329.396 3.682 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 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339.794 3.834 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1F ZINC000761226415 1034827601 /nfs/dbraw/zinc/82/76/01/1034827601.db2.gz RFXYBVMKGFAWLD-NRFANRHFSA-N 1 1 342.458 3.665 20 10 EHCDMO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000189921045 1036162777 /nfs/dbraw/zinc/16/27/77/1036162777.db2.gz SFJRPHHIPRJZEW-LJQANCHMSA-N 1 1 343.496 3.625 20 10 EHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000189921045 1036162781 /nfs/dbraw/zinc/16/27/81/1036162781.db2.gz SFJRPHHIPRJZEW-LJQANCHMSA-N 1 1 343.496 3.625 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCc3ncc(C)s3)c2c1 ZINC000165220298 1036334408 /nfs/dbraw/zinc/33/44/08/1036334408.db2.gz XKODCIYSIZROGB-UHFFFAOYSA-N 1 1 342.464 3.993 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc(-c2cccc(F)c2)no1 ZINC000237500894 1039376530 /nfs/dbraw/zinc/37/65/30/1039376530.db2.gz JKKIBQJMHXWONW-CYBMUJFWSA-N 1 1 340.402 3.793 20 10 EHCDMO Cn1cnnc1[C@@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000093809857 1042543183 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C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1ccc(N2CCCCCC2)cc1 ZINC000765747081 1127764086 /nfs/dbraw/zinc/76/40/86/1127764086.db2.gz BLAQFEWFKIGAEW-CVEARBPZSA-N 1 1 327.476 3.607 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccccc3OC(F)F)CC2)cc1 ZINC000914786975 1120987168 /nfs/dbraw/zinc/98/71/68/1120987168.db2.gz CUIDAQKPRYLVIQ-UHFFFAOYSA-N 1 1 348.393 3.619 20 10 EHCDMO COc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc(F)cc3O)c21 ZINC000186507121 1129051514 /nfs/dbraw/zinc/05/15/14/1129051514.db2.gz NTRSPSSVOUSVFZ-LBPRGKRZSA-N 1 1 328.387 3.915 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1ccc(F)cc1F ZINC000917013973 1122438504 /nfs/dbraw/zinc/43/85/04/1122438504.db2.gz KKGAHENMONKSJS-FQEVSTJZSA-N 1 1 348.437 3.975 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2ccc(F)cc2F)cc1 ZINC000917020961 1122441325 /nfs/dbraw/zinc/44/13/25/1122441325.db2.gz XNMNESIMEAJUDV-FQEVSTJZSA-N 1 1 348.437 3.976 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000154294913 1122535351 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Oc1ccc(F)cc1C[N@H+](Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000180246864 1123969561 /nfs/dbraw/zinc/96/95/61/1123969561.db2.gz FNYUDLHTAQCGDG-IBGZPJMESA-N 1 1 341.382 3.860 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000922467164 1129542792 /nfs/dbraw/zinc/54/27/92/1129542792.db2.gz QUUOWLUGCPCEGR-UHFFFAOYSA-N 1 1 347.256 3.718 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](c2ncccn2)C2CC2)cc1F ZINC000922580340 1129580395 /nfs/dbraw/zinc/58/03/95/1129580395.db2.gz OVRBQXNLKKYARD-GOSISDBHSA-N 1 1 328.435 3.703 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@]23CCC[C@H]2OCC3)c1 ZINC000922692098 1129628669 /nfs/dbraw/zinc/62/86/69/1129628669.db2.gz LDVQXAZCJPNSPQ-GDBMZVCRSA-N 1 1 340.261 3.512 20 10 EHCDMO CO[C@@](C)(C[NH2+][C@H](C)c1ccc(F)cc1O)COCc1ccccc1 ZINC000702804294 1130249745 /nfs/dbraw/zinc/24/97/45/1130249745.db2.gz OUNPMABVIZHXBH-QRWLVFNGSA-N 1 1 347.430 3.804 20 10 EHCDMO COC[C@@H]1CC[N@@H+](CC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)C1 ZINC000739917740 1131517036 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ZPFMNGSGRKLAGJ-MRXNPFEDSA-N 1 1 327.424 3.512 20 10 EHCDMO CN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000768376043 1133133829 /nfs/dbraw/zinc/13/38/29/1133133829.db2.gz OTJAPLNIGJNXFM-IBGZPJMESA-N 1 1 330.859 3.980 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000768376043 1133133832 /nfs/dbraw/zinc/13/38/32/1133133832.db2.gz OTJAPLNIGJNXFM-IBGZPJMESA-N 1 1 330.859 3.980 20 10 EHCDMO CCC[N@@H+](Cc1ccc(C)cc1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768440052 1133137776 /nfs/dbraw/zinc/13/77/76/1133137776.db2.gz RFMTWMHVJRUOAA-LJQANCHMSA-N 1 1 327.424 3.539 20 10 EHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)OC[C@@H]3O)c1C ZINC000768448802 1133140426 /nfs/dbraw/zinc/14/04/26/1133140426.db2.gz XNRCWRFHTOBNLN-QUCCMNQESA-N 1 1 339.435 3.772 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@](C)(c3ccccc3)C2)cc1OC ZINC000768449686 1133140672 /nfs/dbraw/zinc/14/06/72/1133140672.db2.gz XXYXEJSKCKGZLD-OAQYLSRUSA-N 1 1 341.451 3.963 20 10 EHCDMO CCN(C)c1ccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)cc1 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CCC[N@@H+](CC(=O)N(C)[C@@H]1CCCC[C@@H]1C)Cc1ccccc1O ZINC000216738519 1136385284 /nfs/dbraw/zinc/38/52/84/1136385284.db2.gz GSOWPYSPTDHSIG-FUHWJXTLSA-N 1 1 332.488 3.641 20 10 EHCDMO CC(C)CNC(=O)CCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000851840420 1136412730 /nfs/dbraw/zinc/41/27/30/1136412730.db2.gz GLAOIPPUPPGJLT-UHFFFAOYSA-N 1 1 344.455 3.540 20 10 EHCDMO C[C@@]12CC[N@H+](Cc3cccc(Br)c3O)C[C@@H]1C2(F)F ZINC000814169273 1136414695 /nfs/dbraw/zinc/41/46/95/1136414695.db2.gz FXRAGLWXDKLTAF-WCQYABFASA-N 1 1 332.188 3.632 20 10 EHCDMO C[C@@]12CC[N@@H+](Cc3cccc(Br)c3O)C[C@@H]1C2(F)F ZINC000814169273 1136414701 /nfs/dbraw/zinc/41/47/01/1136414701.db2.gz FXRAGLWXDKLTAF-WCQYABFASA-N 1 1 332.188 3.632 20 10 EHCDMO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1cc(F)cc(F)c1O ZINC000853241821 1136521513 /nfs/dbraw/zinc/52/15/13/1136521513.db2.gz NMUPMSYIOVWGGC-QMMMGPOBSA-N 1 1 332.272 3.935 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@H](OCC(F)(F)F)C2)ccc1N(C)C ZINC000815050777 1136540133 /nfs/dbraw/zinc/54/01/33/1136540133.db2.gz HNSDWLQWASBCNL-HNNXBMFYSA-N 1 1 330.394 3.604 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815031423 1136542617 /nfs/dbraw/zinc/54/26/17/1136542617.db2.gz SXCRAEFEXOPALI-PKOBYXMFSA-N 1 1 345.531 3.578 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000815070049 1136546732 /nfs/dbraw/zinc/54/67/32/1136546732.db2.gz JSPZWULZMQFMCT-UHFFFAOYSA-N 1 1 340.301 3.951 20 10 EHCDMO C[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815555073 1136609861 /nfs/dbraw/zinc/60/98/61/1136609861.db2.gz PBJUEZKJVSVCRY-CHWSQXEVSA-N 1 1 347.377 3.647 20 10 EHCDMO CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815632247 1136621872 /nfs/dbraw/zinc/62/18/72/1136621872.db2.gz HXTFAUFLQGIJAS-NEPJUHHUSA-N 1 1 346.393 3.614 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cnn(Cc2ccccc2)c1 ZINC000816535168 1136730552 /nfs/dbraw/zinc/73/05/52/1136730552.db2.gz IDHIHFMDBCLRNT-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1F ZINC000816543467 1136731743 /nfs/dbraw/zinc/73/17/43/1136731743.db2.gz BWWVNYMCNZQYAU-UHFFFAOYSA-N 1 1 326.774 3.680 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(NC(N)=O)cc1 ZINC000816549381 1136732263 /nfs/dbraw/zinc/73/22/63/1136732263.db2.gz MHKAYQDAWXFLPK-VIFPVBQESA-N 1 1 337.782 3.526 20 10 EHCDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816550500 1136733016 /nfs/dbraw/zinc/73/30/16/1136733016.db2.gz SJCRYTHEYUQZMH-CQSZACIVSA-N 1 1 337.778 3.807 20 10 EHCDMO Cc1ccn(-c2ccccc2C[NH2+]Cc2cc(Cl)c(F)cc2O)n1 ZINC000816556669 1136736964 /nfs/dbraw/zinc/73/69/64/1136736964.db2.gz RDOZBTYVIQEJBD-UHFFFAOYSA-N 1 1 345.805 3.969 20 10 EHCDMO CCOC(=O)CC1([NH2+]Cc2cc(Cl)c(F)cc2O)CCCC1 ZINC000816594737 1136739484 /nfs/dbraw/zinc/73/94/84/1136739484.db2.gz NUGHJPGNDULSGA-UHFFFAOYSA-N 1 1 329.799 3.540 20 10 EHCDMO C[C@@H]1C[C@@]2(CCO1)C[N@@H+](Cc1ccc3ccccc3c1O)C[C@H](C)O2 ZINC000816598218 1136739908 /nfs/dbraw/zinc/73/99/08/1136739908.db2.gz SZLZLODJKUYLCJ-XFQAVAEZSA-N 1 1 341.451 3.704 20 10 EHCDMO CSc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938015 1136847290 /nfs/dbraw/zinc/84/72/90/1136847290.db2.gz BOGPCMRMHQVKKL-IFXJQAMLSA-N 1 1 329.513 3.825 20 10 EHCDMO CCCOc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938278 1136847303 /nfs/dbraw/zinc/84/73/03/1136847303.db2.gz IFACHUFTOWMLIW-KKSFZXQISA-N 1 1 341.499 3.892 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc2c(s1)CCC2 ZINC000817939560 1136847363 /nfs/dbraw/zinc/84/73/63/1136847363.db2.gz CMNKAGCHOCYMMN-SUMWQHHRSA-N 1 1 329.513 3.653 20 10 EHCDMO CCC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938354 1136847430 /nfs/dbraw/zinc/84/74/30/1136847430.db2.gz JHOZNJQFZXRXDY-NHCUHLMSSA-N 1 1 341.499 3.892 20 10 EHCDMO Cc1ccc2c(c1)[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)CCCO2 ZINC000817940709 1136848221 /nfs/dbraw/zinc/84/82/21/1136848221.db2.gz HACAFBGSTLPGJW-WOJBJXKFSA-N 1 1 339.483 3.564 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000817940692 1136848605 /nfs/dbraw/zinc/84/86/05/1136848605.db2.gz GVMVPRNBVYHFES-VQTJNVASSA-N 1 1 327.447 3.559 20 10 EHCDMO CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000817965033 1136853313 /nfs/dbraw/zinc/85/33/13/1136853313.db2.gz NUHXRVQMYLKPLH-AWEZNQCLSA-N 1 1 341.293 3.585 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ncc(Br)cn1)c1ccc(N(C)C)cc1 ZINC000805749847 1136995706 /nfs/dbraw/zinc/99/57/06/1136995706.db2.gz AYNXDDDSSXTZCF-NEPJUHHUSA-N 1 1 349.276 3.717 20 10 EHCDMO CCn1nnc(C)c1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000823375192 1137096776 /nfs/dbraw/zinc/09/67/76/1137096776.db2.gz BCAUWKOMWSZTSA-UHFFFAOYSA-N 1 1 328.460 3.647 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000777220608 1137122237 /nfs/dbraw/zinc/12/22/37/1137122237.db2.gz GGDGPRHKMUQDHR-NRFANRHFSA-N 1 1 339.435 3.582 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@@H]2CCn3ccnc32)cc1 ZINC000824533895 1137141718 /nfs/dbraw/zinc/14/17/18/1137141718.db2.gz RXBYCFZBQILYKV-GOSISDBHSA-N 1 1 338.480 3.816 20 10 EHCDMO COC1CCC([N@H+](C)Cc2ccc(Br)cc2O)CC1 ZINC000824814259 1137153551 /nfs/dbraw/zinc/15/35/51/1137153551.db2.gz OIGDKUOSQMSYSF-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO COC1CCC([N@@H+](C)Cc2ccc(Br)cc2O)CC1 ZINC000824814259 1137153553 /nfs/dbraw/zinc/15/35/53/1137153553.db2.gz OIGDKUOSQMSYSF-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO COC[C@@H]1CCC[N@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000825321510 1137172816 /nfs/dbraw/zinc/17/28/16/1137172816.db2.gz FZVQAJZRERSOGF-CYBMUJFWSA-N 1 1 342.277 3.712 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000825321510 1137172818 /nfs/dbraw/zinc/17/28/18/1137172818.db2.gz FZVQAJZRERSOGF-CYBMUJFWSA-N 1 1 342.277 3.712 20 10 EHCDMO CO[C@H](C)c1nc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cs1 ZINC000825326519 1137173220 /nfs/dbraw/zinc/17/32/20/1137173220.db2.gz RDIWJJQCSRASAA-SNVBAGLBSA-N 1 1 326.849 3.808 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](CCF)C1)oc1ccccc12 ZINC000863315855 1137180589 /nfs/dbraw/zinc/18/05/89/1137180589.db2.gz GMKZZAOTHQCPJF-AWEZNQCLSA-N 1 1 329.371 3.852 20 10 EHCDMO COc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1C(F)(F)F ZINC001143646778 1137186404 /nfs/dbraw/zinc/18/64/04/1137186404.db2.gz YMDYTNHFBVJUMM-UHFFFAOYSA-N 1 1 337.341 3.978 20 10 EHCDMO COc1ccc(C[N@H+]2CCc3cccc(O)c3C2)cc1C(F)(F)F ZINC001143646778 1137186405 /nfs/dbraw/zinc/18/64/05/1137186405.db2.gz YMDYTNHFBVJUMM-UHFFFAOYSA-N 1 1 337.341 3.978 20 10 EHCDMO Cc1cnc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1Br ZINC001143668598 1137187994 /nfs/dbraw/zinc/18/79/94/1137187994.db2.gz ZDCKIRONSJQKBW-UHFFFAOYSA-N 1 1 348.288 3.851 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000794668557 1137222533 /nfs/dbraw/zinc/22/25/33/1137222533.db2.gz WHCONPSXYWPSHB-OYRHEFFESA-N 1 1 336.479 3.573 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000794668557 1137222535 /nfs/dbraw/zinc/22/25/35/1137222535.db2.gz WHCONPSXYWPSHB-OYRHEFFESA-N 1 1 336.479 3.573 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@]4(CC4(F)F)C3)cc2)CC1 ZINC000844469033 1137226723 /nfs/dbraw/zinc/22/67/23/1137226723.db2.gz UBLSDNPFYMZVPW-SFHVURJKSA-N 1 1 336.426 3.533 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1F)C[C@@H]1CCCO1 ZINC000120529337 1137280191 /nfs/dbraw/zinc/28/01/91/1137280191.db2.gz NUIQMEVOGOKJIN-KRWDZBQOSA-N 1 1 333.378 3.852 20 10 EHCDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c1 ZINC000120631438 1137294973 /nfs/dbraw/zinc/29/49/73/1137294973.db2.gz HCANEHQWXDBMRX-KRWDZBQOSA-N 1 1 343.423 3.755 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c(F)c1 ZINC000845902862 1137319197 /nfs/dbraw/zinc/31/91/97/1137319197.db2.gz JSDCXVZGBDUJBS-GOSISDBHSA-N 1 1 345.414 3.721 20 10 EHCDMO C[C@H]([NH2+][C@H](Cc1ccccc1)c1nccn1C)c1ccc(F)cc1O ZINC000846207395 1137339206 /nfs/dbraw/zinc/33/92/06/1137339206.db2.gz NVDPXKJOOHANDC-KBXCAEBGSA-N 1 1 339.414 3.899 20 10 EHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c(OC)c1 ZINC000121009862 1137346259 /nfs/dbraw/zinc/34/62/59/1137346259.db2.gz ZXZRWBROMUEULG-KRWDZBQOSA-N 1 1 343.423 3.755 20 10 EHCDMO C[NH+](C)C1(C)CCC([NH2+]Cc2c([O-])cccc2Br)CC1 ZINC000715563570 1137477294 /nfs/dbraw/zinc/47/72/94/1137477294.db2.gz WNKHKVBCVQNAJZ-UHFFFAOYSA-N 1 1 341.293 3.507 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCS[C@@H]4CCCC[C@H]43)cc2)CC1 ZINC000876771805 1137660921 /nfs/dbraw/zinc/66/09/21/1137660921.db2.gz ZGSONBAZZUYDAC-WOJBJXKFSA-N 1 1 346.540 3.508 20 10 EHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876797262 1137661793 /nfs/dbraw/zinc/66/17/93/1137661793.db2.gz SXIUQHGLSLJYSJ-ICSRJNTNSA-N 1 1 348.556 3.754 20 10 EHCDMO Cc1cc(NCc2ccc(F)c(F)c2O)ccc1OCC[NH+](C)C ZINC000877584221 1137682118 /nfs/dbraw/zinc/68/21/18/1137682118.db2.gz DTZQEAKRZHYSEA-UHFFFAOYSA-N 1 1 336.382 3.531 20 10 EHCDMO CCC[N@@H+](Cc1nnc(-c2cccc(O)c2)o1)Cc1ccccc1O ZINC000878150644 1137704578 /nfs/dbraw/zinc/70/45/78/1137704578.db2.gz GSWDVLNJVZOFHB-UHFFFAOYSA-N 1 1 339.395 3.560 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)nc1Cl ZINC000878240173 1137708258 /nfs/dbraw/zinc/70/82/58/1137708258.db2.gz DGVMDLKXVZVSHI-KRWDZBQOSA-N 1 1 346.858 3.930 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000826143136 1137768688 /nfs/dbraw/zinc/76/86/88/1137768688.db2.gz SZOGZXFCLZLEOV-CYBMUJFWSA-N 1 1 332.188 3.776 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccc(OCC(F)(F)F)cc1 ZINC000882882136 1137836580 /nfs/dbraw/zinc/83/65/80/1137836580.db2.gz VXFVVWMOXFAASS-UHFFFAOYSA-N 1 1 347.283 3.901 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(N2CCCC2=O)c1 ZINC000882924893 1137838788 /nfs/dbraw/zinc/83/87/88/1137838788.db2.gz PPTFOKDYYJUAHS-LBPRGKRZSA-N 1 1 346.377 3.648 20 10 EHCDMO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Br)ccc1O ZINC000883311737 1137854046 /nfs/dbraw/zinc/85/40/46/1137854046.db2.gz KBYLXDIVIZSRNA-LLVKDONJSA-N 1 1 348.244 3.675 20 10 EHCDMO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886507562 1138085962 /nfs/dbraw/zinc/08/59/62/1138085962.db2.gz PQNSOLLCKTYXQR-ZDUSSCGKSA-N 1 1 336.451 3.609 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1c(O)cccc1F ZINC000886553626 1138095427 /nfs/dbraw/zinc/09/54/27/1138095427.db2.gz RYDFCNIJAIGWSQ-OLZOCXBDSA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1c(O)cccc1F ZINC000886605203 1138101033 /nfs/dbraw/zinc/10/10/33/1138101033.db2.gz LRNVSWNOTUBSIY-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1c(O)cccc1F ZINC000886644758 1138105343 /nfs/dbraw/zinc/10/53/43/1138105343.db2.gz JYDWKNCGKQQYLB-VDYXNGCNSA-N 1 1 337.341 3.990 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H](C)c2nncn2C)cc1 ZINC000264231217 1138449140 /nfs/dbraw/zinc/44/91/40/1138449140.db2.gz BDSKTNGEQHWZBP-KRWDZBQOSA-N 1 1 349.482 3.692 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1ccc(F)cc1O ZINC000185019437 1140131703 /nfs/dbraw/zinc/13/17/03/1140131703.db2.gz ANBAVYSQBODBJA-CYBMUJFWSA-N 1 1 328.387 3.509 20 10 EHCDMO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185470376 1140151354 /nfs/dbraw/zinc/15/13/54/1140151354.db2.gz JKFYMFBORDHRKX-DJJJIMSYSA-N 1 1 333.403 3.703 20 10 EHCDMO COC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc(F)c(F)c1 ZINC000186225713 1140193041 /nfs/dbraw/zinc/19/30/41/1140193041.db2.gz KIQUUDFLWHQIKJ-QLJPJBMISA-N 1 1 325.330 3.848 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000777440495 1140290667 /nfs/dbraw/zinc/29/06/67/1140290667.db2.gz XYTPPGMATHNCCA-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000777440495 1140290671 /nfs/dbraw/zinc/29/06/71/1140290671.db2.gz XYTPPGMATHNCCA-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO C[C@H]([NH2+]CCCO[C@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000192951919 1140556039 /nfs/dbraw/zinc/55/60/39/1140556039.db2.gz NEVAKFYQEGKKMF-QWRGUYRKSA-N 1 1 334.243 3.545 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2csc([C@@H](C)OC)n2)cc1 ZINC000267638601 1140815339 /nfs/dbraw/zinc/81/53/39/1140815339.db2.gz QCIAMRHBVIIOGN-CQSZACIVSA-N 1 1 333.501 3.987 20 10 EHCDMO CCn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c(C)n1 ZINC000891395341 1020902259 /nfs/dbraw/zinc/90/22/59/1020902259.db2.gz YNAHMAYSTBXPNQ-UHFFFAOYSA-N 1 1 325.412 3.712 20 10 EHCDMO CCn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c(C)n1 ZINC000891395341 1020902265 /nfs/dbraw/zinc/90/22/65/1020902265.db2.gz YNAHMAYSTBXPNQ-UHFFFAOYSA-N 1 1 325.412 3.712 20 10 EHCDMO C[C@@H](O)CC[N@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255320947 1021085386 /nfs/dbraw/zinc/08/53/86/1021085386.db2.gz XAKYAAXTEHRCOT-OAHLLOKOSA-N 1 1 340.427 3.743 20 10 EHCDMO C[C@@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255320947 1021085391 /nfs/dbraw/zinc/08/53/91/1021085391.db2.gz XAKYAAXTEHRCOT-OAHLLOKOSA-N 1 1 340.427 3.743 20 10 EHCDMO COCCCC1(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)CCC1 ZINC000891526964 1021842228 /nfs/dbraw/zinc/84/22/28/1021842228.db2.gz QXDIZTYRRIVZSI-UHFFFAOYSA-N 1 1 346.515 3.552 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1 ZINC000729512279 1024149606 /nfs/dbraw/zinc/14/96/06/1024149606.db2.gz HNQJNVOITSDEAU-FGTMMUONSA-N 1 1 345.531 3.753 20 10 EHCDMO CC(C)[N@@H+](CC[S@](=O)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000729542778 1024606097 /nfs/dbraw/zinc/60/60/97/1024606097.db2.gz UAXVGVKTDRNCJN-DEOSSOPVSA-N 1 1 344.524 3.771 20 10 EHCDMO COc1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c(O)c1OC ZINC000896048365 1025100085 /nfs/dbraw/zinc/10/00/85/1025100085.db2.gz QJTJSRZNWOXEPF-LRDDRELGSA-N 1 1 345.361 3.574 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000273417044 1027417040 /nfs/dbraw/zinc/41/70/40/1027417040.db2.gz RAKPZZSOACXVRW-QWRGUYRKSA-N 1 1 335.350 3.869 20 10 EHCDMO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)on1 ZINC000273558409 1027492476 /nfs/dbraw/zinc/49/24/76/1027492476.db2.gz HKIJQHLMULIFGS-LBPRGKRZSA-N 1 1 346.427 3.921 20 10 EHCDMO COc1c(O)c(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000278274879 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/nfs/dbraw/zinc/31/78/78/1133317878.db2.gz LXKATAJIOHVLRS-UHFFFAOYSA-N 1 1 335.394 3.936 20 10 EHCDMO COC(=O)c1c(C[N@H+]2CC[C@H](C)[C@@H](C)C2)c2cc(F)ccc2n1C ZINC001180198875 1133347428 /nfs/dbraw/zinc/34/74/28/1133347428.db2.gz KOTUNGBJHJNQJG-STQMWFEESA-N 1 1 332.419 3.582 20 10 EHCDMO CCc1cccc(C[N@H+](CCN(C)C)Cc2cccc(OC)c2)c1O ZINC001181506315 1133494598 /nfs/dbraw/zinc/49/45/98/1133494598.db2.gz PQDUMRRCGFHGSJ-UHFFFAOYSA-N 1 1 342.483 3.527 20 10 EHCDMO CCc1cccc(C[N@@H+](CCN(C)C)Cc2cccc(OC)c2)c1O ZINC001181506315 1133494599 /nfs/dbraw/zinc/49/45/99/1133494599.db2.gz PQDUMRRCGFHGSJ-UHFFFAOYSA-N 1 1 342.483 3.527 20 10 EHCDMO CC[N@H+]1CCCC[C@@H]1C(=O)N[C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001182002468 1133560634 /nfs/dbraw/zinc/56/06/34/1133560634.db2.gz RSHCJVBLBFBARK-APWZRJJASA-N 1 1 344.499 3.623 20 10 EHCDMO COCCOCCCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774157670 1133624629 /nfs/dbraw/zinc/62/46/29/1133624629.db2.gz QJDYFRZIBVPQRM-LLVKDONJSA-N 1 1 336.259 3.793 20 10 EHCDMO C[C@H]([NH2+]CCOC[C@H]1CCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774187783 1133629062 /nfs/dbraw/zinc/62/90/62/1133629062.db2.gz HHZFGNFFBIXWFJ-WDEREUQCSA-N 1 1 334.243 3.545 20 10 EHCDMO CO[C@@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C(F)(F)F ZINC000774291188 1133657621 /nfs/dbraw/zinc/65/76/21/1133657621.db2.gz DDCIPIFGONIBEV-KGFZYKRKSA-N 1 1 332.149 3.927 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCn2ccnc2C1)c1cc(Cl)c(Cl)cc1O ZINC000774361949 1133665211 /nfs/dbraw/zinc/66/52/11/1133665211.db2.gz YVGVLKSCXFLAPZ-ZJUUUORDSA-N 1 1 326.227 3.561 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1nc2ccccc2c(=O)[nH]1)c1ccc(N(C)C)cc1 ZINC000774480394 1133687226 /nfs/dbraw/zinc/68/72/26/1133687226.db2.gz BMAZOJDPMJAINR-ZIAGYGMSSA-N 1 1 336.439 3.813 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000774834169 1134035921 /nfs/dbraw/zinc/03/59/21/1134035921.db2.gz AXNJXXCBXBYOJJ-OAHLLOKOSA-N 1 1 346.358 3.785 20 10 EHCDMO Oc1ccccc1C[N@H+](C[C@H]1CCCO1)C[C@H]1CCC(F)(F)C1 ZINC000787731907 1134036391 /nfs/dbraw/zinc/03/63/91/1134036391.db2.gz UDSARSQPFJTDPT-GOEBONIOSA-N 1 1 325.399 3.809 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](C)[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000774841261 1134049281 /nfs/dbraw/zinc/04/92/81/1134049281.db2.gz SZAQOELCZCJMLQ-AEGPPILISA-N 1 1 334.416 3.710 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](C)[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000774841261 1134049286 /nfs/dbraw/zinc/04/92/86/1134049286.db2.gz SZAQOELCZCJMLQ-AEGPPILISA-N 1 1 334.416 3.710 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000774910421 1134117605 /nfs/dbraw/zinc/11/76/05/1134117605.db2.gz XJTCXKSJEINHQD-CZUORRHYSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000774910421 1134117610 /nfs/dbraw/zinc/11/76/10/1134117610.db2.gz XJTCXKSJEINHQD-CZUORRHYSA-N 1 1 342.395 3.687 20 10 EHCDMO CCN(CC)C(=O)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788639174 1134154239 /nfs/dbraw/zinc/15/42/39/1134154239.db2.gz NASBFDPKZADUIY-LBPRGKRZSA-N 1 1 346.393 3.710 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000788778622 1134174865 /nfs/dbraw/zinc/17/48/65/1134174865.db2.gz XXSZUXNSNJQLOV-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO COc1c2ccccc2oc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000788968759 1134197290 /nfs/dbraw/zinc/19/72/90/1134197290.db2.gz ATDQIBULPSLESG-UHFFFAOYSA-N 1 1 328.387 3.936 20 10 EHCDMO CCOC[C@H]([NH2+]Cc1cc(C)cc(Br)c1O)C(C)C ZINC000788971135 1134197921 /nfs/dbraw/zinc/19/79/21/1134197921.db2.gz IZZJLPLIUODERC-AWEZNQCLSA-N 1 1 330.266 3.614 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(F)c(C)c2)ccc1[N+](=O)[O-] ZINC000775032758 1134232410 /nfs/dbraw/zinc/23/24/10/1134232410.db2.gz JZZBGKWETFIVIS-LLVKDONJSA-N 1 1 334.347 3.607 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CCCCCO)c(C)n1-c1cccc(F)c1 ZINC000789339342 1134259086 /nfs/dbraw/zinc/25/90/86/1134259086.db2.gz CUCSMONRVLESBS-UHFFFAOYSA-N 1 1 346.446 3.510 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CCCCCO)c(C)n1-c1cccc(F)c1 ZINC000789339342 1134259094 /nfs/dbraw/zinc/25/90/94/1134259094.db2.gz CUCSMONRVLESBS-UHFFFAOYSA-N 1 1 346.446 3.510 20 10 EHCDMO Cc1ccc(C[N@@H+](C)Cc2cc(C)cc(Br)c2O)nc1 ZINC000789590661 1134299306 /nfs/dbraw/zinc/29/93/06/1134299306.db2.gz XMYZXEKZDIHDFN-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO Cc1ccc(C[N@H+](C)Cc2cc(C)cc(Br)c2O)nc1 ZINC000789590661 1134299311 /nfs/dbraw/zinc/29/93/11/1134299311.db2.gz XMYZXEKZDIHDFN-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775136873 1134364652 /nfs/dbraw/zinc/36/46/52/1134364652.db2.gz NKRIHSLEEGPWJW-SECBINFHSA-N 1 1 338.167 3.929 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(F)c1 ZINC000790944297 1134482842 /nfs/dbraw/zinc/48/28/42/1134482842.db2.gz HRNQBUCCDWNVQX-OAHLLOKOSA-N 1 1 340.801 3.716 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc(C2OCCO2)cc1 ZINC000790961964 1134486232 /nfs/dbraw/zinc/48/62/32/1134486232.db2.gz UXWJMLMYIBALNN-UHFFFAOYSA-N 1 1 337.778 3.520 20 10 EHCDMO CN(CC[NH2+]Cc1c(O)ccc(Cl)c1F)Cc1ccc(F)cc1 ZINC000790974365 1134494200 /nfs/dbraw/zinc/49/42/00/1134494200.db2.gz SPQXSDMCRZMWMQ-UHFFFAOYSA-N 1 1 340.801 3.545 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@H](O)c1cccc(F)c1 ZINC000790973533 1134494278 /nfs/dbraw/zinc/49/42/78/1134494278.db2.gz NIWRMKCGTRIDPG-XXFAHNHDSA-N 1 1 327.758 3.536 20 10 EHCDMO OC[C@H](C1CC1)[N@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792174841 1134663568 /nfs/dbraw/zinc/66/35/68/1134663568.db2.gz IHKCPESUMWAQAU-QGZVFWFLSA-N 1 1 349.833 3.958 20 10 EHCDMO OC[C@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792174841 1134663572 /nfs/dbraw/zinc/66/35/72/1134663572.db2.gz IHKCPESUMWAQAU-QGZVFWFLSA-N 1 1 349.833 3.958 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)Nc1nc(C)c(C)s1 ZINC000772799005 1134702324 /nfs/dbraw/zinc/70/23/24/1134702324.db2.gz VPSIRFSRGSWBRF-ZDUSSCGKSA-N 1 1 347.484 3.705 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c(C(F)(F)F)c1 ZINC000792843518 1134806006 /nfs/dbraw/zinc/80/60/06/1134806006.db2.gz ONOZGMWCJPSKEO-PBHICJAKSA-N 1 1 342.405 3.772 20 10 EHCDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793190720 1134871883 /nfs/dbraw/zinc/87/18/83/1134871883.db2.gz WESBPROGOJLLIO-XJKSGUPXSA-N 1 1 344.421 3.897 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCO[C@@]3(CCO[C@@H]3C)C2)cc1 ZINC000793230310 1134880024 /nfs/dbraw/zinc/88/00/24/1134880024.db2.gz FVKIAONNUCKPGZ-NQIIRXRSSA-N 1 1 346.515 3.693 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c(C(F)(F)F)c1 ZINC000793608023 1134968268 /nfs/dbraw/zinc/96/82/68/1134968268.db2.gz HIVHJARDPBFIJH-IAGOWNOFSA-N 1 1 342.405 3.915 20 10 EHCDMO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2C(=O)c1cc(O)c(O)c(Cl)c1 ZINC001193626620 1135160987 /nfs/dbraw/zinc/16/09/87/1135160987.db2.gz YDQAWENCTJJLAA-CQSZACIVSA-N 1 1 346.814 3.500 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775641904 1135381364 /nfs/dbraw/zinc/38/13/64/1135381364.db2.gz DJXBQTBAMAVWTH-UHFFFAOYSA-N 1 1 346.858 3.987 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775641904 1135381369 /nfs/dbraw/zinc/38/13/69/1135381369.db2.gz DJXBQTBAMAVWTH-UHFFFAOYSA-N 1 1 346.858 3.987 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc(Br)cs2)c1 ZINC000775653756 1135419036 /nfs/dbraw/zinc/41/90/36/1135419036.db2.gz AYOSMOBCWLUHES-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701884 1135538987 /nfs/dbraw/zinc/53/89/87/1135538987.db2.gz OHUVFLGSJSFSFS-LMNJBCLMSA-N 1 1 327.516 3.591 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701884 1135538994 /nfs/dbraw/zinc/53/89/94/1135538994.db2.gz OHUVFLGSJSFSFS-LMNJBCLMSA-N 1 1 327.516 3.591 20 10 EHCDMO COCCN(Cc1ccc(C)o1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775723999 1135575113 /nfs/dbraw/zinc/57/51/13/1135575113.db2.gz BPAYQBQMYGHNJD-UHFFFAOYSA-N 1 1 327.783 3.735 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)o1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775723999 1135575108 /nfs/dbraw/zinc/57/51/08/1135575108.db2.gz BPAYQBQMYGHNJD-UHFFFAOYSA-N 1 1 327.783 3.735 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735221 1135590469 /nfs/dbraw/zinc/59/04/69/1135590469.db2.gz NZURKSNTGMFTOJ-AVRDEDQJSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735221 1135590473 /nfs/dbraw/zinc/59/04/73/1135590473.db2.gz NZURKSNTGMFTOJ-AVRDEDQJSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735221 1135590476 /nfs/dbraw/zinc/59/04/76/1135590476.db2.gz NZURKSNTGMFTOJ-AVRDEDQJSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000747465819 1135631054 /nfs/dbraw/zinc/63/10/54/1135631054.db2.gz BFFWHIAUNOHHPT-ZBFHGGJFSA-N 1 1 325.408 3.574 20 10 EHCDMO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)cc1O ZINC000808727130 1135723019 /nfs/dbraw/zinc/72/30/19/1135723019.db2.gz BUUPFHZWBALIKM-LLVKDONJSA-N 1 1 343.358 3.814 20 10 EHCDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc(Br)ccc1O ZINC000809701550 1135869903 /nfs/dbraw/zinc/86/99/03/1135869903.db2.gz GQXBJRNIRRIQAW-WFASDCNBSA-N 1 1 342.277 3.670 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC[C@H]2CCOC2)Cc2ccco2)cc1 ZINC000809731791 1135873543 /nfs/dbraw/zinc/87/35/43/1135873543.db2.gz QVIPAURAXHLOJS-SFHVURJKSA-N 1 1 328.456 3.774 20 10 EHCDMO C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)CC1 ZINC000809756151 1135887393 /nfs/dbraw/zinc/88/73/93/1135887393.db2.gz QDXPKYQVNQCFRN-ZDUSSCGKSA-N 1 1 343.298 3.863 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(C(F)(F)F)cc1O ZINC000810253838 1135948735 /nfs/dbraw/zinc/94/87/35/1135948735.db2.gz DWNRRAZSBIASEQ-DGCLKSJQSA-N 1 1 339.361 3.732 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCc2ccsc2)c1 ZINC001201529073 1136039133 /nfs/dbraw/zinc/03/91/33/1136039133.db2.gz BZXDKGPEAAKKCA-UHFFFAOYSA-N 1 1 326.259 3.857 20 10 EHCDMO CC(C)C[C@H](C[N@@H+](C)Cc1ccccc1O)NC(=O)OC(C)(C)C ZINC000811456565 1136089583 /nfs/dbraw/zinc/08/95/83/1136089583.db2.gz CYCLPHOCTGSVFJ-MRXNPFEDSA-N 1 1 336.476 3.763 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1 ZINC000811791793 1136140572 /nfs/dbraw/zinc/14/05/72/1136140572.db2.gz VRBLOVBNKBJDEG-HKUYNNGSSA-N 1 1 345.483 3.929 20 10 EHCDMO COc1cc(C[NH2+][C@@H](C)c2nnc(C)s2)c(O)c(C(C)(C)C)c1 ZINC000850246210 1136226301 /nfs/dbraw/zinc/22/63/01/1136226301.db2.gz IHOOJHYYNZHZMN-JTQLQIEISA-N 1 1 335.473 3.709 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)Cc2cccs2)cc1)c1nccn1C ZINC000850409997 1136252414 /nfs/dbraw/zinc/25/24/14/1136252414.db2.gz LGKDKPSDAAMDPG-OAHLLOKOSA-N 1 1 340.496 3.969 20 10 EHCDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2ccc(N(C)C)cc2)C1 ZINC000812840375 1136257856 /nfs/dbraw/zinc/25/78/56/1136257856.db2.gz BGQGFZDOAKRBFD-SEVLPDGMSA-N 1 1 330.516 3.904 20 10 EHCDMO CC[N@H+](Cc1nc(C)oc1C)Cc1cc(Br)ccc1O ZINC000851792982 1136407501 /nfs/dbraw/zinc/40/75/01/1136407501.db2.gz QTEBXJQOYWKJLP-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO CC[N@@H+](Cc1nc(C)oc1C)Cc1cc(Br)ccc1O ZINC000851792982 1136407503 /nfs/dbraw/zinc/40/75/03/1136407503.db2.gz QTEBXJQOYWKJLP-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CC(C)(C)OC1=O ZINC000814179713 1136412238 /nfs/dbraw/zinc/41/22/38/1136412238.db2.gz GSHQCMUIQVFIGN-QGZVFWFLSA-N 1 1 325.408 3.585 20 10 EHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CC(C)(C)OC1=O ZINC000814179713 1136412242 /nfs/dbraw/zinc/41/22/42/1136412242.db2.gz GSHQCMUIQVFIGN-QGZVFWFLSA-N 1 1 325.408 3.585 20 10 EHCDMO COC1CCN(c2ccc(C[NH2+][C@H](C)c3cscn3)cc2)CC1 ZINC000852417290 1136454880 /nfs/dbraw/zinc/45/48/80/1136454880.db2.gz ROJNNQQYBYAQOU-CQSZACIVSA-N 1 1 331.485 3.609 20 10 EHCDMO CC[C@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000111236232 1136525267 /nfs/dbraw/zinc/52/52/67/1136525267.db2.gz PWURFURYDQFMOT-KRWDZBQOSA-N 1 1 346.858 3.745 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@@H]1c1ccco1)OCO2 ZINC000853538650 1136542347 /nfs/dbraw/zinc/54/23/47/1136542347.db2.gz IJVLOSNINCWJBI-SFHVURJKSA-N 1 1 327.380 3.831 20 10 EHCDMO COc1cc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c(O)cc1C ZINC000853550391 1136543854 /nfs/dbraw/zinc/54/38/54/1136543854.db2.gz MZXXBCKIQOISJQ-IBGZPJMESA-N 1 1 343.423 3.656 20 10 EHCDMO C[C@H]([NH2+]CCN1CCC[C@@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815559200 1136610649 /nfs/dbraw/zinc/61/06/49/1136610649.db2.gz AALCREGVZJJZKW-OLZOCXBDSA-N 1 1 330.394 3.794 20 10 EHCDMO CN1CCC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578243 1136613798 /nfs/dbraw/zinc/61/37/98/1136613798.db2.gz KGBMLPNSHCLWFO-TZIWHRDSSA-N 1 1 338.495 3.998 20 10 EHCDMO CC(C)[C@@H]1CC(=O)N(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000113238870 1136683707 /nfs/dbraw/zinc/68/37/07/1136683707.db2.gz MNBCZAWBKCFYHO-LJQANCHMSA-N 1 1 343.515 3.571 20 10 EHCDMO CC(C)[C@@H]1CC(=O)N(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000113238870 1136683711 /nfs/dbraw/zinc/68/37/11/1136683711.db2.gz MNBCZAWBKCFYHO-LJQANCHMSA-N 1 1 343.515 3.571 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(O)c1Cl ZINC000816482360 1136723018 /nfs/dbraw/zinc/72/30/18/1136723018.db2.gz CSCUFFGCIBWHKB-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(O)c1Cl ZINC000816482360 1136723019 /nfs/dbraw/zinc/72/30/19/1136723019.db2.gz CSCUFFGCIBWHKB-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816491794 1136724623 /nfs/dbraw/zinc/72/46/23/1136724623.db2.gz YUAZYCAPPWDMRJ-UHFFFAOYSA-N 1 1 335.403 3.964 20 10 EHCDMO Cn1c(C[NH2+]Cc2cc(Cl)c(F)cc2O)nc2cc(F)ccc21 ZINC000816553410 1136735812 /nfs/dbraw/zinc/73/58/12/1136735812.db2.gz UNBDWBPHAZWMHN-UHFFFAOYSA-N 1 1 337.757 3.500 20 10 EHCDMO COc1cccc(O[C@@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816554381 1136736224 /nfs/dbraw/zinc/73/62/24/1136736224.db2.gz XECXSHZGKRBXCN-NSHDSACASA-N 1 1 339.794 3.750 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000816598219 1136740074 /nfs/dbraw/zinc/74/00/74/1136740074.db2.gz SZLZLODJKUYLCJ-ZOCZFRKYSA-N 1 1 341.451 3.704 20 10 EHCDMO CC[N@@H+](CC(=O)N1CCCCCC1)Cc1ccc2ccccc2c1O ZINC000816608481 1136740309 /nfs/dbraw/zinc/74/03/09/1136740309.db2.gz AVOMDIBTLRUSDB-UHFFFAOYSA-N 1 1 340.467 3.770 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000816611004 1136740888 /nfs/dbraw/zinc/74/08/88/1136740888.db2.gz FOPDABNAHSBGJK-OLZOCXBDSA-N 1 1 327.827 3.823 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000816611004 1136740890 /nfs/dbraw/zinc/74/08/90/1136740890.db2.gz FOPDABNAHSBGJK-OLZOCXBDSA-N 1 1 327.827 3.823 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000816618827 1136742227 /nfs/dbraw/zinc/74/22/27/1136742227.db2.gz JXKYUXFXRYZKHG-MRXNPFEDSA-N 1 1 342.395 3.592 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1cc(C(F)(F)F)ccn1 ZINC000816643316 1136743420 /nfs/dbraw/zinc/74/34/20/1136743420.db2.gz AWNGFQSVUMSZQE-UHFFFAOYSA-N 1 1 348.727 3.931 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000817585539 1136825308 /nfs/dbraw/zinc/82/53/08/1136825308.db2.gz GIDHGAYDVHLWKS-GMTAPVOTSA-N 1 1 345.270 3.641 20 10 EHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000817938552 1136847806 /nfs/dbraw/zinc/84/78/06/1136847806.db2.gz MXAQCSBBFYEKMT-ACJLOTCBSA-N 1 1 349.425 3.705 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCCc3ccc(F)cc32)cc1 ZINC000817940355 1136848330 /nfs/dbraw/zinc/84/83/30/1136848330.db2.gz GCTMBFOAMTWTQD-VQTJNVASSA-N 1 1 327.447 3.559 20 10 EHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC)c1 ZINC000817940338 1136848425 /nfs/dbraw/zinc/84/84/25/1136848425.db2.gz GBMQCRLKTKPFTK-VQTJNVASSA-N 1 1 327.472 3.502 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCc3c2cccc3Cl)cc1 ZINC000817939134 1136848479 /nfs/dbraw/zinc/84/84/79/1136848479.db2.gz ZJJZFUMHENEDBA-RBUKOAKNSA-N 1 1 329.875 3.683 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000817938993 1136848644 /nfs/dbraw/zinc/84/86/44/1136848644.db2.gz XFNHMXJURIIHCN-DYVFJYSZSA-N 1 1 349.425 3.705 20 10 EHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000817940754 1136848754 /nfs/dbraw/zinc/84/87/54/1136848754.db2.gz HREVHNLLKKWHOZ-VQTJNVASSA-N 1 1 341.499 3.810 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H](O)Cc1ccccc1 ZINC000857758325 1136905723 /nfs/dbraw/zinc/90/57/23/1136905723.db2.gz FRMTYHVKAHNGBV-QFIPXVFZSA-N 1 1 338.495 3.712 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cc(Cl)c(C)cc3O)C2)nc1 ZINC000858014070 1136930951 /nfs/dbraw/zinc/93/09/51/1136930951.db2.gz LPPJPACETDLNGM-OAHLLOKOSA-N 1 1 332.831 3.711 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@H+](C/C=C/c3ccc(N(C)C)cc3)C2)nc1 ZINC000858013388 1136931036 /nfs/dbraw/zinc/93/10/36/1136931036.db2.gz ICNDTNUMRBIZOI-DPZZJQGRSA-N 1 1 337.467 3.623 20 10 EHCDMO CC1CCN(c2ccc(CN[C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132282 1136942243 /nfs/dbraw/zinc/94/22/43/1136942243.db2.gz YSZXCRQYMBQAIF-LJQANCHMSA-N 1 1 329.532 3.885 20 10 EHCDMO CC1CCN(c2ccc(CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132282 1136942246 /nfs/dbraw/zinc/94/22/46/1136942246.db2.gz YSZXCRQYMBQAIF-LJQANCHMSA-N 1 1 329.532 3.885 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)cc2)CC1 ZINC000858132282 1136942249 /nfs/dbraw/zinc/94/22/49/1136942249.db2.gz YSZXCRQYMBQAIF-LJQANCHMSA-N 1 1 329.532 3.885 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2cnccc2C(F)(F)F)cc1F ZINC000858196689 1136948860 /nfs/dbraw/zinc/94/88/60/1136948860.db2.gz SVIVGHXESWRLKP-UHFFFAOYSA-N 1 1 345.315 3.734 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)c1cc(Cl)c(Cl)cc1O ZINC000858603080 1136982104 /nfs/dbraw/zinc/98/21/04/1136982104.db2.gz QRJYMYOSMHSPCT-LKFCYVNXSA-N 1 1 343.254 3.503 20 10 EHCDMO C[N@@H+](CC[C@@H]1CC1(Cl)Cl)Cc1ccc(N2CCOCC2)cc1 ZINC000822570764 1137065370 /nfs/dbraw/zinc/06/53/70/1137065370.db2.gz PVKFIFPYFLTUKI-OAHLLOKOSA-N 1 1 343.298 3.539 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CC2(O)CCC2)cc1 ZINC000824166200 1137127245 /nfs/dbraw/zinc/12/72/45/1137127245.db2.gz DWYCTQMPUCAIFJ-UHFFFAOYSA-N 1 1 330.497 3.731 20 10 EHCDMO COc1ccc(O)c(C[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000013993987 1137133850 /nfs/dbraw/zinc/13/38/50/1137133850.db2.gz DMQJZHQLMGQPSG-IBGZPJMESA-N 1 1 345.414 3.721 20 10 EHCDMO Cc1ccnc(C2CC[NH+](Cc3cc(F)c(N(C)C)cc3F)CC2)n1 ZINC000862324045 1137138440 /nfs/dbraw/zinc/13/84/40/1137138440.db2.gz AOYPTOVDMULRRB-UHFFFAOYSA-N 1 1 346.425 3.509 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2c(O)cccc2Br)CC1 ZINC000862351579 1137139548 /nfs/dbraw/zinc/13/95/48/1137139548.db2.gz QQQMWWJOINDJFV-HNNXBMFYSA-N 1 1 328.250 3.546 20 10 EHCDMO CC[N@H+](Cc1cc(C(F)(F)F)nn1C)Cc1ccc(N(C)C)cc1 ZINC000824484421 1137139663 /nfs/dbraw/zinc/13/96/63/1137139663.db2.gz GPNRCDOKSTVHBD-UHFFFAOYSA-N 1 1 340.393 3.527 20 10 EHCDMO CC[N@@H+](Cc1cc(C(F)(F)F)nn1C)Cc1ccc(N(C)C)cc1 ZINC000824484421 1137139664 /nfs/dbraw/zinc/13/96/64/1137139664.db2.gz GPNRCDOKSTVHBD-UHFFFAOYSA-N 1 1 340.393 3.527 20 10 EHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Br)[C@H]1[C@@H]1CCCO1 ZINC000862371904 1137140890 /nfs/dbraw/zinc/14/08/90/1137140890.db2.gz NSHMPTKDVDKKNU-GJZGRUSLSA-N 1 1 340.261 3.544 20 10 EHCDMO CS[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000824683378 1137148149 /nfs/dbraw/zinc/14/81/49/1137148149.db2.gz GPXRBYXPBOKOEI-HNNXBMFYSA-N 1 1 335.473 3.522 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1O ZINC000862540359 1137148733 /nfs/dbraw/zinc/14/87/33/1137148733.db2.gz DCZJLLROGPNLOW-CYBMUJFWSA-N 1 1 333.815 3.749 20 10 EHCDMO Oc1ccc([C@@H]2CC[N@H+](Cc3cccc(Br)c3O)C2)cc1 ZINC000862540458 1137148943 /nfs/dbraw/zinc/14/89/43/1137148943.db2.gz FWYRMBOHVLYEJR-CYBMUJFWSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3cccc(Br)c3O)C2)cc1 ZINC000862540458 1137148945 /nfs/dbraw/zinc/14/89/45/1137148945.db2.gz FWYRMBOHVLYEJR-CYBMUJFWSA-N 1 1 348.240 3.850 20 10 EHCDMO CO[C@H]1CC[N@H+](Cc2cc(C)cc(Br)c2O)CC1(C)C ZINC000824820274 1137153780 /nfs/dbraw/zinc/15/37/80/1137153780.db2.gz COMNGHMQHPGGRA-AWEZNQCLSA-N 1 1 342.277 3.710 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1(C)C ZINC000824820274 1137153782 /nfs/dbraw/zinc/15/37/82/1137153782.db2.gz COMNGHMQHPGGRA-AWEZNQCLSA-N 1 1 342.277 3.710 20 10 EHCDMO CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000863542081 1137191372 /nfs/dbraw/zinc/19/13/72/1137191372.db2.gz FLPLAZURLCZRBA-AQUOVQTQSA-N 1 1 347.684 3.599 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@]2(CCOC2)O1 ZINC000794693385 1137234306 /nfs/dbraw/zinc/23/43/06/1137234306.db2.gz IQXDPVTYOMLWBQ-XLIONFOSSA-N 1 1 333.472 3.594 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1O ZINC000844758654 1137250265 /nfs/dbraw/zinc/25/02/65/1137250265.db2.gz XAKYUDYORSDXGJ-SFHVURJKSA-N 1 1 347.361 3.563 20 10 EHCDMO CCN(CC)c1ccc(CNCc2ccc(C[NH3+])cc2F)cc1F ZINC000844904486 1137261317 /nfs/dbraw/zinc/26/13/17/1137261317.db2.gz NVPXMDNBRQYQSU-UHFFFAOYSA-N 1 1 333.426 3.560 20 10 EHCDMO C[N@H+](Cc1ccccc1O)Cc1cc(Br)c(F)cc1O ZINC001144306672 1137270828 /nfs/dbraw/zinc/27/08/28/1137270828.db2.gz LSBKCOVHZJRAFX-UHFFFAOYSA-N 1 1 340.192 3.631 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Br)c(F)cc1O ZINC001144306672 1137270830 /nfs/dbraw/zinc/27/08/30/1137270830.db2.gz LSBKCOVHZJRAFX-UHFFFAOYSA-N 1 1 340.192 3.631 20 10 EHCDMO CCCn1cc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)nn1 ZINC000865435539 1137283605 /nfs/dbraw/zinc/28/36/05/1137283605.db2.gz JYQKDXMSEDRTDP-UHFFFAOYSA-N 1 1 341.503 3.747 20 10 EHCDMO Cc1cc(C[NH2+]Cc2ncnn2C(C)C)c(C)n1-c1cccc(C)c1 ZINC000865642345 1137301187 /nfs/dbraw/zinc/30/11/87/1137301187.db2.gz GDFCFRDHOSAAOQ-UHFFFAOYSA-N 1 1 337.471 3.865 20 10 EHCDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2c(O)cc(O)cc2O)cc1 ZINC001144514483 1137304131 /nfs/dbraw/zinc/30/41/31/1137304131.db2.gz HKCKIRMZFMZOQZ-QGZVFWFLSA-N 1 1 329.396 3.539 20 10 EHCDMO Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)o1 ZINC000865724574 1137306648 /nfs/dbraw/zinc/30/66/48/1137306648.db2.gz YFTLWVGWUDRKMM-UHFFFAOYSA-N 1 1 329.400 3.776 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2scnc2C2CC2)cc1 ZINC000846051122 1137330482 /nfs/dbraw/zinc/33/04/82/1137330482.db2.gz CBUFUWXVQXNIEN-UHFFFAOYSA-N 1 1 331.485 3.597 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000846052189 1137330516 /nfs/dbraw/zinc/33/05/16/1137330516.db2.gz MDZFFFYLQIZUQA-KRWDZBQOSA-N 1 1 347.459 3.586 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846109048 1137332822 /nfs/dbraw/zinc/33/28/22/1137332822.db2.gz SLDVHMVFYFRVAE-ZDUSSCGKSA-N 1 1 332.188 3.776 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846107528 1137332877 /nfs/dbraw/zinc/33/28/77/1137332877.db2.gz IXDJGDBXAAINGL-CYBMUJFWSA-N 1 1 332.188 3.776 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846107528 1137332878 /nfs/dbraw/zinc/33/28/78/1137332878.db2.gz IXDJGDBXAAINGL-CYBMUJFWSA-N 1 1 332.188 3.776 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000846117550 1137333778 /nfs/dbraw/zinc/33/37/78/1137333778.db2.gz PCPKVBHPODCPPL-YYWHXJBOSA-N 1 1 339.435 3.895 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846216414 1137341921 /nfs/dbraw/zinc/34/19/21/1137341921.db2.gz SBETYWUCSICASG-CMPLNLGQSA-N 1 1 346.254 3.803 20 10 EHCDMO C[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc(C(F)(F)F)c1O ZINC000866568261 1137365373 /nfs/dbraw/zinc/36/53/73/1137365373.db2.gz SJGYOXTUUHEJRZ-QMMMGPOBSA-N 1 1 349.303 3.933 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1n1ccnc1 ZINC000121730950 1137383493 /nfs/dbraw/zinc/38/34/93/1137383493.db2.gz NVHYJTXVSKPKGO-PBHICJAKSA-N 1 1 343.471 3.675 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2ncnn2C(C)(C)C)cc1 ZINC000282725563 1137442000 /nfs/dbraw/zinc/44/20/00/1137442000.db2.gz QPUXCCMNAUEDAB-UHFFFAOYSA-N 1 1 343.519 3.949 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027461 1137566083 /nfs/dbraw/zinc/56/60/83/1137566083.db2.gz DRKALZCHTGHBIY-LLVKDONJSA-N 1 1 335.354 3.790 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1[O-] ZINC000873241745 1137595038 /nfs/dbraw/zinc/59/50/38/1137595038.db2.gz YPGPZNACZFYMHI-UXIGCNINSA-N 1 1 341.293 3.713 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000873272885 1137596010 /nfs/dbraw/zinc/59/60/10/1137596010.db2.gz WYTGIXHTEKLPIA-XHDPSFHLSA-N 1 1 341.293 3.584 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)cc1Cl ZINC000825885557 1137654617 /nfs/dbraw/zinc/65/46/17/1137654617.db2.gz HXVYWXMDVWZIMA-CQSZACIVSA-N 1 1 337.769 3.633 20 10 EHCDMO Cc1cccc(O)c1CNc1cccc([C@@H](C)[NH+]2CCOCC2)c1 ZINC000876859162 1137663963 /nfs/dbraw/zinc/66/39/63/1137663963.db2.gz PBQFZTCCNMVGCM-MRXNPFEDSA-N 1 1 326.440 3.706 20 10 EHCDMO Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c(O)c1 ZINC000877033243 1137668217 /nfs/dbraw/zinc/66/82/17/1137668217.db2.gz SIDPXRPSYVJJEH-SEJPIABJSA-N 1 1 336.479 3.986 20 10 EHCDMO CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(F)c(F)c1[O-] ZINC000877145919 1137671673 /nfs/dbraw/zinc/67/16/73/1137671673.db2.gz RXVHVJVXHQKSSK-UHFFFAOYSA-N 1 1 334.410 3.800 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)cc1Cl ZINC000825955785 1137674225 /nfs/dbraw/zinc/67/42/25/1137674225.db2.gz RZGYORNUNRFZES-CYBMUJFWSA-N 1 1 326.227 3.651 20 10 EHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC12CC=CC2 ZINC000877608290 1137682676 /nfs/dbraw/zinc/68/26/76/1137682676.db2.gz UBZVBDHBPOVVSD-NRFANRHFSA-N 1 1 340.511 3.824 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)c1O ZINC000877673204 1137685452 /nfs/dbraw/zinc/68/54/52/1137685452.db2.gz PKXKTPVVPMJSBF-IAGOWNOFSA-N 1 1 347.842 3.752 20 10 EHCDMO C[C@H]1C[C@H](C[N@H+]2Cc3cccc(O)c3C2)CCN1C(=O)OC(C)(C)C ZINC000877703150 1137686452 /nfs/dbraw/zinc/68/64/52/1137686452.db2.gz TWSOZQUYTYGKMX-LSDHHAIUSA-N 1 1 346.471 3.743 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1CCCOC1 ZINC000880465641 1137779410 /nfs/dbraw/zinc/77/94/10/1137779410.db2.gz GVQFDZCMESKHNV-MLGOLLRUSA-N 1 1 325.836 3.543 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cc(F)cc(F)c3O)cn2)CC1 ZINC000882896925 1137837253 /nfs/dbraw/zinc/83/72/53/1137837253.db2.gz VFFWNMBZIGDNOG-UHFFFAOYSA-N 1 1 347.409 3.592 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130670789 1137840672 /nfs/dbraw/zinc/84/06/72/1137840672.db2.gz JWLKCQFJJOGZIG-YWZLYKJASA-N 1 1 327.424 3.753 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1cccc(C)c1C)Cc1ccccc1O ZINC000130725893 1137841428 /nfs/dbraw/zinc/84/14/28/1137841428.db2.gz CJXGESQWDKTTLW-UHFFFAOYSA-N 1 1 326.440 3.860 20 10 EHCDMO Cc1cccc2[nH]c(C[NH2+]Cc3ccc(N4CCN(C)CC4)cc3)cc21 ZINC000883283691 1137852494 /nfs/dbraw/zinc/85/24/94/1137852494.db2.gz OZOQBXYMRTVTIN-UHFFFAOYSA-N 1 1 348.494 3.518 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000883289151 1137852812 /nfs/dbraw/zinc/85/28/12/1137852812.db2.gz FYZFDRFMRYYXER-HNNXBMFYSA-N 1 1 345.437 3.567 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccsc1 ZINC000883291157 1137853041 /nfs/dbraw/zinc/85/30/41/1137853041.db2.gz UNAUWTZTRILPBM-IBGZPJMESA-N 1 1 329.513 3.741 20 10 EHCDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000101905916 1137871977 /nfs/dbraw/zinc/87/19/77/1137871977.db2.gz PLMPMXLGMPMXRC-INIZCTEOSA-N 1 1 340.467 3.674 20 10 EHCDMO C[N@H+](Cc1ccccc1O)C[C@H](O)c1ccc(Cl)cc1Cl ZINC000136360070 1138023618 /nfs/dbraw/zinc/02/36/18/1138023618.db2.gz PLNNMFSVDIXDME-INIZCTEOSA-N 1 1 326.223 3.864 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(N2CCOC2=O)cc1 ZINC000886512538 1138087292 /nfs/dbraw/zinc/08/72/92/1138087292.db2.gz INWAGZAIJTYFKY-STQMWFEESA-N 1 1 344.386 3.900 20 10 EHCDMO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886527879 1138090443 /nfs/dbraw/zinc/09/04/43/1138090443.db2.gz BTQLQLAHPDXTNV-ACJLOTCBSA-N 1 1 333.403 3.703 20 10 EHCDMO C[C@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1c(O)cccc1F ZINC000886535216 1138092134 /nfs/dbraw/zinc/09/21/34/1138092134.db2.gz WPNAAILJPXANKE-QMMMGPOBSA-N 1 1 334.338 3.900 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(O[C@@H]2CCOC2)c1 ZINC000886538149 1138093032 /nfs/dbraw/zinc/09/30/32/1138093032.db2.gz CHCGOHRGBXAWQV-GDBMZVCRSA-N 1 1 345.414 3.858 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774201 1138138158 /nfs/dbraw/zinc/13/81/58/1138138158.db2.gz JTAXCANGDMVUBG-IFXJQAMLSA-N 1 1 347.455 3.569 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H]1CCCOC1 ZINC000886788485 1138140539 /nfs/dbraw/zinc/14/05/39/1138140539.db2.gz CLAMHLMNLUYLSE-RWSFTLGLSA-N 1 1 348.270 3.791 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)[C@@H]1CCCOC1 ZINC000886789533 1138140906 /nfs/dbraw/zinc/14/09/06/1138140906.db2.gz XEDYUGVCIWMLKL-JMSVASOKSA-N 1 1 347.377 3.503 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000091891461 1138222631 /nfs/dbraw/zinc/22/26/31/1138222631.db2.gz VRGPISQPEZGYLJ-QAPCUYQASA-N 1 1 347.480 3.941 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)c1O ZINC000092975653 1138233381 /nfs/dbraw/zinc/23/33/81/1138233381.db2.gz WYLLTKZPLNDKIY-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)c1O ZINC000092975653 1138233384 /nfs/dbraw/zinc/23/33/84/1138233384.db2.gz WYLLTKZPLNDKIY-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)c1O ZINC000092975194 1138233522 /nfs/dbraw/zinc/23/35/22/1138233522.db2.gz AFRVNYSDOVBRHC-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@H](c3ccccc3F)C2)c1O ZINC000092975194 1138233525 /nfs/dbraw/zinc/23/35/25/1138233525.db2.gz AFRVNYSDOVBRHC-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384994 1139088748 /nfs/dbraw/zinc/08/87/48/1139088748.db2.gz YEIFFRBBNYANTO-SJORKVTESA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384994 1139088757 /nfs/dbraw/zinc/08/87/57/1139088757.db2.gz YEIFFRBBNYANTO-SJORKVTESA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384994 1139088766 /nfs/dbraw/zinc/08/87/66/1139088766.db2.gz YEIFFRBBNYANTO-SJORKVTESA-N 1 1 345.506 3.951 20 10 EHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000184691684 1140115234 /nfs/dbraw/zinc/11/52/34/1140115234.db2.gz UVFLPIVXVPPYJF-HNNXBMFYSA-N 1 1 327.852 3.835 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCSC2(CCOCC2)C1 ZINC000184833078 1140121832 /nfs/dbraw/zinc/12/18/32/1140121832.db2.gz HOVVTYLTXZTQNU-UHFFFAOYSA-N 1 1 329.465 3.643 20 10 EHCDMO CC(C)C(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000184913696 1140125814 /nfs/dbraw/zinc/12/58/14/1140125814.db2.gz JDIMTWSHSKOARH-ZDUSSCGKSA-N 1 1 330.403 3.977 20 10 EHCDMO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185470412 1140151372 /nfs/dbraw/zinc/15/13/72/1140151372.db2.gz JKFYMFBORDHRKX-YJYMSZOUSA-N 1 1 333.403 3.703 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(O[C@H]2CCOC2)c1 ZINC000185725633 1140166439 /nfs/dbraw/zinc/16/64/39/1140166439.db2.gz OYTKGGVBWLBXOE-PBHICJAKSA-N 1 1 345.414 3.858 20 10 EHCDMO OCC1CCN(c2ccc(CNc3cc[nH+]cc3Cl)cc2)CC1 ZINC000267296623 1140776330 /nfs/dbraw/zinc/77/63/30/1140776330.db2.gz SXZQJOMIRJYZQV-UHFFFAOYSA-N 1 1 331.847 3.556 20 10 EHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)sc1C ZINC000268703932 1140973608 /nfs/dbraw/zinc/97/36/08/1140973608.db2.gz WAAVHQHORFZBMB-INIZCTEOSA-N 1 1 332.469 3.647 20 10 EHCDMO Cc1nc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)sc1C ZINC000268703932 1140973610 /nfs/dbraw/zinc/97/36/10/1140973610.db2.gz WAAVHQHORFZBMB-INIZCTEOSA-N 1 1 332.469 3.647 20 10 EHCDMO COc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1O ZINC000283173914 1141567169 /nfs/dbraw/zinc/56/71/69/1141567169.db2.gz ZHCIJBYUMSXTOE-CQSZACIVSA-N 1 1 329.362 3.955 20 10 EHCDMO COc1cc(O)c(C[N@@H+](CCc2cccc(F)c2)C2CC2)cc1OC ZINC000160197675 1014307575 /nfs/dbraw/zinc/30/75/75/1014307575.db2.gz DQFBWMQTFZPWFW-UHFFFAOYSA-N 1 1 345.414 3.756 20 10 EHCDMO C[C@@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccccc1O ZINC000183403604 1032167575 /nfs/dbraw/zinc/16/75/75/1032167575.db2.gz OEFLISTXGSYYBD-FZKQIMNGSA-N 1 1 325.387 3.705 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](CCO)Cc2ccc(C)cc2)c1O ZINC000783032436 1017961510 /nfs/dbraw/zinc/96/15/10/1017961510.db2.gz ZKNUVYBUNQKOTC-UHFFFAOYSA-N 1 1 347.842 3.551 20 10 EHCDMO C[N@@H+](Cc1ccc([S@](C)=O)cc1)Cc1cc2c(cc1O)CCCC2 ZINC000160363932 1018614176 /nfs/dbraw/zinc/61/41/76/1018614176.db2.gz YSSVFXJEHXVBMY-XMMPIXPASA-N 1 1 343.492 3.640 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000172772852 1032937532 /nfs/dbraw/zinc/93/75/32/1032937532.db2.gz XPFLVCCSJXUADJ-INIZCTEOSA-N 1 1 348.487 3.861 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](C)c2nnc([C@@H](C)CC)[nH]2)ccc1OC ZINC000276759698 1022644508 /nfs/dbraw/zinc/64/45/08/1022644508.db2.gz ADZMYPJVGXXBRK-UONOGXRCSA-N 1 1 346.475 3.714 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000894746677 1022829402 /nfs/dbraw/zinc/82/94/02/1022829402.db2.gz AVXIRGLKSGKDEC-LMMKCTJWSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000894746677 1022829416 /nfs/dbraw/zinc/82/94/16/1022829416.db2.gz AVXIRGLKSGKDEC-LMMKCTJWSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000894746677 1022829427 /nfs/dbraw/zinc/82/94/27/1022829427.db2.gz AVXIRGLKSGKDEC-LMMKCTJWSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1ccccc1C[N@@H+](C1CCCC1)[C@H]1CCC2(C[C@@H]1F)OCCO2 ZINC000892011946 1024329597 /nfs/dbraw/zinc/32/95/97/1024329597.db2.gz IONOIEMSWSOIJX-ROUUACIJSA-N 1 1 349.446 3.771 20 10 EHCDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc(OC)c(OC)c2O)C1 ZINC000892027113 1024392243 /nfs/dbraw/zinc/39/22/43/1024392243.db2.gz CSLYMTSVFBNVDT-AWEZNQCLSA-N 1 1 325.474 3.517 20 10 EHCDMO COc1cc(C)cc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c1O ZINC000895471920 1024555655 /nfs/dbraw/zinc/55/56/55/1024555655.db2.gz BPPZQRQTDYDPCD-UHFFFAOYSA-N 1 1 330.428 3.502 20 10 EHCDMO CCCC[C@@H](CC)C[N@H+]1CCC2(CN(Cc3ccc(O)c(O)c3)C2)C1 ZINC001279142972 1025460882 /nfs/dbraw/zinc/46/08/82/1025460882.db2.gz XTZAHQMVTWAUGV-QGZVFWFLSA-N 1 1 346.515 3.822 20 10 EHCDMO Cc1c(C[NH2+]Cc2c(O)cccc2F)sc2nc(C)nc(C)c12 ZINC000896640282 1025794816 /nfs/dbraw/zinc/79/48/16/1025794816.db2.gz IPAGZOZZSXVPHZ-UHFFFAOYSA-N 1 1 331.416 3.751 20 10 EHCDMO C[N@@H+](Cc1cnc2ccccn12)Cc1ccc(N2CCCCC2)cc1 ZINC000158267477 1026190093 /nfs/dbraw/zinc/19/00/93/1026190093.db2.gz BXWIHHQWNJMGNP-UHFFFAOYSA-N 1 1 334.467 3.957 20 10 EHCDMO COc1cccc(C[N@@H+](C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000273348272 1027387901 /nfs/dbraw/zinc/38/79/01/1027387901.db2.gz AMGXVOWGDKKHMQ-PKOBYXMFSA-N 1 1 345.414 3.892 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000273384867 1027405740 /nfs/dbraw/zinc/40/57/40/1027405740.db2.gz JDQQDIMNMLCEIN-MNOVXSKESA-N 1 1 335.350 3.869 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2(c3nc(C)cs3)CCC2)c1 ZINC000273475530 1027445995 /nfs/dbraw/zinc/44/59/95/1027445995.db2.gz KUCGJHBLIYJTDZ-LBPRGKRZSA-N 1 1 346.452 3.674 20 10 EHCDMO C[C@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000273583728 1027504891 /nfs/dbraw/zinc/50/48/91/1027504891.db2.gz NGSZRKUTGUFOFP-LBPRGKRZSA-N 1 1 338.423 3.581 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2ccsc2)ccc1[N+](=O)[O-] ZINC000278212217 1029675845 /nfs/dbraw/zinc/67/58/45/1029675845.db2.gz KGNQASREABHUAL-ZDUSSCGKSA-N 1 1 334.397 3.708 20 10 EHCDMO Cc1cc(N[C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)nc(C)n1 ZINC000780544418 1034247417 /nfs/dbraw/zinc/24/74/17/1034247417.db2.gz DZWFFTNFHAAFKB-MRXNPFEDSA-N 1 1 346.862 3.529 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1O ZINC000164282584 1035515635 /nfs/dbraw/zinc/51/56/35/1035515635.db2.gz ARKCLRYLBTZSFJ-MRXNPFEDSA-N 1 1 341.407 3.775 20 10 EHCDMO C[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000186652700 1035679507 /nfs/dbraw/zinc/67/95/07/1035679507.db2.gz DQUVSJOJWCLNBF-BLVKFPJESA-N 1 1 343.377 3.844 20 10 EHCDMO CCn1nc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c2ccccc21 ZINC000274418525 1038949355 /nfs/dbraw/zinc/94/93/55/1038949355.db2.gz JOCRDPSXICIRTG-UHFFFAOYSA-N 1 1 326.419 3.551 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)cc1OC ZINC000784025048 1040821045 /nfs/dbraw/zinc/82/10/45/1040821045.db2.gz DNETWFMIZMERNG-MRXNPFEDSA-N 1 1 327.424 3.707 20 10 EHCDMO CCOC[C@H]1CCCC[N@H+]1Cc1cccc(Br)c1[O-] ZINC000313486832 1042017090 /nfs/dbraw/zinc/01/70/90/1042017090.db2.gz QKTZKIKXOXFPDG-CYBMUJFWSA-N 1 1 328.250 3.546 20 10 EHCDMO CCOC[C@H]1CCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000313486832 1042017098 /nfs/dbraw/zinc/01/70/98/1042017098.db2.gz QKTZKIKXOXFPDG-CYBMUJFWSA-N 1 1 328.250 3.546 20 10 EHCDMO CCOC[C@H]1CCCC[N@H+]1Cc1cccc(Br)c1O ZINC000313486832 1042017107 /nfs/dbraw/zinc/01/71/07/1042017107.db2.gz QKTZKIKXOXFPDG-CYBMUJFWSA-N 1 1 328.250 3.546 20 10 EHCDMO CC[C@H]([NH2+][C@H](Cc1ccccc1)CN(C)C)c1ccc(F)cc1O ZINC000796703169 1042509315 /nfs/dbraw/zinc/50/93/15/1042509315.db2.gz SWCQBXFJODLAAC-MJGOQNOKSA-N 1 1 330.447 3.745 20 10 EHCDMO C[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)[C@H]1CCOC1 ZINC000106858169 1043060822 /nfs/dbraw/zinc/06/08/22/1043060822.db2.gz KKAGRLIUUIWVQR-ZDUSSCGKSA-N 1 1 336.229 3.529 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1ccc(F)cc1O ZINC000185010748 1126735381 /nfs/dbraw/zinc/73/53/81/1126735381.db2.gz GIYVNSUOWYILRN-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185075122 1126751029 /nfs/dbraw/zinc/75/10/29/1126751029.db2.gz CVDGNWLEPSKPRW-HNNXBMFYSA-N 1 1 328.500 3.796 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](c1c(F)cccc1F)N(C)C)c1ccc(F)cc1O ZINC000185458726 1126904338 /nfs/dbraw/zinc/90/43/38/1126904338.db2.gz RTMZBWKUJHPCSN-ZBEGNZNMSA-N 1 1 338.373 3.763 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843125324 1128509489 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EHCDMO CC(C)[N@H+](Cc1nnc(C(C)(C)C)o1)Cc1ccc(N(C)C)cc1 ZINC000917075464 1122473270 /nfs/dbraw/zinc/47/32/70/1122473270.db2.gz WIBUGSRKRDORTI-UHFFFAOYSA-N 1 1 330.476 3.844 20 10 EHCDMO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)o1)Cc1ccc(N(C)C)cc1 ZINC000917075464 1122473273 /nfs/dbraw/zinc/47/32/73/1122473273.db2.gz WIBUGSRKRDORTI-UHFFFAOYSA-N 1 1 330.476 3.844 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1CCc1ccccc1)OCO2 ZINC000917476689 1122612614 /nfs/dbraw/zinc/61/26/14/1122612614.db2.gz GQIPADJPNNAINL-KRWDZBQOSA-N 1 1 325.408 3.718 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000918070940 1122740468 /nfs/dbraw/zinc/74/04/68/1122740468.db2.gz FXWQIRJSXKBBLY-CVEARBPZSA-N 1 1 343.496 3.512 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Oc3cnccn3)cc2)cc1 ZINC000155185456 1123290835 /nfs/dbraw/zinc/29/08/35/1123290835.db2.gz IVXGPOBQWPHJGW-UHFFFAOYSA-N 1 1 348.450 3.967 20 10 EHCDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NCc1ccc(N2CCCCC2)cc1 ZINC000920181257 1123328921 /nfs/dbraw/zinc/32/89/21/1123328921.db2.gz BZHLKCSCZYEHRY-RTBURBONSA-N 1 1 329.532 3.887 20 10 EHCDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(N2CCCCC2)cc1 ZINC000920181257 1123328924 /nfs/dbraw/zinc/32/89/24/1123328924.db2.gz BZHLKCSCZYEHRY-RTBURBONSA-N 1 1 329.532 3.887 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000182317927 1125252089 /nfs/dbraw/zinc/25/20/89/1125252089.db2.gz RZUGYKRUFCBQAV-CHWSQXEVSA-N 1 1 339.395 3.863 20 10 EHCDMO Cc1nn(-c2ccncc2)cc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000355141180 1129626410 /nfs/dbraw/zinc/62/64/10/1129626410.db2.gz ZCXSYTSOZMCBQV-UHFFFAOYSA-N 1 1 345.450 3.666 20 10 EHCDMO COc1ccc(CNCC2([NH+]3CCC(OC)CC3)CCCC2)cc1C ZINC000730817093 1130742136 /nfs/dbraw/zinc/74/21/36/1130742136.db2.gz GPWJIWOKDPEESI-UHFFFAOYSA-N 1 1 346.515 3.517 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)C3=CC(=O)CS3)cc2)C1 ZINC000731869176 1130856539 /nfs/dbraw/zinc/85/65/39/1130856539.db2.gz AOGIZUSVSUSRSD-CYBMUJFWSA-N 1 1 330.453 3.938 20 10 EHCDMO CCOC(=O)[C@@H]1CC12CCC([N@@H+](CC)Cc1ccccc1O)CC2 ZINC001173622551 1132108052 /nfs/dbraw/zinc/10/80/52/1132108052.db2.gz KYQRTDHUACACRM-GNZRSQJKSA-N 1 1 331.456 3.726 20 10 EHCDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2)CCN1Cc1ccccc1 ZINC000379657799 1132241379 /nfs/dbraw/zinc/24/13/79/1132241379.db2.gz UMRBKAGKMSZGNO-GHTZIAJQSA-N 1 1 337.511 3.895 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H]3[C@H]4C=C[C@H](C4)[C@@]3(C)C2)c1[O-] ZINC001176620591 1132972635 /nfs/dbraw/zinc/97/26/35/1132972635.db2.gz UOMZDPGGFWXLQB-XBLMQXIHSA-N 1 1 331.843 3.892 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H]3[C@H]4C=C[C@H](C4)[C@@]3(C)C2)c1O ZINC001176620591 1132972639 /nfs/dbraw/zinc/97/26/39/1132972639.db2.gz UOMZDPGGFWXLQB-XBLMQXIHSA-N 1 1 331.843 3.892 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H]3[C@H]4C=C[C@H](C4)[C@@]3(C)C2)c1O ZINC001176620591 1132972643 /nfs/dbraw/zinc/97/26/43/1132972643.db2.gz UOMZDPGGFWXLQB-XBLMQXIHSA-N 1 1 331.843 3.892 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)Cc1ccc(OC)c(OC)c1 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340.511 3.720 20 10 EHCDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000768529580 1133150302 /nfs/dbraw/zinc/15/03/02/1133150302.db2.gz QGDFMYUZULSSOC-ZDUSSCGKSA-N 1 1 325.836 3.599 20 10 EHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)c(F)c2)o1 ZINC000768540597 1133153156 /nfs/dbraw/zinc/15/31/56/1133153156.db2.gz JVAJWJHUNWBKJB-SFHVURJKSA-N 1 1 332.419 3.968 20 10 EHCDMO COC[C@@H]1CCCC[N@@H+](Cc2cc(C)cc(Br)c2O)C1 ZINC000768541554 1133153965 /nfs/dbraw/zinc/15/39/65/1133153965.db2.gz PHWFGFWWWMVCAU-CYBMUJFWSA-N 1 1 342.277 3.712 20 10 EHCDMO COC[C@@H]1CCCC[N@H+](Cc2cc(C)cc(Br)c2O)C1 ZINC000768541554 1133153964 /nfs/dbraw/zinc/15/39/64/1133153964.db2.gz PHWFGFWWWMVCAU-CYBMUJFWSA-N 1 1 342.277 3.712 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC000769103549 1133232553 /nfs/dbraw/zinc/23/25/53/1133232553.db2.gz YOCIQHNRGNWXBX-SMDDNHRTSA-N 1 1 340.261 3.928 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCN(C(C)=O)C3(CCCCC3)C2)cc1 ZINC000773815689 1133261165 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C[N@@H+](Cc1ccccc1O)C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000770509271 1133435664 /nfs/dbraw/zinc/43/56/64/1133435664.db2.gz KESBXQVFRLELQJ-UHFFFAOYSA-N 1 1 334.460 3.660 20 10 EHCDMO COc1cc(C)cc(C[N@H+](CCN(C)C)Cc2cccc(C)c2)c1O ZINC001181498458 1133493977 /nfs/dbraw/zinc/49/39/77/1133493977.db2.gz XHGCYPILHXIWJB-UHFFFAOYSA-N 1 1 342.483 3.581 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](CCN(C)C)Cc2cccc(C)c2)c1O ZINC001181498458 1133493978 /nfs/dbraw/zinc/49/39/78/1133493978.db2.gz XHGCYPILHXIWJB-UHFFFAOYSA-N 1 1 342.483 3.581 20 10 EHCDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000771939629 1133617592 /nfs/dbraw/zinc/61/75/92/1133617592.db2.gz SIVOWIRLVVQXMC-KRWDZBQOSA-N 1 1 347.459 3.586 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774172382 1133627879 /nfs/dbraw/zinc/62/78/79/1133627879.db2.gz BSZWGRWZUXEXAC-PWSUYJOCSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@H]([NH2+]CCOc1ncccc1F)c1cc(Cl)c(Cl)cc1O ZINC000774268017 1133650604 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COc1c(O)c(C[N@@H+](Cc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000774816127 1134025546 /nfs/dbraw/zinc/02/55/46/1134025546.db2.gz YQXPKMHYJAIGCX-UHFFFAOYSA-N 1 1 346.358 3.613 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C[C@H](O)COc2ccccc2)C(C)C)cc1C ZINC000775201955 1134510520 /nfs/dbraw/zinc/51/05/20/1134510520.db2.gz WPXDIOPSRPSFAJ-IBGZPJMESA-N 1 1 343.467 3.659 20 10 EHCDMO COc1cccc(O)c1C[N@@H+]1CCc2cc(Br)ccc2C1 ZINC000792182157 1134664565 /nfs/dbraw/zinc/66/45/65/1134664565.db2.gz WZGKKHHKJGSRNM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCc2cc(Br)ccc2C1 ZINC000792182157 1134664566 /nfs/dbraw/zinc/66/45/66/1134664566.db2.gz WZGKKHHKJGSRNM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO Cc1cc(C)cc(-n2ncc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)n2)c1 ZINC000775361688 1134666333 /nfs/dbraw/zinc/66/63/33/1134666333.db2.gz DMIVVRILBSPLPS-KRWDZBQOSA-N 1 1 349.482 3.801 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)c1 ZINC000775373088 1134681032 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Cc1ccc(C[N@@H+](CCO)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000793367372 1134913162 /nfs/dbraw/zinc/91/31/62/1134913162.db2.gz ZOHYSEIPWBJYKM-UHFFFAOYSA-N 1 1 328.456 3.573 20 10 EHCDMO CO[C@@]1(C)C[C@H]([NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001194444985 1135274273 /nfs/dbraw/zinc/27/42/73/1135274273.db2.gz GOBJOYHUUSLQFX-YOEHRIQHSA-N 1 1 325.836 3.541 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nc2c(s1)CCC2)C[C@@H]1CCCO1 ZINC000775642811 1135382590 /nfs/dbraw/zinc/38/25/90/1135382590.db2.gz HUMOCQQZPOKHBA-HNNXBMFYSA-N 1 1 344.480 3.519 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1nc2c(s1)CCC2)C[C@@H]1CCCO1 ZINC000775642811 1135382594 /nfs/dbraw/zinc/38/25/94/1135382594.db2.gz HUMOCQQZPOKHBA-HNNXBMFYSA-N 1 1 344.480 3.519 20 10 EHCDMO C[C@@H]([NH2+][C@H](CN(C)C)c1ccc(F)cc1)c1cc(F)cc(F)c1O ZINC000806173110 1135398222 /nfs/dbraw/zinc/39/82/22/1135398222.db2.gz WPTNXCQZIQDOAY-PIGZYNQJSA-N 1 1 338.373 3.763 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cc(OC)ccc1O ZINC000775656934 1135428709 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C[C@H]([NH2+]Cc1nc(-c2ccsc2)no1)c1ccc(N(C)C)cc1 ZINC000775834285 1135798325 /nfs/dbraw/zinc/79/83/25/1135798325.db2.gz MWUNFVSPORGIGX-LBPRGKRZSA-N 1 1 328.441 3.715 20 10 EHCDMO Cc1cccc(-c2noc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)n2)c1 ZINC000775834233 1135798506 /nfs/dbraw/zinc/79/85/06/1135798506.db2.gz PYWLJRTVRXMZTD-HNNXBMFYSA-N 1 1 336.439 3.962 20 10 EHCDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000809711050 1135875730 /nfs/dbraw/zinc/87/57/30/1135875730.db2.gz IFVUDTKEQIATLJ-KRWDZBQOSA-N 1 1 327.424 3.753 20 10 EHCDMO C[C@H]1[C@H](N2CCCC2)CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724147 1135879162 /nfs/dbraw/zinc/87/91/62/1135879162.db2.gz FKQKDCNZLWWENT-GHTZIAJQSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724147 1135879164 /nfs/dbraw/zinc/87/91/64/1135879164.db2.gz FKQKDCNZLWWENT-GHTZIAJQSA-N 1 1 327.516 3.736 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1O ZINC000776013957 1135918239 /nfs/dbraw/zinc/91/82/39/1135918239.db2.gz LPVICNYGBQMODY-NRFANRHFSA-N 1 1 339.435 3.812 20 10 EHCDMO CSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2[O-])CC[NH+](C)CC1 ZINC000810252175 1135948906 /nfs/dbraw/zinc/94/89/06/1135948906.db2.gz KQTILLTYJZNONS-GFCCVEGCSA-N 1 1 328.909 3.524 20 10 EHCDMO CSc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000811454042 1136088994 /nfs/dbraw/zinc/08/89/94/1136088994.db2.gz FVUYKQWDGLWRFY-UHFFFAOYSA-N 1 1 348.537 3.939 20 10 EHCDMO CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)[C@H]1[C@@H]1CCCO1 ZINC000811511094 1136102042 /nfs/dbraw/zinc/10/20/42/1136102042.db2.gz UWKWDVPXJOTGJY-GJZGRUSLSA-N 1 1 340.261 3.544 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2COC(=O)NC2CCCC2)c1 ZINC000811510739 1136102996 /nfs/dbraw/zinc/10/29/96/1136102996.db2.gz NWMZOAXCOLVIDP-GOSISDBHSA-N 1 1 346.471 3.724 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CCC[C@@H](C)O2)c1 ZINC000850379299 1136246060 /nfs/dbraw/zinc/24/60/60/1136246060.db2.gz KIBMNSMCWPYRHA-YPMHNXCESA-N 1 1 328.250 3.510 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOCC(F)(F)F)Cc1ccco1 ZINC000109760935 1136339271 /nfs/dbraw/zinc/33/92/71/1136339271.db2.gz FXRIUBJDFIFIRA-UHFFFAOYSA-N 1 1 329.318 3.566 20 10 EHCDMO C[C@@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1ccc2ccccc2c1 ZINC000109770278 1136340072 /nfs/dbraw/zinc/34/00/72/1136340072.db2.gz GEYIJMKJTWEMDO-MRXNPFEDSA-N 1 1 348.446 3.855 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1 ZINC000852522408 1136462394 /nfs/dbraw/zinc/46/23/94/1136462394.db2.gz JQZWYNYMYOCRHH-RBBKRZOGSA-N 1 1 338.495 3.741 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c1O ZINC000852594310 1136469358 /nfs/dbraw/zinc/46/93/58/1136469358.db2.gz BGHDJTRXNZFKTI-RDTXWAMCSA-N 1 1 335.419 3.515 20 10 EHCDMO c1cc(N2CCCCC2)ccc1CNC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093129 1136508635 /nfs/dbraw/zinc/50/86/35/1136508635.db2.gz DCIFCCYJDNHUPY-NRFANRHFSA-N 1 1 341.543 3.889 20 10 EHCDMO c1cc(N2CCCCC2)ccc1CNC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853093129 1136508638 /nfs/dbraw/zinc/50/86/38/1136508638.db2.gz DCIFCCYJDNHUPY-NRFANRHFSA-N 1 1 341.543 3.889 20 10 EHCDMO CC[N@@H+](CCC1(OC)CCC1)Cc1cc(Br)ccc1O ZINC000815054799 1136540565 /nfs/dbraw/zinc/54/05/65/1136540565.db2.gz MNFKXLBPQIQDNA-UHFFFAOYSA-N 1 1 342.277 3.936 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074190 1136547176 /nfs/dbraw/zinc/54/71/76/1136547176.db2.gz LDUONBXRLRHGPX-WIYYLYMNSA-N 1 1 327.516 3.510 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074190 1136547178 /nfs/dbraw/zinc/54/71/78/1136547178.db2.gz LDUONBXRLRHGPX-WIYYLYMNSA-N 1 1 327.516 3.510 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)ccc1N(C)C ZINC000815105793 1136557070 /nfs/dbraw/zinc/55/70/70/1136557070.db2.gz LNXZGLDUGXABHL-TYPHKJRUSA-N 1 1 330.516 3.967 20 10 EHCDMO Fc1cc(CNc2ccc(C3CCC3)c[nH+]2)ccc1N1CCOCC1 ZINC000815160878 1136558837 /nfs/dbraw/zinc/55/88/37/1136558837.db2.gz PXTSQLRVZMIAPA-UHFFFAOYSA-N 1 1 341.430 3.937 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1F)c1cccc(C(F)(F)F)c1O ZINC000815563291 1136611204 /nfs/dbraw/zinc/61/12/04/1136611204.db2.gz YIJUUTOWLDPHJZ-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815564672 1136611762 /nfs/dbraw/zinc/61/17/62/1136611762.db2.gz PIPRCTGGEBMHGV-CIISACIHSA-N 1 1 337.341 3.720 20 10 EHCDMO C[C@H]([NH2+]Cc1cnn2ccccc12)c1cccc(C(F)(F)F)c1O ZINC000815625680 1136620767 /nfs/dbraw/zinc/62/07/67/1136620767.db2.gz JYVSXQRCSIBSAO-NSHDSACASA-N 1 1 335.329 3.910 20 10 EHCDMO CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000815633470 1136621847 /nfs/dbraw/zinc/62/18/47/1136621847.db2.gz OQBREGDNZZWRAT-WDEREUQCSA-N 1 1 347.286 3.902 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCO[C@@H](C2CC2)C1)CCCC3 ZINC000776767436 1136656182 /nfs/dbraw/zinc/65/61/82/1136656182.db2.gz HPGZJTMWLKOMCT-LJQANCHMSA-N 1 1 327.424 3.628 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3c(C)cc(C)cc3C2)cc1OC ZINC000776776130 1136663778 /nfs/dbraw/zinc/66/37/78/1136663778.db2.gz WCTHSRHLKBEOKQ-UHFFFAOYSA-N 1 1 327.424 3.585 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)cc1F ZINC000816482954 1136723847 /nfs/dbraw/zinc/72/38/47/1136723847.db2.gz ZUKJDMYBKRKDFA-UHFFFAOYSA-N 1 1 327.758 3.964 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc1F ZINC000816482954 1136723848 /nfs/dbraw/zinc/72/38/48/1136723848.db2.gz ZUKJDMYBKRKDFA-UHFFFAOYSA-N 1 1 327.758 3.964 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000816513932 1136729218 /nfs/dbraw/zinc/72/92/18/1136729218.db2.gz HRDWAMUZELXKHX-CQSZACIVSA-N 1 1 326.843 3.635 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000816528591 1136730013 /nfs/dbraw/zinc/73/00/13/1136730013.db2.gz JKVBBIOMTKHLJL-OAHLLOKOSA-N 1 1 338.810 3.704 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(-n2cncn2)cc1 ZINC000816530596 1136730770 /nfs/dbraw/zinc/73/07/70/1136730770.db2.gz NPSJLVBPWXBAMD-NSHDSACASA-N 1 1 346.793 3.616 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000816552731 1136736097 /nfs/dbraw/zinc/73/60/97/1136736097.db2.gz UTKXICJJBHQJTH-OAHLLOKOSA-N 1 1 330.186 3.661 20 10 EHCDMO OC[C@H](C1CC1)[N@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816569396 1136738103 /nfs/dbraw/zinc/73/81/03/1136738103.db2.gz KBORLYVEGGBFTQ-GOSISDBHSA-N 1 1 349.833 3.958 20 10 EHCDMO OC[C@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816569396 1136738106 /nfs/dbraw/zinc/73/81/06/1136738106.db2.gz KBORLYVEGGBFTQ-GOSISDBHSA-N 1 1 349.833 3.958 20 10 EHCDMO O[C@@H]1CCC[N@@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC000816667642 1136747074 /nfs/dbraw/zinc/74/70/74/1136747074.db2.gz SORKRUMMVBNHNF-OAQYLSRUSA-N 1 1 336.479 3.596 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1OC ZINC000817366565 1136803685 /nfs/dbraw/zinc/80/36/85/1136803685.db2.gz YNJDVLXPIOWRLV-LLVKDONJSA-N 1 1 333.350 3.574 20 10 EHCDMO CCCOc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938275 1136847814 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3.537 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCCC(F)(F)CC3)cc2)CC1 ZINC000859541422 1137018989 /nfs/dbraw/zinc/01/89/89/1137018989.db2.gz ZHCJJGVNPYTCQY-UHFFFAOYSA-N 1 1 338.442 3.923 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCCO1 ZINC000823433051 1137099340 /nfs/dbraw/zinc/09/93/40/1137099340.db2.gz QBJZEPHNSWOEDZ-INIZCTEOSA-N 1 1 330.497 3.995 20 10 EHCDMO CCOC(=O)C[N@H+](Cc1ccccc1O)CC1CCC(F)(F)CC1 ZINC000823576470 1137104708 /nfs/dbraw/zinc/10/47/08/1137104708.db2.gz PCQDCFCURIHDEH-UHFFFAOYSA-N 1 1 341.398 3.583 20 10 EHCDMO CCCn1nccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000824474114 1137139069 /nfs/dbraw/zinc/13/90/69/1137139069.db2.gz INKKKWVDZVOABS-UHFFFAOYSA-N 1 1 326.488 3.915 20 10 EHCDMO CCCn1nccc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000824474114 1137139070 /nfs/dbraw/zinc/13/90/70/1137139070.db2.gz INKKKWVDZVOABS-UHFFFAOYSA-N 1 1 326.488 3.915 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1F ZINC000862384316 1137141562 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O[C@@H]1CCC[C@H]1[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000824714392 1137149768 /nfs/dbraw/zinc/14/97/68/1137149768.db2.gz CURUWGAZOYDMAK-PWRODBHTSA-N 1 1 328.500 3.802 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@H]1C ZINC000824815693 1137153459 /nfs/dbraw/zinc/15/34/59/1137153459.db2.gz WYSJJCDQRHAGSZ-IERDGZPVSA-N 1 1 341.451 3.828 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2nnc3n2CCCCC3)cc1Cl ZINC000825097790 1137165327 /nfs/dbraw/zinc/16/53/27/1137165327.db2.gz ZOAKRHBILJOUCN-LBPRGKRZSA-N 1 1 334.851 3.523 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000825412360 1137177065 /nfs/dbraw/zinc/17/70/65/1137177065.db2.gz HMAZOUVZRXYRLT-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO C[C@@]1(O)CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1 ZINC000794672331 1137222874 /nfs/dbraw/zinc/22/28/74/1137222874.db2.gz LPTDPWSFYDZFRB-HXUWFJFHSA-N 1 1 329.440 3.754 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@]2(CCOC2)O1 ZINC000794690575 1137234053 /nfs/dbraw/zinc/23/40/53/1137234053.db2.gz BKUWLDDIPLZBGJ-UTKZUKDTSA-N 1 1 347.499 3.768 20 10 EHCDMO CC[N@H+](Cc1cccnc1)Cc1cc(Br)c(F)cc1O ZINC001144300212 1137267721 /nfs/dbraw/zinc/26/77/21/1137267721.db2.gz XLQHKQSJLIJWPW-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[N@@H+](Cc1cccnc1)Cc1cc(Br)c(F)cc1O ZINC001144300212 1137267723 /nfs/dbraw/zinc/26/77/23/1137267723.db2.gz XLQHKQSJLIJWPW-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC(C)n1ncnc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000865435678 1137283742 /nfs/dbraw/zinc/28/37/42/1137283742.db2.gz NOGZUJGXGLBBTR-UHFFFAOYSA-N 1 1 341.503 3.918 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](c2ccccc2F)[C@H](C)O)ccc1OC ZINC000846018567 1137326271 /nfs/dbraw/zinc/32/62/71/1137326271.db2.gz UNSCMMUSORTJKY-XOBRGWDASA-N 1 1 347.430 3.583 20 10 EHCDMO CCC[N@H+]1CCCC[C@@H]1C(=O)NCc1ccc(N(CC)CC)c(F)c1 ZINC001144978529 1137377386 /nfs/dbraw/zinc/37/73/86/1137377386.db2.gz RHLJNNILZSTSEX-LJQANCHMSA-N 1 1 349.494 3.553 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](c3cc(C)ccn3)C2)c1O ZINC000846981755 1137380310 /nfs/dbraw/zinc/38/03/10/1137380310.db2.gz WFNYAVSGQZJNDJ-CQSZACIVSA-N 1 1 344.842 3.941 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc(F)n1)c1ccc(N2CCOCC2)cc1Cl ZINC000773085293 1137464433 /nfs/dbraw/zinc/46/44/33/1137464433.db2.gz HCDSEDZWTIDMQQ-ZDUSSCGKSA-N 1 1 349.837 3.562 20 10 EHCDMO CCOC(=O)C[N@H+](CCCCc1ccccc1)Cc1ccccc1O ZINC001171390267 1137468626 /nfs/dbraw/zinc/46/86/26/1137468626.db2.gz JMRYOXSEXQBVPE-UHFFFAOYSA-N 1 1 341.451 3.780 20 10 EHCDMO CCOC(=O)C[N@@H+](CCCCc1ccccc1)Cc1ccccc1O ZINC001171390267 1137468627 /nfs/dbraw/zinc/46/86/27/1137468627.db2.gz JMRYOXSEXQBVPE-UHFFFAOYSA-N 1 1 341.451 3.780 20 10 EHCDMO C[C@H]([NH2+]CCC[C@@H]1CCOC1=O)c1cc(Cl)c(Cl)cc1O ZINC000872113867 1137571960 /nfs/dbraw/zinc/57/19/60/1137571960.db2.gz RLNJEIXDIKLJPG-VHSXEESVSA-N 1 1 332.227 3.693 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000872814858 1137584919 /nfs/dbraw/zinc/58/49/19/1137584919.db2.gz VUWLXFPMTIVPHG-INIZCTEOSA-N 1 1 325.330 3.699 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1[N+](=O)[O-] ZINC000873183764 1137592903 /nfs/dbraw/zinc/59/29/03/1137592903.db2.gz HBEBGKPFJSYBTL-LLVKDONJSA-N 1 1 335.354 3.790 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)Cc1c(C)cccc1O ZINC000876536974 1137654836 /nfs/dbraw/zinc/65/48/36/1137654836.db2.gz IOMNOXFXRYIUKK-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccn(C(F)F)c1=O ZINC000876584922 1137656201 /nfs/dbraw/zinc/65/62/01/1137656201.db2.gz SUDFLAXHTVNFGD-UHFFFAOYSA-N 1 1 349.425 3.720 20 10 EHCDMO COc1cc(C[N@@H+]2Cc3cccc(O)c3C2)c(SC)cc1OC ZINC000877702799 1137686426 /nfs/dbraw/zinc/68/64/26/1137686426.db2.gz HWXWTCRHHPNVQV-UHFFFAOYSA-N 1 1 331.437 3.647 20 10 EHCDMO COc1cc(C[N@H+]2Cc3cccc(O)c3C2)c(SC)cc1OC ZINC000877702799 1137686427 /nfs/dbraw/zinc/68/64/27/1137686427.db2.gz HWXWTCRHHPNVQV-UHFFFAOYSA-N 1 1 331.437 3.647 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3cc(C(C)C)n[nH]3)C2)c1O ZINC000877785463 1137689970 /nfs/dbraw/zinc/68/99/70/1137689970.db2.gz ZJFLBNIHFRXJJD-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(C[N@@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000877785463 1137689971 /nfs/dbraw/zinc/68/99/71/1137689971.db2.gz ZJFLBNIHFRXJJD-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000877785463 1137689972 /nfs/dbraw/zinc/68/99/72/1137689972.db2.gz ZJFLBNIHFRXJJD-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO CCC[N@@H+](Cc1nnc(-c2ccccc2O)o1)Cc1ccccc1O ZINC000878151456 1137704478 /nfs/dbraw/zinc/70/44/78/1137704478.db2.gz QUSMJNAUHDYYLF-UHFFFAOYSA-N 1 1 339.395 3.560 20 10 EHCDMO Cc1cc(C[NH2+]C2(c3ncccn3)CCC2)ccc1N1CCCCC1 ZINC000880368245 1137776624 /nfs/dbraw/zinc/77/66/24/1137776624.db2.gz UFECAKFXPQJLPH-UHFFFAOYSA-N 1 1 336.483 3.944 20 10 EHCDMO COc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1OC(F)F ZINC000882884403 1137836914 /nfs/dbraw/zinc/83/69/14/1137836914.db2.gz IAOFJQODVZUIIX-UHFFFAOYSA-N 1 1 345.292 3.570 20 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/nfs/dbraw/zinc/89/73/42/1137897342.db2.gz OXHYBZSVYSWVGO-NSHDSACASA-N 1 1 343.452 3.500 20 10 EHCDMO Cc1sc2[nH]c([C@H](C)[N@@H+](C)Cc3ccccc3O)nc(=O)c2c1C ZINC000109772207 1137897343 /nfs/dbraw/zinc/89/73/43/1137897343.db2.gz OXHYBZSVYSWVGO-NSHDSACASA-N 1 1 343.452 3.500 20 10 EHCDMO C[C@@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1c(O)cccc1F ZINC000886522296 1138089314 /nfs/dbraw/zinc/08/93/14/1138089314.db2.gz GTRLGADMHXGUBN-GFCCVEGCSA-N 1 1 338.423 3.581 20 10 EHCDMO Cc1noc(C[C@H]([NH2+][C@@H](C)c2c(O)cccc2F)c2ccccc2)n1 ZINC000886601264 1138100714 /nfs/dbraw/zinc/10/07/14/1138100714.db2.gz NUYPMFWNJNUDQT-LRDDRELGSA-N 1 1 341.386 3.857 20 10 EHCDMO CC[C@@H]([NH2+]Cc1nc(Cc2ccccc2F)no1)c1ccccc1O ZINC000886714797 1138124028 /nfs/dbraw/zinc/12/40/28/1138124028.db2.gz VHTAYMIPUJFHSN-MRXNPFEDSA-N 1 1 341.386 3.746 20 10 EHCDMO Cc1cc(C[C@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n[nH]1 ZINC000090531360 1138211622 /nfs/dbraw/zinc/21/16/22/1138211622.db2.gz QOPYMRRCQJILNM-DOTOQJQBSA-N 1 1 326.488 3.990 20 10 EHCDMO C[N@@H+](CCCCC(F)(F)F)Cc1ccc(N2CCOCC2)cc1 ZINC000130997687 1138489267 /nfs/dbraw/zinc/48/92/67/1138489267.db2.gz BNVNGLIMTHKEIQ-UHFFFAOYSA-N 1 1 330.394 3.688 20 10 EHCDMO Cc1ncc(C[N@H+](C)Cc2cc(Br)ccc2O)s1 ZINC000179380544 1139754223 /nfs/dbraw/zinc/75/42/23/1139754223.db2.gz XBQLGPXJQYYZIF-UHFFFAOYSA-N 1 1 327.247 3.552 20 10 EHCDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@H](C)c1cccc(O)c1 ZINC000179770810 1139782017 /nfs/dbraw/zinc/78/20/17/1139782017.db2.gz YSGLMGAWUYAWFK-CYBMUJFWSA-N 1 1 331.412 3.698 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1C)Cc1cccc(C)c1O ZINC000180441933 1139836152 /nfs/dbraw/zinc/83/61/52/1139836152.db2.gz NUVVADGUHRUBIT-UHFFFAOYSA-N 1 1 326.440 3.778 20 10 EHCDMO CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Br)ccc2[O-])C1 ZINC000185112007 1140136305 /nfs/dbraw/zinc/13/63/05/1140136305.db2.gz YMVFLQLOYRAMHF-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Br)ccc2[O-])C1 ZINC000185112007 1140136309 /nfs/dbraw/zinc/13/63/09/1140136309.db2.gz YMVFLQLOYRAMHF-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc(F)cc1O ZINC000185661494 1140161791 /nfs/dbraw/zinc/16/17/91/1140161791.db2.gz BETIAMHYCNXIKK-HNNXBMFYSA-N 1 1 339.414 3.821 20 10 EHCDMO CCc1ncc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000271033313 1141297424 /nfs/dbraw/zinc/29/74/24/1141297424.db2.gz ZQYMWMCZKBOHTD-HNNXBMFYSA-N 1 1 332.469 3.592 20 10 EHCDMO CC[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccc(N(C)C)cc1 ZINC000271452185 1141370759 /nfs/dbraw/zinc/37/07/59/1141370759.db2.gz IIOLMYPMLLKJQZ-QZTJIDSGSA-N 1 1 334.410 3.805 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874309 201114224 /nfs/dbraw/zinc/11/42/24/201114224.db2.gz RFPFCDWPSHWPCC-DKICVRJWSA-N 1 1 328.431 3.875 20 10 EHCDMO CC(C)[N@H+](Cc1nnc(C2CCC2)n1C)Cc1ccc(N(C)C)cc1 ZINC000782910767 1016659807 /nfs/dbraw/zinc/65/98/07/1016659807.db2.gz PGRIGCVVFMEVQU-UHFFFAOYSA-N 1 1 341.503 3.559 20 10 EHCDMO CC(C)[N@@H+](Cc1nnc(C2CCC2)n1C)Cc1ccc(N(C)C)cc1 ZINC000782910767 1016659812 /nfs/dbraw/zinc/65/98/12/1016659812.db2.gz PGRIGCVVFMEVQU-UHFFFAOYSA-N 1 1 341.503 3.559 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(Br)ccc2O)CC1 ZINC000280348508 1020306172 /nfs/dbraw/zinc/30/61/72/1020306172.db2.gz SPWNIOPMKUOGMT-HNNXBMFYSA-N 1 1 328.250 3.546 20 10 EHCDMO COC(=O)c1cc2cc(C[N@@H+](C)Cc3ccccc3O)ccc2o1 ZINC000172798572 1032946626 /nfs/dbraw/zinc/94/66/26/1032946626.db2.gz STRVKYKBCSLTPO-UHFFFAOYSA-N 1 1 325.364 3.557 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2cccc(=O)[nH]2)ccc1N1CCCCC1 ZINC000933402842 1021679092 /nfs/dbraw/zinc/67/90/92/1021679092.db2.gz YPSVOONEURGQDR-UHFFFAOYSA-N 1 1 325.456 3.718 20 10 EHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(OC)c(OC)c2O)cc1 ZINC000891565869 1021947772 /nfs/dbraw/zinc/94/77/72/1021947772.db2.gz KMRZABRUTRCHPM-CYBMUJFWSA-N 1 1 331.412 3.611 20 10 EHCDMO CCCC[N@@H+](Cc1c2c(nn1C)CCSC2)Cc1ccccc1O ZINC000894678767 1022700814 /nfs/dbraw/zinc/70/08/14/1022700814.db2.gz HQWKPAPYJSTTQI-UHFFFAOYSA-N 1 1 345.512 3.717 20 10 EHCDMO COc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1O ZINC000151132888 1024056891 /nfs/dbraw/zinc/05/68/91/1024056891.db2.gz AMYYZXGLFBYGNA-LJQANCHMSA-N 1 1 339.391 3.882 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000796680243 1024114515 /nfs/dbraw/zinc/11/45/15/1024114515.db2.gz BVHPOQDGDBWSLH-GOSISDBHSA-N 1 1 325.387 3.958 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)Cc2cccnc2)c1 ZINC000897970961 1033246335 /nfs/dbraw/zinc/24/63/35/1033246335.db2.gz VXKYYDCPCNNJLS-LBPRGKRZSA-N 1 1 335.245 3.579 20 10 EHCDMO Cc1nn(C(C)C)cc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000281688717 1025353263 /nfs/dbraw/zinc/35/32/63/1025353263.db2.gz RXRBBFYINRALJQ-IBGZPJMESA-N 1 1 343.471 3.659 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC000896515734 1025525311 /nfs/dbraw/zinc/52/53/11/1025525311.db2.gz HSKYPJSEHALJNB-CYBMUJFWSA-N 1 1 344.480 3.726 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(-n2ccnc2C)nc1)c1ccc(F)cc1O ZINC000286093822 1025567541 /nfs/dbraw/zinc/56/75/41/1025567541.db2.gz MWDJOBYSONDXED-KRWDZBQOSA-N 1 1 340.402 3.661 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(C(F)(F)F)n(C)n2)cc1 ZINC000898022955 1033293967 /nfs/dbraw/zinc/29/39/67/1033293967.db2.gz NVMBYMMTHFVPRQ-UHFFFAOYSA-N 1 1 340.393 3.575 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(OC)cc2)c1 ZINC000273462138 1027438710 /nfs/dbraw/zinc/43/87/10/1027438710.db2.gz CWAKOJOPRAYUJI-CHWSQXEVSA-N 1 1 329.396 3.599 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000273533784 1027477665 /nfs/dbraw/zinc/47/76/65/1027477665.db2.gz VNRNOGUEAQFBHD-FXAWDEMLSA-N 1 1 345.414 3.892 20 10 EHCDMO C[C@@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000273583725 1027505033 /nfs/dbraw/zinc/50/50/33/1027505033.db2.gz NGSZRKUTGUFOFP-GFCCVEGCSA-N 1 1 338.423 3.581 20 10 EHCDMO Cc1c2ccccc2n(C)c1CNC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000525942386 1030239214 /nfs/dbraw/zinc/23/92/14/1030239214.db2.gz FMPHUFIILUHPTJ-UHFFFAOYSA-N 1 1 341.499 3.758 20 10 EHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000160267631 1030644241 /nfs/dbraw/zinc/64/42/41/1030644241.db2.gz BDLOFBCUXHOBSW-AWEZNQCLSA-N 1 1 325.474 3.517 20 10 EHCDMO COc1ccc(CC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)cn1 ZINC000527989752 1031548538 /nfs/dbraw/zinc/54/85/38/1031548538.db2.gz GIGVAOPYDXTVCQ-LLVKDONJSA-N 1 1 340.345 3.708 20 10 EHCDMO COc1cc(O)c(C[NH2+][C@H](c2ccco2)c2ccccc2)cc1OC ZINC000181030467 1031937692 /nfs/dbraw/zinc/93/76/92/1031937692.db2.gz DCDTYFJAJBBSJG-FQEVSTJZSA-N 1 1 339.391 3.882 20 10 EHCDMO COC(=O)[C@@H](C)C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000780893050 1033841781 /nfs/dbraw/zinc/84/17/81/1033841781.db2.gz MJDSZZNIOLBXTK-HNNXBMFYSA-N 1 1 339.435 3.833 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc2c(cc1OC)OCO2 ZINC000761185706 1034312619 /nfs/dbraw/zinc/31/26/19/1034312619.db2.gz TXVKFUZVUOUVFZ-UHFFFAOYSA-N 1 1 342.439 3.512 20 10 EHCDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000179764075 1034598985 /nfs/dbraw/zinc/59/89/85/1034598985.db2.gz LXXUIHIBHHIZQY-JXFKEZNVSA-N 1 1 340.467 3.872 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000179717308 1037901185 /nfs/dbraw/zinc/90/11/85/1037901185.db2.gz OSXHJOXSMPUCFS-OAQYLSRUSA-N 1 1 334.419 3.808 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000179717308 1037901205 /nfs/dbraw/zinc/90/12/05/1037901205.db2.gz OSXHJOXSMPUCFS-OAQYLSRUSA-N 1 1 334.419 3.808 20 10 EHCDMO C[C@H]([NH2+]CC1CC2(C1)OCCO2)c1cc(Cl)c(Cl)cc1O ZINC000927001030 1038556846 /nfs/dbraw/zinc/55/68/46/1038556846.db2.gz LEQYUXGEBAEYSH-VIFPVBQESA-N 1 1 332.227 3.503 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000905679265 1039035800 /nfs/dbraw/zinc/03/58/00/1039035800.db2.gz VDWZXDOFMSLNKM-OAHLLOKOSA-N 1 1 340.320 3.807 20 10 EHCDMO Cc1cnc(Cl)c(CNC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000898446799 1039058712 /nfs/dbraw/zinc/05/87/12/1039058712.db2.gz BNPAVZUMWHSJNK-GOSISDBHSA-N 1 1 346.906 3.502 20 10 EHCDMO Oc1cc2c(cc1CNc1ccc([NH+]3CCCCC3)cc1)OCO2 ZINC000120133898 1040513209 /nfs/dbraw/zinc/51/32/09/1040513209.db2.gz RPJNNQZIOCCFSW-UHFFFAOYSA-N 1 1 326.396 3.723 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000164276875 1041231277 /nfs/dbraw/zinc/23/12/77/1041231277.db2.gz IHZRLBGPOMKZIM-KXBFYZLASA-N 1 1 327.424 3.671 20 10 EHCDMO Cn1cnnc1[C@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000093809858 1042543021 /nfs/dbraw/zinc/54/30/21/1042543021.db2.gz RLWYTBZYLUGLKX-GOSISDBHSA-N 1 1 334.423 3.525 20 10 EHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2n[nH]cc2Br)c1O ZINC000808697821 1135726093 /nfs/dbraw/zinc/72/60/93/1135726093.db2.gz WMLIVFMQBFIKCY-MRVPVSSYSA-N 1 1 344.640 3.690 20 10 EHCDMO C[C@@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000764811460 1127537410 /nfs/dbraw/zinc/53/74/10/1127537410.db2.gz ZNULRHSFFDCQOH-OXQOHEQNSA-N 1 1 334.467 3.926 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)CC12CCCCC2 ZINC000764954362 1127557214 /nfs/dbraw/zinc/55/72/14/1127557214.db2.gz JQJJHBOWBVQGES-RDTXWAMCSA-N 1 1 331.456 3.610 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)N(C)C)cc1)Cc1c(O)cccc1Cl ZINC000131722677 1128684916 /nfs/dbraw/zinc/68/49/16/1128684916.db2.gz WPPXQCUNTLZKNU-UHFFFAOYSA-N 1 1 346.858 3.770 20 10 EHCDMO CCN(CC)c1ccc(CN[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648903187 1120064213 /nfs/dbraw/zinc/06/42/13/1120064213.db2.gz JFKZQMZWBNHALN-OTWHNJEPSA-N 1 1 331.548 3.989 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648903187 1120064219 /nfs/dbraw/zinc/06/42/19/1120064219.db2.gz JFKZQMZWBNHALN-OTWHNJEPSA-N 1 1 331.548 3.989 20 10 EHCDMO Cc1cc(Br)cc(C[NH+]2CC(C)(C)OC(C)(C)C2)c1O ZINC000226455353 1120159452 /nfs/dbraw/zinc/15/94/52/1120159452.db2.gz JYVHGWAQAYYHPB-UHFFFAOYSA-N 1 1 342.277 3.853 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccccc1Cl)Cc1cc2c(cc1O)CCC2 ZINC000915813822 1121639787 /nfs/dbraw/zinc/63/97/87/1121639787.db2.gz ROSKYDLFFKTZFI-UHFFFAOYSA-N 1 1 344.842 3.605 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccccc1Cl)Cc1cc2c(cc1O)CCC2 ZINC000915813822 1121639789 /nfs/dbraw/zinc/63/97/89/1121639789.db2.gz ROSKYDLFFKTZFI-UHFFFAOYSA-N 1 1 344.842 3.605 20 10 EHCDMO CC(C)(C)c1cccc(C[N@H+]2CCCC[C@](O)(C(F)(F)F)C2)c1O ZINC001143103598 1129059225 /nfs/dbraw/zinc/05/92/25/1129059225.db2.gz GLIHDQCZSMQTOG-QGZVFWFLSA-N 1 1 345.405 3.969 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCOCC(F)(F)F)C2CC2)cc1 ZINC000919731136 1123138259 /nfs/dbraw/zinc/13/82/59/1123138259.db2.gz PGAUZYDDRJUADA-UHFFFAOYSA-N 1 1 330.394 3.686 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc(OC)c1 ZINC000919953357 1123244491 /nfs/dbraw/zinc/24/44/91/1123244491.db2.gz JJLZBPZKHYBXSV-UHFFFAOYSA-N 1 1 327.424 3.530 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1O ZINC000179792475 1123859407 /nfs/dbraw/zinc/85/94/07/1123859407.db2.gz CDYWIUZKHUVEMQ-INIZCTEOSA-N 1 1 348.487 3.780 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000182317890 1125252275 /nfs/dbraw/zinc/25/22/75/1125252275.db2.gz RZUGYKRUFCBQAV-OLZOCXBDSA-N 1 1 339.395 3.863 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000182318275 1125252400 /nfs/dbraw/zinc/25/24/00/1125252400.db2.gz XXKGNIWJVNZEQW-OLZOCXBDSA-N 1 1 339.395 3.863 20 10 EHCDMO Cc1c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)nnn1-c1ccccc1 ZINC000766030619 1129848975 /nfs/dbraw/zinc/84/89/75/1129848975.db2.gz VBZJEOMEWDXYRK-INIZCTEOSA-N 1 1 349.482 3.801 20 10 EHCDMO CCN(CC)c1ccc(CNC(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC000731373528 1130792353 /nfs/dbraw/zinc/79/23/53/1130792353.db2.gz KPANOHZIMMKLET-XHSDSOJGSA-N 1 1 349.494 3.549 20 10 EHCDMO C[C@@H]1CCCC[C@H]1NC(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731847746 1130850223 /nfs/dbraw/zinc/85/02/23/1130850223.db2.gz NIFPTBNSOIMZJY-VQIMIIECSA-N 1 1 344.499 3.832 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1COc2ccccc2O1)C1CCCC1 ZINC000733613462 1131061520 /nfs/dbraw/zinc/06/15/20/1131061520.db2.gz XCLJISGXPUAWDN-GOSISDBHSA-N 1 1 339.435 3.977 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nnc(-c2ccco2)o1)C1CCCC1 ZINC000733613498 1131061922 /nfs/dbraw/zinc/06/19/22/1131061922.db2.gz YVXGNDTZJNPBEW-UHFFFAOYSA-N 1 1 339.395 3.980 20 10 EHCDMO Cc1ncsc1CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000738312908 1131468122 /nfs/dbraw/zinc/46/81/22/1131468122.db2.gz YXOCEVKXAWARKN-UHFFFAOYSA-N 1 1 328.437 3.995 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cc1C ZINC000740856034 1131549423 /nfs/dbraw/zinc/54/94/23/1131549423.db2.gz LVODNHPNGIERLS-DOTOQJQBSA-N 1 1 348.487 3.744 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H](C)C3)cc2F)CC1 ZINC000742369672 1131716210 /nfs/dbraw/zinc/71/62/10/1131716210.db2.gz CRWWISJJBCNWSR-FUHWJXTLSA-N 1 1 333.495 3.636 20 10 EHCDMO COC(=O)[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001172791418 1131846862 /nfs/dbraw/zinc/84/68/62/1131846862.db2.gz KDDRXKNTTPMRNZ-RTBURBONSA-N 1 1 344.499 3.841 20 10 EHCDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2O)CN1C(=O)OC(C)(C)C ZINC001173073989 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20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1)[C@@H](O)CO2 ZINC000768440926 1133139163 /nfs/dbraw/zinc/13/91/63/1133139163.db2.gz HUHGMJDTKWGKMS-WMZOPIPTSA-N 1 1 345.826 3.809 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1CC1CCCCC1)[C@H](O)CO2 ZINC000768443602 1133140092 /nfs/dbraw/zinc/14/00/92/1133140092.db2.gz HKQRYUDVXJZZKN-VQIMIIECSA-N 1 1 331.456 3.753 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c1O ZINC000768532525 1133151375 /nfs/dbraw/zinc/15/13/75/1133151375.db2.gz MPGXMGQCVJLFPP-JTQLQIEISA-N 1 1 340.261 3.926 20 10 EHCDMO COCC[C@H]1CCCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000768539679 1133152915 /nfs/dbraw/zinc/15/29/15/1133152915.db2.gz ASEMCFWOTXJAHF-CYBMUJFWSA-N 1 1 342.277 3.793 20 10 EHCDMO COCC[C@H]1CCCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000768539679 1133152918 /nfs/dbraw/zinc/15/29/18/1133152918.db2.gz ASEMCFWOTXJAHF-CYBMUJFWSA-N 1 1 342.277 3.793 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000768886129 1133196626 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334.822 3.549 20 10 EHCDMO Oc1ccc(Cl)c(F)c1CN[C@H]1COc2cc(F)cc(F)c21 ZINC000790986282 1134488598 /nfs/dbraw/zinc/48/85/98/1134488598.db2.gz MDNOWVSHCZIXPY-NSHDSACASA-N 1 1 329.705 3.686 20 10 EHCDMO Cc1cc(C)cc(-n2ncc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)n2)c1 ZINC000775361689 1134666406 /nfs/dbraw/zinc/66/64/06/1134666406.db2.gz DMIVVRILBSPLPS-QGZVFWFLSA-N 1 1 349.482 3.801 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)c1 ZINC000775373089 1134680800 /nfs/dbraw/zinc/68/08/00/1134680800.db2.gz MIIOTQGWPTXEJD-ZETCQYMHSA-N 1 1 347.283 3.947 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](C)NC(=O)OC(C)(C)C ZINC001190436251 1134699884 /nfs/dbraw/zinc/69/98/84/1134699884.db2.gz CABLPAYXKARARX-INIZCTEOSA-N 1 1 349.519 3.876 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c(C(F)(F)F)c1 ZINC000793075356 1134847206 /nfs/dbraw/zinc/84/72/06/1134847206.db2.gz AXEOIINNYMNPJL-OAHLLOKOSA-N 1 1 330.394 3.507 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775645589 1135389553 /nfs/dbraw/zinc/38/95/53/1135389553.db2.gz BNAOFKHHWPYCEF-SFHVURJKSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)Cc2ccccc21 ZINC000775645589 1135389558 /nfs/dbraw/zinc/38/95/58/1135389558.db2.gz BNAOFKHHWPYCEF-SFHVURJKSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)Cc2ccccc21 ZINC000775645589 1135389561 /nfs/dbraw/zinc/38/95/61/1135389561.db2.gz BNAOFKHHWPYCEF-SFHVURJKSA-N 1 1 335.495 3.558 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCCc3cc(OC)ccc32)c1 ZINC000775651013 1135416360 /nfs/dbraw/zinc/41/63/60/1135416360.db2.gz JNEOILFTRLOOBY-LJQANCHMSA-N 1 1 327.424 3.919 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)cc1 ZINC001195500102 1135434753 /nfs/dbraw/zinc/43/47/53/1135434753.db2.gz ZXZSJSVQVJWSPT-QFBILLFUSA-N 1 1 346.515 3.942 20 10 EHCDMO C[C@@H](C[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 ZINC000775679275 1135503734 /nfs/dbraw/zinc/50/37/34/1135503734.db2.gz UEHUCFJRLQQJPF-IBGZPJMESA-N 1 1 337.511 3.674 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 ZINC000775679275 1135503735 /nfs/dbraw/zinc/50/37/35/1135503735.db2.gz UEHUCFJRLQQJPF-IBGZPJMESA-N 1 1 337.511 3.674 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)c1O ZINC000775735388 1135590155 /nfs/dbraw/zinc/59/01/55/1135590155.db2.gz RFDYGNUIBFCSRG-INIZCTEOSA-N 1 1 334.460 3.532 20 10 EHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ncnn2-c2ccccc2)c1O ZINC000808716844 1135721141 /nfs/dbraw/zinc/72/11/41/1135721141.db2.gz XNKKNQNTAVIRTO-ZDUSSCGKSA-N 1 1 342.830 3.786 20 10 EHCDMO C[N@@H+](Cc1cn[nH]c1)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000809575700 1135853200 /nfs/dbraw/zinc/85/32/00/1135853200.db2.gz BFFBKSSUTKVJAJ-UHFFFAOYSA-N 1 1 332.451 3.604 20 10 EHCDMO CCOc1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CC)CO)c(O)c1 ZINC000809642383 1135864499 /nfs/dbraw/zinc/86/44/99/1135864499.db2.gz FIPQMTSWMWZKBK-SFHVURJKSA-N 1 1 329.440 3.564 20 10 EHCDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC000809697595 1135867624 /nfs/dbraw/zinc/86/76/24/1135867624.db2.gz JSUQHLNUGDXYKA-SQEGATDGSA-N 1 1 326.484 3.532 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H](C)[S@]1=O ZINC000809700461 1135869340 /nfs/dbraw/zinc/86/93/40/1135869340.db2.gz HCSFQEIOTPWYNN-ZCLJVBCSSA-N 1 1 343.492 3.791 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c1O ZINC000809712945 1135876202 /nfs/dbraw/zinc/87/62/02/1135876202.db2.gz XEUFYCJXFKIKIV-UHFFFAOYSA-N 1 1 344.430 3.642 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)no2)cc1 ZINC000809718766 1135878121 /nfs/dbraw/zinc/87/81/21/1135878121.db2.gz OJMFDOLWDSPXLT-GOSISDBHSA-N 1 1 328.460 3.951 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)no2)cc1 ZINC000809718766 1135878125 /nfs/dbraw/zinc/87/81/25/1135878125.db2.gz OJMFDOLWDSPXLT-GOSISDBHSA-N 1 1 328.460 3.951 20 10 EHCDMO CCOc1ccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c(O)c1 ZINC000809738117 1135883271 /nfs/dbraw/zinc/88/32/71/1135883271.db2.gz PSFFDODSOPIYJK-UHFFFAOYSA-N 1 1 327.424 3.909 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c1 ZINC000776013883 1135920306 /nfs/dbraw/zinc/92/03/06/1135920306.db2.gz KECSGAHXLQDKNW-OAQYLSRUSA-N 1 1 339.435 3.812 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1O ZINC000810211079 1135943456 /nfs/dbraw/zinc/94/34/56/1135943456.db2.gz LNUYZAFSEBHCPJ-SWLSCSKDSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211079 1135943457 /nfs/dbraw/zinc/94/34/57/1135943457.db2.gz LNUYZAFSEBHCPJ-SWLSCSKDSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211079 1135943460 /nfs/dbraw/zinc/94/34/60/1135943460.db2.gz LNUYZAFSEBHCPJ-SWLSCSKDSA-N 1 1 330.394 3.794 20 10 EHCDMO CCOc1ccc(O)c(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000811508448 1136101751 /nfs/dbraw/zinc/10/17/51/1136101751.db2.gz QNAYZULBFLZCRF-GOSISDBHSA-N 1 1 338.451 3.776 20 10 EHCDMO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1CCOC(C)(C)C1 ZINC000811511480 1136102199 /nfs/dbraw/zinc/10/21/99/1136102199.db2.gz JSTWWLDBDDGHEG-CQSZACIVSA-N 1 1 327.852 3.834 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c1 ZINC000811511569 1136103305 /nfs/dbraw/zinc/10/33/05/1136103305.db2.gz NNEPXHOVDJOHKG-SNVBAGLBSA-N 1 1 334.204 3.940 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1 ZINC000811511569 1136103306 /nfs/dbraw/zinc/10/33/06/1136103306.db2.gz NNEPXHOVDJOHKG-SNVBAGLBSA-N 1 1 334.204 3.940 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)c1 ZINC000811780740 1136135127 /nfs/dbraw/zinc/13/51/27/1136135127.db2.gz WLRVBYALYHPSLE-FUHWJXTLSA-N 1 1 333.472 3.785 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)c1 ZINC000811780736 1136135139 /nfs/dbraw/zinc/13/51/39/1136135139.db2.gz WLRVBYALYHPSLE-AEFFLSMTSA-N 1 1 333.472 3.785 20 10 EHCDMO COC[C@@H](C)Oc1ccc(CNc2ccc3c(c2)[nH+]cn3C)cc1 ZINC000850217874 1136222882 /nfs/dbraw/zinc/22/28/82/1136222882.db2.gz PQJBEQAPJFADHG-CQSZACIVSA-N 1 1 325.412 3.599 20 10 EHCDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2ccc(N(C)C)cc2)C1 ZINC000812840371 1136257605 /nfs/dbraw/zinc/25/76/05/1136257605.db2.gz BGQGFZDOAKRBFD-DBOLQNLKSA-N 1 1 330.516 3.904 20 10 EHCDMO COC[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C1CCOCC1 ZINC000850492411 1136271233 /nfs/dbraw/zinc/27/12/33/1136271233.db2.gz BETIMSULYVODSH-MEBBXXQBSA-N 1 1 348.270 3.791 20 10 EHCDMO C[C@@H]([NH2+]CCO[C@@H]1CC1(F)F)c1cc(Cl)c(Cl)cc1O ZINC000850521163 1136276682 /nfs/dbraw/zinc/27/66/82/1136276682.db2.gz OJSNRSICMNVIPC-JMCQJSRRSA-N 1 1 326.170 3.774 20 10 EHCDMO CCc1ccc([C@@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000111235236 1136524373 /nfs/dbraw/zinc/52/43/73/1136524373.db2.gz HRNDOUQSYQVTNV-CVEARBPZSA-N 1 1 340.467 3.652 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1N(C)C ZINC000815012400 1136537387 /nfs/dbraw/zinc/53/73/87/1136537387.db2.gz CYUCNVYRUAMKFW-QGZVFWFLSA-N 1 1 349.482 3.835 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)c(OC)c1 ZINC000815013115 1136537395 /nfs/dbraw/zinc/53/73/95/1136537395.db2.gz QVMHNFUCMHKFMS-UHFFFAOYSA-N 1 1 328.456 3.710 20 10 EHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@@H]1COc2ccccc2O1 ZINC000816482092 1136722955 /nfs/dbraw/zinc/72/29/55/1136722955.db2.gz UHFURDQTNVCENH-QGZVFWFLSA-N 1 1 335.403 3.817 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)cc1OC ZINC000816481933 1136723825 /nfs/dbraw/zinc/72/38/25/1136723825.db2.gz OABPSGJCDHMTIO-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc1OC ZINC000816481933 1136723826 /nfs/dbraw/zinc/72/38/26/1136723826.db2.gz OABPSGJCDHMTIO-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000816549742 1136732910 /nfs/dbraw/zinc/73/29/10/1136732910.db2.gz XLMMPYNZGBTADV-MRVPVSSYSA-N 1 1 335.766 3.617 20 10 EHCDMO COc1ccc(O[C@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816554798 1136736209 /nfs/dbraw/zinc/73/62/09/1136736209.db2.gz JGQIYAWFLFJXKM-LLVKDONJSA-N 1 1 339.794 3.750 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000816571141 1136738777 /nfs/dbraw/zinc/73/87/77/1136738777.db2.gz SXYJAQBSZDTGCO-GOSISDBHSA-N 1 1 333.790 3.816 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000816571141 1136738780 /nfs/dbraw/zinc/73/87/80/1136738780.db2.gz SXYJAQBSZDTGCO-GOSISDBHSA-N 1 1 333.790 3.816 20 10 EHCDMO C[N@@H+]1CCC[C@]2(CC[NH+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643259 1136743860 /nfs/dbraw/zinc/74/38/60/1136743860.db2.gz ZJVQPIVQTYWILA-INIZCTEOSA-N 1 1 329.271 3.617 20 10 EHCDMO C[N@H+]1CCC[C@]2(CC[NH+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643259 1136743863 /nfs/dbraw/zinc/74/38/63/1136743863.db2.gz ZJVQPIVQTYWILA-INIZCTEOSA-N 1 1 329.271 3.617 20 10 EHCDMO C[NH+]1CCC[C@]2(CC[N@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643259 1136743864 /nfs/dbraw/zinc/74/38/64/1136743864.db2.gz ZJVQPIVQTYWILA-INIZCTEOSA-N 1 1 329.271 3.617 20 10 EHCDMO C[NH+]1CCC[C@]2(CC[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643259 1136743868 /nfs/dbraw/zinc/74/38/68/1136743868.db2.gz ZJVQPIVQTYWILA-INIZCTEOSA-N 1 1 329.271 3.617 20 10 EHCDMO COc1cc(Cl)cc(C[NH2+]Cc2c(F)cc(F)cc2F)c1O ZINC000816650743 1136744959 /nfs/dbraw/zinc/74/49/59/1136744959.db2.gz AEVIQUMRXSCDKA-UHFFFAOYSA-N 1 1 331.721 3.761 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000816656086 1136745530 /nfs/dbraw/zinc/74/55/30/1136745530.db2.gz DVIQTQNMUWKGDU-INIZCTEOSA-N 1 1 325.811 3.576 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000816656086 1136745533 /nfs/dbraw/zinc/74/55/33/1136745533.db2.gz DVIQTQNMUWKGDU-INIZCTEOSA-N 1 1 325.811 3.576 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCSc3ccccc32)cc1 ZINC000817938665 1136847599 /nfs/dbraw/zinc/84/75/99/1136847599.db2.gz PBLXSQLSYKMEIY-ROUUACIJSA-N 1 1 327.497 3.579 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000817938995 1136848710 /nfs/dbraw/zinc/84/87/10/1136848710.db2.gz XFNHMXJURIIHCN-SUMWQHHRSA-N 1 1 349.425 3.705 20 10 EHCDMO CCN(C)c1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817942281 1136849343 /nfs/dbraw/zinc/84/93/43/1136849343.db2.gz NPJXQQZFTKFAJF-KKSFZXQISA-N 1 1 340.515 3.559 20 10 EHCDMO CCC([NH3+])(CC)CN[C@H](C)c1cc(Br)cc(C)c1O ZINC000817960857 1136852028 /nfs/dbraw/zinc/85/20/28/1136852028.db2.gz RTYNGCSIGOXIJN-LLVKDONJSA-N 1 1 329.282 3.631 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1[O-] ZINC000817976559 1136854556 /nfs/dbraw/zinc/85/45/56/1136854556.db2.gz NLTHIVNZVGRFKU-HIFRSBDPSA-N 1 1 328.378 3.594 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817987764 1136855440 /nfs/dbraw/zinc/85/54/40/1136855440.db2.gz WTCSEUWAUPKMLY-GMZLATJGSA-N 1 1 342.405 3.840 20 10 EHCDMO CCn1nc(C)c(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)n1 ZINC000818344120 1136873004 /nfs/dbraw/zinc/87/30/04/1136873004.db2.gz JIRBXPFQCIXLIK-MRXNPFEDSA-N 1 1 341.503 3.838 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C(=O)OC)s2)cc1 ZINC000818357697 1136875669 /nfs/dbraw/zinc/87/56/69/1136875669.db2.gz HWIRLOSUYVELHZ-STQMWFEESA-N 1 1 347.484 3.798 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2cccc(C(F)(F)F)n2)cc1F ZINC000858171295 1136946262 /nfs/dbraw/zinc/94/62/62/1136946262.db2.gz OSMWUAQBJUDMJF-UHFFFAOYSA-N 1 1 345.315 3.734 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000858484725 1136972076 /nfs/dbraw/zinc/97/20/76/1136972076.db2.gz ZMYMNDNRVUOSBK-YJYMSZOUSA-N 1 1 340.423 3.766 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc4cc[nH]c4c3)CC2)cc1 ZINC000862230961 1137133688 /nfs/dbraw/zinc/13/36/88/1137133688.db2.gz BDBOJCOFXJKZDM-UHFFFAOYSA-N 1 1 335.451 3.889 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)cc1F ZINC000862327622 1137138309 /nfs/dbraw/zinc/13/83/09/1137138309.db2.gz FIDYTUMTBHKGCV-HXUWFJFHSA-N 1 1 344.405 3.662 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1F ZINC000862327622 1137138311 /nfs/dbraw/zinc/13/83/11/1137138311.db2.gz FIDYTUMTBHKGCV-HXUWFJFHSA-N 1 1 344.405 3.662 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1Cl ZINC000824949673 1137159032 /nfs/dbraw/zinc/15/90/32/1137159032.db2.gz NWBJYIXRVSDGKQ-ZDUSSCGKSA-N 1 1 346.862 3.729 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]2CC3(CC[C@@H]21)OCCO3 ZINC000825030541 1137162578 /nfs/dbraw/zinc/16/25/78/1137162578.db2.gz NLFJITQNULYOJW-CJNGLKHVSA-N 1 1 337.847 3.553 20 10 EHCDMO CC(C)[N@@H+]1CC[C@@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000794698626 1137235566 /nfs/dbraw/zinc/23/55/66/1137235566.db2.gz ICXQURAQWWEZSQ-AWEZNQCLSA-N 1 1 343.437 3.591 20 10 EHCDMO CC(C)[N@H+]1CC[C@@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000794698626 1137235568 /nfs/dbraw/zinc/23/55/68/1137235568.db2.gz ICXQURAQWWEZSQ-AWEZNQCLSA-N 1 1 343.437 3.591 20 10 EHCDMO CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000844924564 1137263243 /nfs/dbraw/zinc/26/32/43/1137263243.db2.gz LXSQHBSZXZWLDF-OAHLLOKOSA-N 1 1 330.394 3.841 20 10 EHCDMO COc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1O ZINC000846139369 1137338408 /nfs/dbraw/zinc/33/84/08/1137338408.db2.gz SICJOQSISRLYIP-KBXCAEBGSA-N 1 1 337.423 3.575 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]CC[C@H](C)N(C)Cc2ccccc2)c1O ZINC000846144584 1137338900 /nfs/dbraw/zinc/33/89/00/1137338900.db2.gz IAXZTHGPZILSFL-DLBZAZTESA-N 1 1 342.483 3.962 20 10 EHCDMO C[C@H]([NH2+][C@@H](Cc1ccccc1)c1nccn1C)c1ccc(F)cc1O ZINC000846207397 1137339295 /nfs/dbraw/zinc/33/92/95/1137339295.db2.gz NVDPXKJOOHANDC-KSSFIOAISA-N 1 1 339.414 3.899 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1ccc(F)cc1O ZINC000846201934 1137341692 /nfs/dbraw/zinc/34/16/92/1137341692.db2.gz BCGJVGYMAISWSC-SUMDDJOVSA-N 1 1 330.403 3.887 20 10 EHCDMO C[C@H]([NH2+]CCc1cn(C)c2ncccc12)c1ccc(Cl)cc1O ZINC000866573143 1137366081 /nfs/dbraw/zinc/36/60/81/1137366081.db2.gz IFVTWYUBGZFGHJ-LBPRGKRZSA-N 1 1 329.831 3.826 20 10 EHCDMO CC1(C)c2ccccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001171417033 1137476675 /nfs/dbraw/zinc/47/66/75/1137476675.db2.gz LOQPILOFKKKIOQ-UHFFFAOYSA-N 1 1 336.479 3.817 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872280055 1137577535 /nfs/dbraw/zinc/57/75/35/1137577535.db2.gz IUUMIAPRSSDTDD-QGZVFWFLSA-N 1 1 335.419 3.658 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H]4CSC[C@@H]4C3)c2c1 ZINC000872721606 1137583205 /nfs/dbraw/zinc/58/32/05/1137583205.db2.gz ICHNTYVGHYBICH-GJZGRUSLSA-N 1 1 329.465 3.739 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCc2ccccc21 ZINC000876561643 1137655538 /nfs/dbraw/zinc/65/55/38/1137655538.db2.gz QFRLHWLPSSWNDK-JOCHJYFZSA-N 1 1 336.479 3.767 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(C(F)F)nc3)CC2)cc1 ZINC000876631488 1137657739 /nfs/dbraw/zinc/65/77/39/1137657739.db2.gz SDTXVYZPIVPLIP-UHFFFAOYSA-N 1 1 347.409 3.740 20 10 EHCDMO Cc1ccc(NCc2ccc(F)c(F)c2O)c(OCC[NH+](C)C)c1 ZINC000876862627 1137664063 /nfs/dbraw/zinc/66/40/63/1137664063.db2.gz RXENAAXUWNJUMB-UHFFFAOYSA-N 1 1 336.382 3.531 20 10 EHCDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC000877192041 1137672597 /nfs/dbraw/zinc/67/25/97/1137672597.db2.gz IURDAOBRMVSAQO-LAUBAEHRSA-N 1 1 328.500 3.660 20 10 EHCDMO C[C@@H]1C[C@@H](C[N@H+]2Cc3cccc(O)c3C2)CCN1C(=O)OC(C)(C)C ZINC000877703147 1137686465 /nfs/dbraw/zinc/68/64/65/1137686465.db2.gz TWSOZQUYTYGKMX-CABCVRRESA-N 1 1 346.471 3.743 20 10 EHCDMO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000877822048 1137691609 /nfs/dbraw/zinc/69/16/09/1137691609.db2.gz PVXAYJASKPHEOT-KRWDZBQOSA-N 1 1 342.405 3.830 20 10 EHCDMO C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cc(F)cc(F)c2[O-])CC1 ZINC000883004913 1137841409 /nfs/dbraw/zinc/84/14/09/1137841409.db2.gz YZJUAWFGDFNECR-CQSZACIVSA-N 1 1 346.421 3.986 20 10 EHCDMO Cn1c2ccccc2nc1C(C)(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883089528 1137844224 /nfs/dbraw/zinc/84/42/24/1137844224.db2.gz MIFSRAXLZKXWRT-UHFFFAOYSA-N 1 1 331.366 3.582 20 10 EHCDMO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109769905 1137897287 /nfs/dbraw/zinc/89/72/87/1137897287.db2.gz YGLMOJAFVKFCED-ZDUSSCGKSA-N 1 1 332.831 3.813 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000134055420 1137936430 /nfs/dbraw/zinc/93/64/30/1137936430.db2.gz YQJGAYFIESQWHZ-UHFFFAOYSA-N 1 1 334.485 3.916 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000884483256 1137960913 /nfs/dbraw/zinc/96/09/13/1137960913.db2.gz QLQHNYHTVPBXHW-KBXCAEBGSA-N 1 1 333.472 3.699 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000884483258 1137960916 /nfs/dbraw/zinc/96/09/16/1137960916.db2.gz QLQHNYHTVPBXHW-KSSFIOAISA-N 1 1 333.472 3.699 20 10 EHCDMO CC(C)C(=O)Nc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886494945 1138083421 /nfs/dbraw/zinc/08/34/21/1138083421.db2.gz ALQXAYWTDDAOFL-CYBMUJFWSA-N 1 1 330.403 3.977 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1c(O)cccc1F ZINC000886539440 1138093020 /nfs/dbraw/zinc/09/30/20/1138093020.db2.gz ZLSNGGDEGPJRMG-VXGBXAGGSA-N 1 1 335.810 3.509 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnc(Cl)s1)C[C@H]1CCCO1 ZINC000079321395 1138155083 /nfs/dbraw/zinc/15/50/83/1138155083.db2.gz ARGDAOPPAKOJLV-CYBMUJFWSA-N 1 1 338.860 3.683 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnc(Cl)s1)C[C@H]1CCCO1 ZINC000079321395 1138155085 /nfs/dbraw/zinc/15/50/85/1138155085.db2.gz ARGDAOPPAKOJLV-CYBMUJFWSA-N 1 1 338.860 3.683 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2CC(=O)c2ccccc2)c1O ZINC000093667980 1138239881 /nfs/dbraw/zinc/23/98/81/1138239881.db2.gz UQZFEZXDMJDMJY-QGZVFWFLSA-N 1 1 325.408 3.638 20 10 EHCDMO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)NC(=O)OC(C)(C)C ZINC000301809248 1138650917 /nfs/dbraw/zinc/65/09/17/1138650917.db2.gz FSTQPOCPEINSMU-WFASDCNBSA-N 1 1 340.439 3.731 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(COC)o2)c1O ZINC000137074410 1138831417 /nfs/dbraw/zinc/83/14/17/1138831417.db2.gz OCVNPCOSNMGAIW-MRXNPFEDSA-N 1 1 331.412 3.867 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc(F)cc1O ZINC000185151238 1140137417 /nfs/dbraw/zinc/13/74/17/1140137417.db2.gz RXKYGPVQMDPEJC-JTQLQIEISA-N 1 1 337.778 3.807 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(O[C@@H]2CCOC2)c1 ZINC000185725579 1140166640 /nfs/dbraw/zinc/16/66/40/1140166640.db2.gz OYTKGGVBWLBXOE-WMLDXEAASA-N 1 1 345.414 3.858 20 10 EHCDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccccc2O)cc1Cl ZINC000268876480 1141015106 /nfs/dbraw/zinc/01/51/06/1141015106.db2.gz BMFOMRCVDNQKDM-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3ccccc3F)C2)cc1OC ZINC000271055391 1141301444 /nfs/dbraw/zinc/30/14/44/1141301444.db2.gz ADLQXNRCHUGJDW-ZDUSSCGKSA-N 1 1 331.387 3.538 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cn2ccnc2C(C)C)c1 ZINC000359878279 201114988 /nfs/dbraw/zinc/11/49/88/201114988.db2.gz QNUGVZBBIZUZDB-QGZVFWFLSA-N 1 1 343.471 3.775 20 10 EHCDMO COc1cc(O)c(C[N@H+](C)Cc2ccc(F)cc2Cl)cc1OC ZINC000160161920 1014175543 /nfs/dbraw/zinc/17/55/43/1014175543.db2.gz VERKKRRIOBJKCZ-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(F)cc2Cl)cc1OC ZINC000160161920 1014175546 /nfs/dbraw/zinc/17/55/46/1014175546.db2.gz VERKKRRIOBJKCZ-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1ccc(C[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cc1C ZINC000274769818 1015054035 /nfs/dbraw/zinc/05/40/35/1015054035.db2.gz IHRZONPQHHLPJL-FQEVSTJZSA-N 1 1 339.414 3.755 20 10 EHCDMO Cn1c(C[N@@H+](Cc2ccccc2O)C2CCCC2)nnc1C1CCC1 ZINC000782930479 1016746351 /nfs/dbraw/zinc/74/63/51/1016746351.db2.gz VYXOXMGJROHLEC-UHFFFAOYSA-N 1 1 340.471 3.733 20 10 EHCDMO CC[C@@H](c1ccncc1)[N@@H+](CC)Cc1cc(OC)c(OC)cc1O ZINC000160281837 1016876431 /nfs/dbraw/zinc/87/64/31/1016876431.db2.gz LNZZZMCRYCPNFY-INIZCTEOSA-N 1 1 330.428 3.778 20 10 EHCDMO COc1ccc(C[N@H+]2CCc3cccc(O)c3C2)c(C(F)(F)F)c1 ZINC001143482961 1017027654 /nfs/dbraw/zinc/02/76/54/1017027654.db2.gz BYEQHLMQRZCRCZ-UHFFFAOYSA-N 1 1 337.341 3.978 20 10 EHCDMO COc1cccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278755248 1032387828 /nfs/dbraw/zinc/38/78/28/1032387828.db2.gz NMRZGSGPXUTXMC-QMMMGPOBSA-N 1 1 332.347 3.727 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](COC)c2ccc(C)o2)ccc1OC ZINC000080237583 1021781959 /nfs/dbraw/zinc/78/19/59/1021781959.db2.gz ABQZHSQOIFIXFF-KRWDZBQOSA-N 1 1 333.428 3.610 20 10 EHCDMO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc(C)cc(OC)c1O ZINC000894643953 1022658523 /nfs/dbraw/zinc/65/85/23/1022658523.db2.gz JAFRYQYMLBQVHE-INIZCTEOSA-N 1 1 329.444 3.653 20 10 EHCDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC000894643953 1022658533 /nfs/dbraw/zinc/65/85/33/1022658533.db2.gz JAFRYQYMLBQVHE-INIZCTEOSA-N 1 1 329.444 3.653 20 10 EHCDMO c1nc2c([nH]1)C1(CCC1)[N@@H+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC000895068243 1023135324 /nfs/dbraw/zinc/13/53/24/1023135324.db2.gz PCMKLDUHUDXUPM-UHFFFAOYSA-N 1 1 336.483 3.838 20 10 EHCDMO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc(OC)c2O)[nH]1 ZINC000277069142 1023735456 /nfs/dbraw/zinc/73/54/56/1023735456.db2.gz DUUAJJYNPQVQJA-ZJUUUORDSA-N 1 1 338.839 3.537 20 10 EHCDMO CCC[N@@H+](CCC(=O)Nc1cccc(OC)c1)Cc1ccccc1O ZINC000173282880 1033209372 /nfs/dbraw/zinc/20/93/72/1033209372.db2.gz APKHNYJNMREQSG-UHFFFAOYSA-N 1 1 342.439 3.642 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3ccc(N(C)C)cc3C)[C@@H]2C(C)C)C1 ZINC000895989257 1025047779 /nfs/dbraw/zinc/04/77/79/1025047779.db2.gz QJNUVRBEWBJZGS-LJQANCHMSA-N 1 1 346.515 3.671 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c(O)c1 ZINC000896228540 1025261867 /nfs/dbraw/zinc/26/18/67/1025261867.db2.gz SRABZXZSKFRJAA-AWEZNQCLSA-N 1 1 333.325 3.657 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)c1O ZINC000896532092 1025546720 /nfs/dbraw/zinc/54/67/20/1025546720.db2.gz SSYOWQMYKVMBRN-CQSZACIVSA-N 1 1 332.469 3.702 20 10 EHCDMO Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2c(O)cccc2F)c(C)c1 ZINC000896636750 1025790318 /nfs/dbraw/zinc/79/03/18/1025790318.db2.gz GTMUPFJCTFOZDT-CQSZACIVSA-N 1 1 330.403 3.655 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2OC)c1 ZINC000273417909 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CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)cc1 ZINC001183653017 1133836760 /nfs/dbraw/zinc/83/67/60/1133836760.db2.gz XRMUACQTSMWRHC-QGZVFWFLSA-N 1 1 344.524 3.977 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCS[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001183831398 1133862667 /nfs/dbraw/zinc/86/26/67/1133862667.db2.gz BLSJXWNHFITJQC-GFCCVEGCSA-N 1 1 325.783 3.834 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCS[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001183831398 1133862675 /nfs/dbraw/zinc/86/26/75/1133862675.db2.gz BLSJXWNHFITJQC-GFCCVEGCSA-N 1 1 325.783 3.834 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3scnc3C3CC3)CC2)cc1 ZINC000787129087 1133962426 /nfs/dbraw/zinc/96/24/26/1133962426.db2.gz PGQODAYDBIXIRV-UHFFFAOYSA-N 1 1 343.496 3.741 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774831944 1134039013 /nfs/dbraw/zinc/03/90/13/1134039013.db2.gz GALWTWCJPWDOGM-OAHLLOKOSA-N 1 1 334.416 3.854 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774831944 1134039020 /nfs/dbraw/zinc/03/90/20/1134039020.db2.gz GALWTWCJPWDOGM-OAHLLOKOSA-N 1 1 334.416 3.854 20 10 EHCDMO COc1c(O)c(C[NH2+]CCCc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000774958594 1134152784 /nfs/dbraw/zinc/15/27/84/1134152784.db2.gz ZDWDPPRAJBCORP-UHFFFAOYSA-N 1 1 344.411 3.648 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000775061094 1134274609 /nfs/dbraw/zinc/27/46/09/1134274609.db2.gz RUCWWWGGUVAFAQ-HNNXBMFYSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000775061094 1134274613 /nfs/dbraw/zinc/27/46/13/1134274613.db2.gz RUCWWWGGUVAFAQ-HNNXBMFYSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)Cc2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000775117194 1134332424 /nfs/dbraw/zinc/33/24/24/1134332424.db2.gz AKKUZDBZAGAAOV-UHFFFAOYSA-N 1 1 330.384 3.558 20 10 EHCDMO COc1c([O-])c(C[N@@H+](C)C/C(C)=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000775118881 1134333416 /nfs/dbraw/zinc/33/34/16/1134333416.db2.gz QOIFDNKWNMBLQX-SDNWHVSQSA-N 1 1 342.395 3.844 20 10 EHCDMO COc1c(O)c(C[N@H+](C)C/C(C)=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000775118881 1134333424 /nfs/dbraw/zinc/33/34/24/1134333424.db2.gz QOIFDNKWNMBLQX-SDNWHVSQSA-N 1 1 342.395 3.844 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)C/C(C)=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000775118881 1134333430 /nfs/dbraw/zinc/33/34/30/1134333430.db2.gz QOIFDNKWNMBLQX-SDNWHVSQSA-N 1 1 342.395 3.844 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@@H]1COc2ccccc2O1 ZINC000790977742 1134494761 /nfs/dbraw/zinc/49/47/61/1134494761.db2.gz RVIPFRMQPYOUGQ-LLVKDONJSA-N 1 1 337.778 3.504 20 10 EHCDMO COC(=O)[C@@H](C)[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C1CCC1 ZINC000792184551 1134665632 /nfs/dbraw/zinc/66/56/32/1134665632.db2.gz HCQFGHKORAACQG-OAHLLOKOSA-N 1 1 339.435 3.975 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCSCC[C@H]2C)c1O ZINC000792194987 1134667397 /nfs/dbraw/zinc/66/73/97/1134667397.db2.gz BAPLIPGWCAPPBF-LLVKDONJSA-N 1 1 330.291 3.791 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2C[C@@H](C)O[C@]3(CCOC3)C2)cc1 ZINC000793363399 1134910605 /nfs/dbraw/zinc/91/06/05/1134910605.db2.gz UDECBDHATUBOMM-WIYYLYMNSA-N 1 1 346.515 3.693 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000793536165 1134950849 /nfs/dbraw/zinc/95/08/49/1134950849.db2.gz XOAXDKPZEUJBJL-WMLDXEAASA-N 1 1 325.399 3.872 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)[C@H]3CCc4ccccc43)cc2)CC1 ZINC000775648247 1135396953 /nfs/dbraw/zinc/39/69/53/1135396953.db2.gz RILSBCIVJAGOEE-QFIPXVFZSA-N 1 1 335.495 3.558 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)[C@H]3CCc4ccccc43)cc2)CC1 ZINC000775648247 1135396958 /nfs/dbraw/zinc/39/69/58/1135396958.db2.gz RILSBCIVJAGOEE-QFIPXVFZSA-N 1 1 335.495 3.558 20 10 EHCDMO COCc1cnc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000775651961 1135423047 /nfs/dbraw/zinc/42/30/47/1135423047.db2.gz UEEMUDJCVSPJEV-UHFFFAOYSA-N 1 1 333.501 3.766 20 10 EHCDMO COCc1cnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000775651961 1135423050 /nfs/dbraw/zinc/42/30/50/1135423050.db2.gz UEEMUDJCVSPJEV-UHFFFAOYSA-N 1 1 333.501 3.766 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)CCSc2ccccc2)cc1 ZINC001195791173 1135470777 /nfs/dbraw/zinc/47/07/77/1135470777.db2.gz YCJCRQXBXLAITM-UHFFFAOYSA-N 1 1 330.497 3.856 20 10 EHCDMO Cc1cccc(C[N@@H+](C2CC2)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1O ZINC000775728129 1135585836 /nfs/dbraw/zinc/58/58/36/1135585836.db2.gz OHVPMDVHKPXPLI-KRWDZBQOSA-N 1 1 346.471 3.674 20 10 EHCDMO CC(=O)NCC[C@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000808216533 1135630684 /nfs/dbraw/zinc/63/06/84/1135630684.db2.gz JHRWPLBJPBSCRP-QGZVFWFLSA-N 1 1 332.488 3.562 20 10 EHCDMO CC(=O)NCC[C@@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000808216530 1135631178 /nfs/dbraw/zinc/63/11/78/1135631178.db2.gz JHRWPLBJPBSCRP-KRWDZBQOSA-N 1 1 332.488 3.562 20 10 EHCDMO C[NH+](C)C[C@@H]1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC000809576510 1135852740 /nfs/dbraw/zinc/85/27/40/1135852740.db2.gz BPBFYSJLDRWDGS-NRFANRHFSA-N 1 1 349.522 3.633 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CCOc3cc(O)ccc3C2)cc1 ZINC000809704541 1135875153 /nfs/dbraw/zinc/87/51/53/1135875153.db2.gz BUERGCBPYLCSRK-UHFFFAOYSA-N 1 1 326.440 3.633 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCOc3cc(O)ccc3C2)cc1 ZINC000809704541 1135875155 /nfs/dbraw/zinc/87/51/55/1135875155.db2.gz BUERGCBPYLCSRK-UHFFFAOYSA-N 1 1 326.440 3.633 20 10 EHCDMO Oc1ccc2c(c1)OCC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000809704822 1135875218 /nfs/dbraw/zinc/87/52/18/1135875218.db2.gz HYXGAOLZGHGLCE-UHFFFAOYSA-N 1 1 338.451 3.777 20 10 EHCDMO Oc1ccc2c(c1)OCC[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000809704822 1135875220 /nfs/dbraw/zinc/87/52/20/1135875220.db2.gz HYXGAOLZGHGLCE-UHFFFAOYSA-N 1 1 338.451 3.777 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2COC(=O)NC2CCCCC2)c1O ZINC000809719020 1135877603 /nfs/dbraw/zinc/87/76/03/1135877603.db2.gz UTOGVWGUHYRELQ-SFHVURJKSA-N 1 1 346.471 3.724 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)cc1C ZINC000809774267 1135881258 /nfs/dbraw/zinc/88/12/58/1135881258.db2.gz RBUHBAXHCNGTHU-ROUUACIJSA-N 1 1 327.468 3.996 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000775930190 1135881328 /nfs/dbraw/zinc/88/13/28/1135881328.db2.gz PLWMBYFUXIKYAX-UHFFFAOYSA-N 1 1 325.456 3.713 20 10 EHCDMO Cc1cccc(C[N@@H+](CCc2ccccn2)Cc2ccncc2)c1O ZINC000809762763 1135888441 /nfs/dbraw/zinc/88/84/41/1135888441.db2.gz ZMXFLZWBGOSXPF-UHFFFAOYSA-N 1 1 333.435 3.736 20 10 EHCDMO Cc1cc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)cc(N2CCCC2)n1 ZINC000810249986 1135947638 /nfs/dbraw/zinc/94/76/38/1135947638.db2.gz CLARGBLKUZTYNH-CYBMUJFWSA-N 1 1 347.409 3.825 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000811513457 1136103297 /nfs/dbraw/zinc/10/32/97/1136103297.db2.gz VXYISEVLJHBWTQ-AWEZNQCLSA-N 1 1 346.833 3.822 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000811513457 1136103299 /nfs/dbraw/zinc/10/32/99/1136103299.db2.gz VXYISEVLJHBWTQ-AWEZNQCLSA-N 1 1 346.833 3.822 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000811782322 1136135029 /nfs/dbraw/zinc/13/50/29/1136135029.db2.gz DCOSQTFWPFOFCK-JOCHJYFZSA-N 1 1 346.430 3.910 20 10 EHCDMO COc1cc(C[NH2+]Cc2noc3c2CCCC3)c(O)c(C(C)(C)C)c1 ZINC000850300376 1136233201 /nfs/dbraw/zinc/23/32/01/1136233201.db2.gz BBVKYPNWNUVXLL-UHFFFAOYSA-N 1 1 344.455 3.855 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H](n3cccn3)C2)cc1 ZINC000812780749 1136246703 /nfs/dbraw/zinc/24/67/03/1136246703.db2.gz QTXIMLBWROMEPR-FQEVSTJZSA-N 1 1 326.488 3.957 20 10 EHCDMO C[C@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Br)c(F)cc1O ZINC000850482930 1136267595 /nfs/dbraw/zinc/26/75/95/1136267595.db2.gz SLFKGTGFHFVIKB-DTWKUNHWSA-N 1 1 332.213 3.512 20 10 EHCDMO CC[C@H]([NH2+][C@H](COC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000850513782 1136274624 /nfs/dbraw/zinc/27/46/24/1136274624.db2.gz JJEJVCYSFIGDET-ZWKOTPCHSA-N 1 1 333.403 3.968 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(OC)ccc1OC ZINC000216721374 1136378293 /nfs/dbraw/zinc/37/82/93/1136378293.db2.gz BAHJIFBYERXSCA-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000851793072 1136407561 /nfs/dbraw/zinc/40/75/61/1136407561.db2.gz WCBNENKCEATWTB-QGZVFWFLSA-N 1 1 346.515 3.889 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)Cc2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000814170092 1136414832 /nfs/dbraw/zinc/41/48/32/1136414832.db2.gz RNBIAJBIGMSNPD-UHFFFAOYSA-N 1 1 330.384 3.558 20 10 EHCDMO Cc1cc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c(C)n1-c1ccccc1C ZINC000110694249 1136467778 /nfs/dbraw/zinc/46/77/78/1136467778.db2.gz VCOMOLFKIPDPTC-INIZCTEOSA-N 1 1 339.483 3.615 20 10 EHCDMO CC(C)[C@@H]1CCN(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000853488797 1136537242 /nfs/dbraw/zinc/53/72/42/1136537242.db2.gz SUQWEOZCQCZDMT-FQEVSTJZSA-N 1 1 343.515 3.571 20 10 EHCDMO CC(C)[C@@H]1CCN(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000853488797 1136537244 /nfs/dbraw/zinc/53/72/44/1136537244.db2.gz SUQWEOZCQCZDMT-FQEVSTJZSA-N 1 1 343.515 3.571 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c1O ZINC000853552219 1136543889 /nfs/dbraw/zinc/54/38/89/1136543889.db2.gz YZDAYPLBBJXGQC-LJQANCHMSA-N 1 1 343.423 3.656 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccccc2)[C@@H](C)CCO)ccc1N(C)C ZINC000815078490 1136548502 /nfs/dbraw/zinc/54/85/02/1136548502.db2.gz ACDRCPRJMWNMDB-SFHVURJKSA-N 1 1 326.484 3.834 20 10 EHCDMO COc1ccc(N2CC[C@@H](CNc3[nH+]ccc4c(N)cccc43)C2)cc1 ZINC000853700018 1136556337 /nfs/dbraw/zinc/55/63/37/1136556337.db2.gz VIIJSSHENPGTCT-HNNXBMFYSA-N 1 1 348.450 3.764 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815554394 1136609783 /nfs/dbraw/zinc/60/97/83/1136609783.db2.gz YQDVMLZPIKLGCE-XHDPSFHLSA-N 1 1 325.330 3.795 20 10 EHCDMO C[C@H]([NH2+]CCN1CCC(C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815559286 1136610706 /nfs/dbraw/zinc/61/07/06/1136610706.db2.gz CMVYOCQVOJEVNV-ZDUSSCGKSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@H](CN1CCCCC1)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815559138 1136610752 /nfs/dbraw/zinc/61/07/52/1136610752.db2.gz YTXMTHYLKSROSD-CHWSQXEVSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815581238 1136614037 /nfs/dbraw/zinc/61/40/37/1136614037.db2.gz ZMVALAKJKVCSGB-YVEFUNNKSA-N 1 1 339.357 3.969 20 10 EHCDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)c(O)c1 ZINC000815634299 1136621924 /nfs/dbraw/zinc/62/19/24/1136621924.db2.gz ICEWLFZKUNBOQC-QWRGUYRKSA-N 1 1 336.233 3.665 20 10 EHCDMO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1O ZINC000815637256 1136624286 /nfs/dbraw/zinc/62/42/86/1136624286.db2.gz RAZCFXLCAOBSPG-JTQLQIEISA-N 1 1 328.309 3.838 20 10 EHCDMO COc1ccc(F)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000816481367 1136722649 /nfs/dbraw/zinc/72/26/49/1136722649.db2.gz SEBZOHVRPJHIEJ-SFHVURJKSA-N 1 1 345.414 3.721 20 10 EHCDMO Oc1c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521254 1136727097 /nfs/dbraw/zinc/72/70/97/1136727097.db2.gz KRMPHLQOUIKEAU-LAUBAEHRSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521254 1136727098 /nfs/dbraw/zinc/72/70/98/1136727098.db2.gz KRMPHLQOUIKEAU-LAUBAEHRSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCCSc1nccs1 ZINC000816553140 1136736356 /nfs/dbraw/zinc/73/63/56/1136736356.db2.gz KAXUYEYIVXTJKA-UHFFFAOYSA-N 1 1 332.853 3.913 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000816557716 1136736660 /nfs/dbraw/zinc/73/66/60/1136736660.db2.gz YSHJKEMGQOSZPV-UHFFFAOYSA-N 1 1 335.762 3.692 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cn(C)nc3Cl)cc2)CC1 ZINC000856769530 1136809173 /nfs/dbraw/zinc/80/91/73/1136809173.db2.gz QXJGJXOMKQMGSC-UHFFFAOYSA-N 1 1 332.879 3.600 20 10 EHCDMO CCC[N@H+]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 ZINC001136025712 1136841554 /nfs/dbraw/zinc/84/15/54/1136841554.db2.gz VXBLERBJTSSTKB-HXUWFJFHSA-N 1 1 343.515 3.510 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H]2CCSc3ccccc32)cc1 ZINC000817938663 1136847976 /nfs/dbraw/zinc/84/79/76/1136847976.db2.gz PBLXSQLSYKMEIY-MSOLQXFVSA-N 1 1 327.497 3.579 20 10 EHCDMO CCOc1cccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817944122 1136849193 /nfs/dbraw/zinc/84/91/93/1136849193.db2.gz XJKJANUVRSPCLX-QRWLVFNGSA-N 1 1 327.472 3.502 20 10 EHCDMO CCOc1cccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817944119 1136849361 /nfs/dbraw/zinc/84/93/61/1136849361.db2.gz XJKJANUVRSPCLX-FOIQADDNSA-N 1 1 327.472 3.502 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817946914 1136849831 /nfs/dbraw/zinc/84/98/31/1136849831.db2.gz HSZKVOKKXLHLPU-JMSVASOKSA-N 1 1 341.293 3.584 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Br)ccc1[O-] ZINC000817949877 1136850446 /nfs/dbraw/zinc/85/04/46/1136850446.db2.gz SUQMBFQHVTYTKN-LBPRGKRZSA-N 1 1 349.272 3.507 20 10 EHCDMO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817948334 1136850609 /nfs/dbraw/zinc/85/06/09/1136850609.db2.gz XZAYDBWPZQTPQV-BQFCYCMXSA-N 1 1 333.495 3.855 20 10 EHCDMO CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817964388 1136851961 /nfs/dbraw/zinc/85/19/61/1136851961.db2.gz ARIZNWHZKMFMID-CQSZACIVSA-N 1 1 330.394 3.841 20 10 EHCDMO C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964395 1136852112 /nfs/dbraw/zinc/85/21/12/1136852112.db2.gz BEWQNWDTYHUBHN-JXFKEZNVSA-N 1 1 333.495 3.856 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCc2scnc21)c1ccc(N2CCOCC2)cc1 ZINC000858355947 1136960961 /nfs/dbraw/zinc/96/09/61/1136960961.db2.gz SNJZQFZKQVSVFR-PBHICJAKSA-N 1 1 343.496 3.708 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CC2(C)COC2)c(C)n1-c1ccccc1C ZINC000859570128 1137020442 /nfs/dbraw/zinc/02/04/42/1137020442.db2.gz RFDRPSBTKXYHSL-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CC2(C)COC2)c(C)n1-c1ccccc1C ZINC000859570128 1137020443 /nfs/dbraw/zinc/02/04/43/1137020443.db2.gz RFDRPSBTKXYHSL-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)cc1 ZINC000823476920 1137101722 /nfs/dbraw/zinc/10/17/22/1137101722.db2.gz DEPUNOAJIUBRBD-FQEVSTJZSA-N 1 1 342.508 3.997 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@H]1O ZINC000823490175 1137102267 /nfs/dbraw/zinc/10/22/67/1137102267.db2.gz WCLDKWCGIKNULH-VQIMIIECSA-N 1 1 330.497 3.587 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000862024664 1137127222 /nfs/dbraw/zinc/12/72/22/1137127222.db2.gz BGYUFWUKXQJJPM-ZWKOTPCHSA-N 1 1 345.531 3.802 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000862353972 1137139805 /nfs/dbraw/zinc/13/98/05/1137139805.db2.gz HFSOWAXTOXHUQW-LBPRGKRZSA-N 1 1 333.229 3.539 20 10 EHCDMO C[C@@]12CC[N@@H+](Cc3c(O)cccc3Br)C[C@@H]1C2(F)F ZINC000862376412 1137141297 /nfs/dbraw/zinc/14/12/97/1137141297.db2.gz YLDIKBQDQDFYBP-QWHCGFSZSA-N 1 1 332.188 3.632 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1F ZINC000862370459 1137141050 /nfs/dbraw/zinc/14/10/50/1137141050.db2.gz MDQQOWGWLBWGNX-ZWKOTPCHSA-N 1 1 336.426 3.564 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1F ZINC000862370459 1137141052 /nfs/dbraw/zinc/14/10/52/1137141052.db2.gz MDQQOWGWLBWGNX-ZWKOTPCHSA-N 1 1 336.426 3.564 20 10 EHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC000862369029 1137141109 /nfs/dbraw/zinc/14/11/09/1137141109.db2.gz RXNQKFAWCYTCHK-INIZCTEOSA-N 1 1 334.414 3.708 20 10 EHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC000862369029 1137141111 /nfs/dbraw/zinc/14/11/11/1137141111.db2.gz RXNQKFAWCYTCHK-INIZCTEOSA-N 1 1 334.414 3.708 20 10 EHCDMO CC[C@H](C)[N@@H+](CCO)Cc1ccc(OCc2ccccc2)cc1O ZINC000862386926 1137141894 /nfs/dbraw/zinc/14/18/94/1137141894.db2.gz DKISYTPWQMTDBC-INIZCTEOSA-N 1 1 329.440 3.564 20 10 EHCDMO COc1cc(C[N@@H+]2Cc3ccc(O)cc3C2)c(O)c(C(C)(C)C)c1 ZINC000862451066 1137145227 /nfs/dbraw/zinc/14/52/27/1137145227.db2.gz HUGBWKKCVSIHFX-UHFFFAOYSA-N 1 1 327.424 3.920 20 10 EHCDMO COc1cc(C[N@H+]2Cc3ccc(O)cc3C2)c(O)c(C(C)(C)C)c1 ZINC000862451066 1137145228 /nfs/dbraw/zinc/14/52/28/1137145228.db2.gz HUGBWKKCVSIHFX-UHFFFAOYSA-N 1 1 327.424 3.920 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1O ZINC000824696984 1137147101 /nfs/dbraw/zinc/14/71/01/1137147101.db2.gz WXJVMCKVEGRIOB-XHSDSOJGSA-N 1 1 339.863 3.570 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000825561483 1137148587 /nfs/dbraw/zinc/14/85/87/1137148587.db2.gz CEWQBVIXOZDISB-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2O)CC1 ZINC000824777226 1137151599 /nfs/dbraw/zinc/15/15/99/1137151599.db2.gz MCBYJJLAEJOORS-HNNXBMFYSA-N 1 1 342.277 3.936 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1Cl ZINC000824949670 1137159059 /nfs/dbraw/zinc/15/90/59/1137159059.db2.gz NWBJYIXRVSDGKQ-CYBMUJFWSA-N 1 1 346.862 3.729 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@H](CCCO)C2)cc1 ZINC000825337621 1137173455 /nfs/dbraw/zinc/17/34/55/1137173455.db2.gz HNVJKKHBXXMDSD-KRWDZBQOSA-N 1 1 344.524 3.979 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3ccc(F)cc3[C@H](C)C2)cc1OC ZINC000844757017 1137250299 /nfs/dbraw/zinc/25/02/99/1137250299.db2.gz DSPILJOTGVAWOY-CYBMUJFWSA-N 1 1 345.414 3.710 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCc2ccccc2F)c1 ZINC000794843152 1137285174 /nfs/dbraw/zinc/28/51/74/1137285174.db2.gz VDZNOOFWYDENKM-ZDUSSCGKSA-N 1 1 331.387 3.601 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@](O)(c3ccc(Cl)cc3)C2)c1O ZINC000846009540 1137325368 /nfs/dbraw/zinc/32/53/68/1137325368.db2.gz CPBXLIJBZVMDSC-IBGZPJMESA-N 1 1 347.842 3.538 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000846112914 1137333584 /nfs/dbraw/zinc/33/35/84/1137333584.db2.gz UYXOBWSDOWUEGP-CALCHBBNSA-N 1 1 331.362 3.668 20 10 EHCDMO C[C@@H](NC(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000868103634 1137397122 /nfs/dbraw/zinc/39/71/22/1137397122.db2.gz SANWHAUBQPQFSA-IXDOHACOSA-N 1 1 347.503 3.511 20 10 EHCDMO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000872135629 1137573535 /nfs/dbraw/zinc/57/35/35/1137573535.db2.gz XNADQJLFWCOXBQ-GXSJLCMTSA-N 1 1 325.334 3.921 20 10 EHCDMO CC1CC(n2nnc3c2C[N@@H+](Cc2c(O)ccc4ccccc42)CC3)C1 ZINC000872686139 1137582815 /nfs/dbraw/zinc/58/28/15/1137582815.db2.gz YIMAKJKGPZVBCF-UHFFFAOYSA-N 1 1 348.450 3.666 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nnc3n2CCCCC3)cc1C ZINC000873011547 1137588001 /nfs/dbraw/zinc/58/80/01/1137588001.db2.gz YYIFOKZARRIUME-INIZCTEOSA-N 1 1 342.487 3.953 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1Cn1cccn1 ZINC000873038004 1137588630 /nfs/dbraw/zinc/58/86/30/1137588630.db2.gz HYOVLVZWKSJYQE-AWEZNQCLSA-N 1 1 342.468 3.556 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1[O-] ZINC000873241746 1137595054 /nfs/dbraw/zinc/59/50/54/1137595054.db2.gz YPGPZNACZFYMHI-WHOFXGATSA-N 1 1 341.293 3.713 20 10 EHCDMO COCCc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000876585082 1137656264 /nfs/dbraw/zinc/65/62/64/1137656264.db2.gz YQOLMFWUHCNGMR-UHFFFAOYSA-N 1 1 347.528 3.809 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000877195778 1137672758 /nfs/dbraw/zinc/67/27/58/1137672758.db2.gz QRDRLSPEWAURDW-ZDUSSCGKSA-N 1 1 339.361 3.753 20 10 EHCDMO COc1cccc(-c2noc([C@@H](C)[NH2+]Cc3c(C)cccc3O)n2)c1 ZINC000877470756 1137677242 /nfs/dbraw/zinc/67/72/42/1137677242.db2.gz LSFLUHKPYSBONS-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO OC1CCN(c2ccc(C[N@@H+](CCC3CC3)CC3CC3)cc2)CC1 ZINC000877641078 1137684060 /nfs/dbraw/zinc/68/40/60/1137684060.db2.gz VVVDGPMISUZHFF-UHFFFAOYSA-N 1 1 328.500 3.660 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1F ZINC000877674934 1137685292 /nfs/dbraw/zinc/68/52/92/1137685292.db2.gz XMUMMNHGGVXCEF-PXNSSMCTSA-N 1 1 328.431 3.590 20 10 EHCDMO Cc1c(C[N@H+]2Cc3cccc(O)c3C2)sc2nc(C)nc(C)c12 ZINC000877704044 1137686396 /nfs/dbraw/zinc/68/63/96/1137686396.db2.gz YAYAKCFJGVEYBL-UHFFFAOYSA-N 1 1 325.437 3.838 20 10 EHCDMO CCOc1ccc(-c2noc(C[NH2+][C@H](C)c3ccccc3O)n2)cc1 ZINC000879649255 1137753683 /nfs/dbraw/zinc/75/36/83/1137753683.db2.gz OLEXVECBJQNLHQ-CYBMUJFWSA-N 1 1 339.395 3.692 20 10 EHCDMO COc1cc(C[NH2+]Cc2cc(F)cc(F)c2O)ccc1OC(C)C ZINC000882887407 1137836920 /nfs/dbraw/zinc/83/69/20/1137836920.db2.gz PSXCTNPMGZULGK-UHFFFAOYSA-N 1 1 337.366 3.756 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000882921266 1137838624 /nfs/dbraw/zinc/83/86/24/1137838624.db2.gz CAYFVIZDJBCQRB-LIRRHRJNSA-N 1 1 333.378 3.928 20 10 EHCDMO C[C@@H](c1cccc(NCc2cc(F)cc(F)c2O)c1)[NH+]1CCOCC1 ZINC000883062376 1137843182 /nfs/dbraw/zinc/84/31/82/1137843182.db2.gz AEACUOYKHRVZPB-ZDUSSCGKSA-N 1 1 348.393 3.676 20 10 EHCDMO OC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(C(F)(F)F)cc1 ZINC000883077421 1137843698 /nfs/dbraw/zinc/84/36/98/1137843698.db2.gz JJZVXLNQEDHWPZ-AWEZNQCLSA-N 1 1 347.283 3.512 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)[C@@H](C)c2ccco2)c1O ZINC000131041899 1137845656 /nfs/dbraw/zinc/84/56/56/1137845656.db2.gz MCARTLVBPSOJOK-JTQLQIEISA-N 1 1 340.217 3.949 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccsc1 ZINC000883291158 1137852924 /nfs/dbraw/zinc/85/29/24/1137852924.db2.gz UNAUWTZTRILPBM-LJQANCHMSA-N 1 1 329.513 3.741 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(C)cc(Br)c1O)[C@H]1CCCOC1 ZINC000883353009 1137857058 /nfs/dbraw/zinc/85/70/58/1137857058.db2.gz MJDCROMAERHQJF-SWLSCSKDSA-N 1 1 342.277 3.758 20 10 EHCDMO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000016873339 1137946853 /nfs/dbraw/zinc/94/68/53/1137946853.db2.gz CXJBHIGDHGTFAC-NSHDSACASA-N 1 1 342.420 3.924 20 10 EHCDMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000016873339 1137946854 /nfs/dbraw/zinc/94/68/54/1137946854.db2.gz CXJBHIGDHGTFAC-NSHDSACASA-N 1 1 342.420 3.924 20 10 EHCDMO Cc1ccc2nc(C[N@H+]3CCCc4cc(O)c(O)cc4C3)ccc2c1 ZINC001137218673 1138005864 /nfs/dbraw/zinc/00/58/64/1138005864.db2.gz HYZFXMKHKVXXHT-UHFFFAOYSA-N 1 1 334.419 3.903 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1c(O)cccc1F ZINC000886510128 1138086536 /nfs/dbraw/zinc/08/65/36/1138086536.db2.gz VIAIFQHVQDCBLH-AWEZNQCLSA-N 1 1 342.414 3.899 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1c(O)cccc1F ZINC000886513245 1138087612 /nfs/dbraw/zinc/08/76/12/1138087612.db2.gz XCJLNHWXARGBTC-QWHCGFSZSA-N 1 1 344.386 3.900 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)c1c(O)cccc1F ZINC000886553687 1138095369 /nfs/dbraw/zinc/09/53/69/1138095369.db2.gz SWXMCCGDUHNVNO-HOCLYGCPSA-N 1 1 331.431 3.984 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886558067 1138096503 /nfs/dbraw/zinc/09/65/03/1138096503.db2.gz ASHJTKPZNUEEJB-HZMBPMFUSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000886710842 1138122148 /nfs/dbraw/zinc/12/21/48/1138122148.db2.gz HKWYXTSFWPCYLM-GOEBONIOSA-N 1 1 337.435 3.548 20 10 EHCDMO CCOc1cccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000093336029 1138236042 /nfs/dbraw/zinc/23/60/42/1138236042.db2.gz VHVVJYDXPPZWRC-UHFFFAOYSA-N 1 1 332.469 3.758 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000093336029 1138236046 /nfs/dbraw/zinc/23/60/46/1138236046.db2.gz VHVVJYDXPPZWRC-UHFFFAOYSA-N 1 1 332.469 3.758 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](c2nccn2C)C2CC2)cc1F ZINC000183274498 1140026263 /nfs/dbraw/zinc/02/62/63/1140026263.db2.gz HTFKFMHHISTGFN-SFHVURJKSA-N 1 1 330.451 3.646 20 10 EHCDMO Cc1cccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1O ZINC000183512977 1140044139 /nfs/dbraw/zinc/04/41/39/1140044139.db2.gz IXFXKYZRRWBIPG-GOSISDBHSA-N 1 1 327.424 3.587 20 10 EHCDMO CC(C)C(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000184913715 1140125759 /nfs/dbraw/zinc/12/57/59/1140125759.db2.gz JDIMTWSHSKOARH-CYBMUJFWSA-N 1 1 330.403 3.977 20 10 EHCDMO COCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185681920 1140162896 /nfs/dbraw/zinc/16/28/96/1140162896.db2.gz YLTOWPOFCDXSFV-CQSZACIVSA-N 1 1 333.403 3.716 20 10 EHCDMO C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)c(F)c1[O-] ZINC000191179807 1140441834 /nfs/dbraw/zinc/44/18/34/1140441834.db2.gz MICWJSVNVHZEHJ-CQSZACIVSA-N 1 1 346.421 3.986 20 10 EHCDMO COc1cccc(-c2noc([C@@H](C)[NH2+]Cc3cccc(C)c3O)n2)c1 ZINC000191562575 1140472341 /nfs/dbraw/zinc/47/23/41/1140472341.db2.gz GOHFUHRHBNJPJW-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000271225210 1141329173 /nfs/dbraw/zinc/32/91/73/1141329173.db2.gz QNUCHOPFKYYBGP-JBEBIEQOSA-N 1 1 348.487 3.822 20 10 EHCDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1O ZINC000154465170 1015468219 /nfs/dbraw/zinc/46/82/19/1015468219.db2.gz MMHYQRPKUDOGNY-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1O ZINC000170788924 1032627082 /nfs/dbraw/zinc/62/70/82/1032627082.db2.gz NODCNZOKSUGNNL-CYBMUJFWSA-N 1 1 328.387 3.509 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000178887287 1019496841 /nfs/dbraw/zinc/49/68/41/1019496841.db2.gz WQSHMDVMHZKNAI-MRXNPFEDSA-N 1 1 348.487 3.698 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)c(O)c1OC ZINC000891598432 1022072411 /nfs/dbraw/zinc/07/24/11/1022072411.db2.gz TYRXCQGSGRXBSL-UHFFFAOYSA-N 1 1 331.387 3.713 20 10 EHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001142524724 1033228345 /nfs/dbraw/zinc/22/83/45/1033228345.db2.gz IHZRVEAHCRBUPU-AWEZNQCLSA-N 1 1 336.407 3.822 20 10 EHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001142524724 1033228356 /nfs/dbraw/zinc/22/83/56/1033228356.db2.gz IHZRVEAHCRBUPU-AWEZNQCLSA-N 1 1 336.407 3.822 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2ccc(SC)cc2)ccc1[N+](=O)[O-] ZINC000281173296 1024702411 /nfs/dbraw/zinc/70/24/11/1024702411.db2.gz GZPWVDHMIGFAQW-NSHDSACASA-N 1 1 348.424 3.882 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](Cc2nc(C)cs2)C1 ZINC000895822868 1024877102 /nfs/dbraw/zinc/87/71/02/1024877102.db2.gz MPSUOQOTEOISIO-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO Cc1nn(C(C)C)cc1C[NH2+]Cc1cccc(Br)c1O ZINC000281333482 1024908333 /nfs/dbraw/zinc/90/83/33/1024908333.db2.gz SCNUGMPUULXCFF-UHFFFAOYSA-N 1 1 338.249 3.530 20 10 EHCDMO CCC(CC)NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435608736 1025030623 /nfs/dbraw/zinc/03/06/23/1025030623.db2.gz VEJYJAYIGRRDFV-UHFFFAOYSA-N 1 1 341.499 3.713 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCCCC(F)(F)F)CC2)cc1 ZINC000370981832 1026617193 /nfs/dbraw/zinc/61/71/93/1026617193.db2.gz GJLGAVXHGBLYQB-UHFFFAOYSA-N 1 1 330.394 3.940 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)c1 ZINC000273432226 1027425952 /nfs/dbraw/zinc/42/59/52/1027425952.db2.gz WAJUUYDDXQAMAO-KGLIPLIRSA-N 1 1 343.423 3.908 20 10 EHCDMO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)on1 ZINC000273558406 1027492630 /nfs/dbraw/zinc/49/26/30/1027492630.db2.gz HKIJQHLMULIFGS-GFCCVEGCSA-N 1 1 346.427 3.921 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(N2CCCCCC2)cc1 ZINC000187721287 1027942033 /nfs/dbraw/zinc/94/20/33/1027942033.db2.gz CFJKTNCXJDOYSF-OAHLLOKOSA-N 1 1 341.455 3.610 20 10 EHCDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000093863748 1030683688 /nfs/dbraw/zinc/68/36/88/1030683688.db2.gz TZFQRXKWVDJQTG-HXUWFJFHSA-N 1 1 338.499 3.920 20 10 EHCDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000093845413 1030684507 /nfs/dbraw/zinc/68/45/07/1030684507.db2.gz IMQLOKCKMOLWTL-OAQYLSRUSA-N 1 1 339.483 3.589 20 10 EHCDMO c1nc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n(-c2ccccc2)n1 ZINC000278614705 1031654042 /nfs/dbraw/zinc/65/40/42/1031654042.db2.gz DDJUHVYWCYYIOP-UHFFFAOYSA-N 1 1 347.466 3.547 20 10 EHCDMO COC(=O)c1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2O)cc1 ZINC001142534648 1033344435 /nfs/dbraw/zinc/34/44/35/1033344435.db2.gz QRSFRKXUNDJGEQ-QGZVFWFLSA-N 1 1 347.361 3.794 20 10 EHCDMO COC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2O)cc1 ZINC001142534648 1033344447 /nfs/dbraw/zinc/34/44/47/1033344447.db2.gz QRSFRKXUNDJGEQ-QGZVFWFLSA-N 1 1 347.361 3.794 20 10 EHCDMO CCC[N@@H+](Cc1cncc(Br)c1)Cc1ccccc1O ZINC000170779225 1033602096 /nfs/dbraw/zinc/60/20/96/1033602096.db2.gz SSGFYQLKGOBMGN-UHFFFAOYSA-N 1 1 335.245 3.962 20 10 EHCDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000064028870 1033959982 /nfs/dbraw/zinc/95/99/82/1033959982.db2.gz TVUSNBVPEYCRNF-UHFFFAOYSA-N 1 1 343.423 3.550 20 10 EHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(OC)c2O)C12CCC2 ZINC000761202523 1034411564 /nfs/dbraw/zinc/41/15/64/1034411564.db2.gz FQWUMLSICLHVJB-JKSUJKDBSA-N 1 1 339.863 3.834 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1O ZINC000164282719 1035514615 /nfs/dbraw/zinc/51/46/15/1035514615.db2.gz ARKCLRYLBTZSFJ-INIZCTEOSA-N 1 1 341.407 3.775 20 10 EHCDMO COCC1([NH2+]Cc2cc(C)cc(Br)c2O)CCCC1 ZINC000850344924 1036041241 /nfs/dbraw/zinc/04/12/41/1036041241.db2.gz BSPZLKCXDUXKRT-UHFFFAOYSA-N 1 1 328.250 3.512 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184226929 1038798178 /nfs/dbraw/zinc/79/81/78/1038798178.db2.gz PZLNUANRIWNWAA-UHFFFAOYSA-N 1 1 348.374 3.860 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c(O)cc1C ZINC000905679915 1039038332 /nfs/dbraw/zinc/03/83/32/1039038332.db2.gz ZHTQHDDILICTQZ-AWEZNQCLSA-N 1 1 333.325 3.576 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(C)s1 ZINC000898450426 1039047558 /nfs/dbraw/zinc/04/75/58/1039047558.db2.gz RIPSGSYACHRNAM-ACJLOTCBSA-N 1 1 346.544 3.779 20 10 EHCDMO Cc1cnc(Cl)c(CNC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000898446800 1039058095 /nfs/dbraw/zinc/05/80/95/1039058095.db2.gz BNPAVZUMWHSJNK-SFHVURJKSA-N 1 1 346.906 3.502 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](c1c(F)cccc1F)N(C)C)c1ccc(F)cc1O ZINC000185458784 1039115253 /nfs/dbraw/zinc/11/52/53/1039115253.db2.gz RTMZBWKUJHPCSN-BDJLRTHQSA-N 1 1 338.373 3.763 20 10 EHCDMO CCOC(=O)c1ccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)cc1 ZINC001142603078 1039723754 /nfs/dbraw/zinc/72/37/54/1039723754.db2.gz HSGZHGHRXDWDEL-UHFFFAOYSA-N 1 1 340.467 3.951 20 10 EHCDMO COc1cccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1O ZINC000092435806 1040210762 /nfs/dbraw/zinc/21/07/62/1040210762.db2.gz BJJNESPDGSGSNQ-SFHVURJKSA-N 1 1 327.424 3.582 20 10 EHCDMO COc1cc(C)c(C[N@@H+](C)Cc2cc(C)c(C)cc2O)cc1OC ZINC000027529942 1040600177 /nfs/dbraw/zinc/60/01/77/1040600177.db2.gz CTASGYNXWJOMKI-UHFFFAOYSA-N 1 1 329.440 3.967 20 10 EHCDMO Cc1cc(C[NH+]2CCN(C(=O)C(C)(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000220294157 1040877975 /nfs/dbraw/zinc/87/79/75/1040877975.db2.gz SKUKUGNORINART-UHFFFAOYSA-N 1 1 346.515 3.688 20 10 EHCDMO COc1cc(C)cc(CN[C@@H](C[NH+]2CCCC2)c2ccccc2)c1O ZINC000894140696 1041309334 /nfs/dbraw/zinc/30/93/34/1041309334.db2.gz OBJNRVCNBIKSBJ-IBGZPJMESA-N 1 1 340.467 3.636 20 10 EHCDMO COC1CCC([N@@H+](C)Cc2cc(Br)ccc2O)CC1 ZINC000093414793 1042296620 /nfs/dbraw/zinc/29/66/20/1042296620.db2.gz HXUCNUCXRISXHB-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1O ZINC000093704343 1042431403 /nfs/dbraw/zinc/43/14/03/1042431403.db2.gz FKBVWZJMWSQEMW-SFHVURJKSA-N 1 1 326.440 3.867 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000278915810 1042934064 /nfs/dbraw/zinc/93/40/64/1042934064.db2.gz TYAQYXNVNLLUHZ-CYBMUJFWSA-N 1 1 346.408 3.636 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000278947598 1043069381 /nfs/dbraw/zinc/06/93/81/1043069381.db2.gz YXJNBFFRXIBUAX-ZDUSSCGKSA-N 1 1 330.384 3.777 20 10 EHCDMO C[C@@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1O ZINC000184999192 1126732294 /nfs/dbraw/zinc/73/22/94/1126732294.db2.gz RKICMZVLNUVOTH-CQSZACIVSA-N 1 1 325.387 3.627 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1O ZINC000185062516 1126747973 /nfs/dbraw/zinc/74/79/73/1126747973.db2.gz FIOLYTAFIBGCLY-CQSZACIVSA-N 1 1 346.471 3.935 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(F)cc1O ZINC000185399974 1126885511 /nfs/dbraw/zinc/88/55/11/1126885511.db2.gz OBCDBHBLHZZRLH-OCCSQVGLSA-N 1 1 338.423 3.581 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccccc1Cl ZINC000072953289 1126949089 /nfs/dbraw/zinc/94/90/89/1126949089.db2.gz OUOFJOSKYLHKCJ-UHFFFAOYSA-N 1 1 330.859 3.809 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)CC12CCCCC2 ZINC000764954358 1127557185 /nfs/dbraw/zinc/55/71/85/1127557185.db2.gz JQJJHBOWBVQGES-KDOFPFPSSA-N 1 1 331.456 3.610 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000917013487 1122438633 /nfs/dbraw/zinc/43/86/33/1122438633.db2.gz CVOLOCFRDYJVQB-FQEVSTJZSA-N 1 1 346.421 3.729 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)Cc1ccccc1 ZINC000917013444 1122438908 /nfs/dbraw/zinc/43/89/08/1122438908.db2.gz AMUZDWPBOKGREY-OAQYLSRUSA-N 1 1 326.484 3.567 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000917031260 1122446816 /nfs/dbraw/zinc/44/68/16/1122446816.db2.gz ZRYGJWJTQVRFHE-UHFFFAOYSA-N 1 1 327.428 3.991 20 10 EHCDMO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000917437261 1122602742 /nfs/dbraw/zinc/60/27/42/1122602742.db2.gz IQXQFVALFAHDOA-AWEZNQCLSA-N 1 1 325.408 3.922 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@H](c2cnn(C)c2)c2cccc(F)c2)cc1 ZINC000180010780 1123916718 /nfs/dbraw/zinc/91/67/18/1123916718.db2.gz XQOMYBYRRTXDKU-FQEVSTJZSA-N 1 1 338.430 3.504 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CCCC[C@@](C)(F)C2)c(Br)c1 ZINC001237064359 1125257907 /nfs/dbraw/zinc/25/79/07/1125257907.db2.gz HTNSHMBUSHBOMZ-OAHLLOKOSA-N 1 1 346.240 3.877 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@@](C)(F)C2)c(Br)c1 ZINC001237064359 1125257910 /nfs/dbraw/zinc/25/79/10/1125257910.db2.gz HTNSHMBUSHBOMZ-OAHLLOKOSA-N 1 1 346.240 3.877 20 10 EHCDMO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C[C@@H]1CCCO1 ZINC000182980828 1125412825 /nfs/dbraw/zinc/41/28/25/1125412825.db2.gz DBKYWBYZXWUWGD-IBGZPJMESA-N 1 1 327.424 3.582 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCOC2(CCC2)C1 ZINC000183095371 1125445980 /nfs/dbraw/zinc/44/59/80/1125445980.db2.gz MBGUXUZZAZTZLR-UHFFFAOYSA-N 1 1 339.435 3.726 20 10 EHCDMO CC(C)CN(C(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1)C1CC1 ZINC000732205814 1130900393 /nfs/dbraw/zinc/90/03/93/1130900393.db2.gz ZTRBGCKABGVQKW-UHFFFAOYSA-N 1 1 344.499 3.784 20 10 EHCDMO Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)cc1 ZINC000733300659 1131018783 /nfs/dbraw/zinc/01/87/83/1131018783.db2.gz LWWZKAKUHHLPNY-KRWDZBQOSA-N 1 1 325.408 3.636 20 10 EHCDMO C[NH+](C)CC1CC[NH+](Cc2c3c(ccc2[O-])oc2c3CCCC2)CC1 ZINC000738077081 1131460327 /nfs/dbraw/zinc/46/03/27/1131460327.db2.gz RVBFOOHRYFGIEK-UHFFFAOYSA-N 1 1 342.483 3.791 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000741752675 1131644026 /nfs/dbraw/zinc/64/40/26/1131644026.db2.gz FEFYMONWBXXKMF-FQEVSTJZSA-N 1 1 328.431 3.855 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000741752675 1131644030 /nfs/dbraw/zinc/64/40/30/1131644030.db2.gz FEFYMONWBXXKMF-FQEVSTJZSA-N 1 1 328.431 3.855 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@@H](C(=O)OC)CC1 ZINC001172807161 1131847879 /nfs/dbraw/zinc/84/78/79/1131847879.db2.gz MMKCFKHELPFOQP-MJGOQNOKSA-N 1 1 332.488 3.696 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)cc1C ZINC000743392471 1131910136 /nfs/dbraw/zinc/91/01/36/1131910136.db2.gz MNYOOERPVJUWKD-KRWDZBQOSA-N 1 1 348.487 3.840 20 10 EHCDMO C[C@H]1CC[C@H]([N@H+]2CCc3cccc(O)c3C2)CN1C(=O)OC(C)(C)C ZINC001173073985 1131955177 /nfs/dbraw/zinc/95/51/77/1131955177.db2.gz FSGXZMSSUFJIFF-HOCLYGCPSA-N 1 1 346.471 3.538 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)C[C@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000745983894 1132342877 /nfs/dbraw/zinc/34/28/77/1132342877.db2.gz IEWKEFXPDRJWSB-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)C[C@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000745983894 1132342884 /nfs/dbraw/zinc/34/28/84/1132342884.db2.gz IEWKEFXPDRJWSB-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000746381787 1132504827 /nfs/dbraw/zinc/50/48/27/1132504827.db2.gz IHTMFNSVGBWMQD-INIZCTEOSA-N 1 1 346.515 3.559 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CCCc4sccc43)cc2)CC1 ZINC000767191194 1132964025 /nfs/dbraw/zinc/96/40/25/1132964025.db2.gz XNLSKRSBVCGLGF-LJQANCHMSA-N 1 1 341.524 3.667 20 10 EHCDMO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001177641472 1133089843 /nfs/dbraw/zinc/08/98/43/1133089843.db2.gz DJXZQVITBVSEGW-PZJWPPBQSA-N 1 1 329.532 3.887 20 10 EHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc(OC)c(OC)c2)c1O ZINC000768202904 1133106777 /nfs/dbraw/zinc/10/67/77/1133106777.db2.gz CXDYDTHEBVTXRK-UHFFFAOYSA-N 1 1 345.439 3.830 20 10 EHCDMO CCc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000768208140 1133107670 /nfs/dbraw/zinc/10/76/70/1133107670.db2.gz NYSARLLEVZBZRK-UHFFFAOYSA-N 1 1 330.497 3.779 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768257187 1133118124 /nfs/dbraw/zinc/11/81/24/1133118124.db2.gz JKKCDIDHWNCFFO-UHFFFAOYSA-N 1 1 326.440 3.631 20 10 EHCDMO Cc1cc(C)n2c(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)cnc2n1 ZINC000768258730 1133118529 /nfs/dbraw/zinc/11/85/29/1133118529.db2.gz WORBSXVRNGEJFG-UHFFFAOYSA-N 1 1 349.482 3.577 20 10 EHCDMO Cc1cccc(C[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)CC(C)C)c1 ZINC000768438998 1133137902 /nfs/dbraw/zinc/13/79/02/1133137902.db2.gz CTFNFPJQSTVUDS-HXUWFJFHSA-N 1 1 341.451 3.785 20 10 EHCDMO C[N@@H+](Cc1cc2c(cc1O)OC[C@H]2O)Cc1cccc2ccccc21 ZINC000768439082 1133138344 /nfs/dbraw/zinc/13/83/44/1133138344.db2.gz GPRUJPOVKFVZGL-HXUWFJFHSA-N 1 1 335.403 3.603 20 10 EHCDMO CN(C)c1ccc(/C=C\C[NH2+][C@H]2COc3cc(F)cc(F)c32)cc1 ZINC001178469601 1133171437 /nfs/dbraw/zinc/17/14/37/1133171437.db2.gz QGLIIZOVRGUUDF-LIMHQNJXSA-N 1 1 330.378 3.767 20 10 EHCDMO CC(C)CCC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768913989 1133202032 /nfs/dbraw/zinc/20/20/32/1133202032.db2.gz BVIWDRVSJUHNPZ-INIZCTEOSA-N 1 1 338.879 3.562 20 10 EHCDMO CN(C)c1ccc(CN[C@@H]2CC[N@@H+](C(C)(C)C)C2)c(C(F)(F)F)c1 ZINC001179141195 1133231318 /nfs/dbraw/zinc/23/13/18/1133231318.db2.gz XKQQHOIZGBGRRB-CQSZACIVSA-N 1 1 343.437 3.734 20 10 EHCDMO CN(C)c1ccc(CN[C@@H]2CC[N@H+](C(C)(C)C)C2)c(C(F)(F)F)c1 ZINC001179141195 1133231323 /nfs/dbraw/zinc/23/13/23/1133231323.db2.gz XKQQHOIZGBGRRB-CQSZACIVSA-N 1 1 343.437 3.734 20 10 EHCDMO CCCc1ccc([C@@H](C)[N@@H+](CC(N)=O)Cc2cc(C)ccc2O)cc1 ZINC000769103745 1133233018 /nfs/dbraw/zinc/23/30/18/1133233018.db2.gz BOUBIULQXHWJAE-MRXNPFEDSA-N 1 1 340.467 3.702 20 10 EHCDMO CCCn1cc(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)nn1 ZINC001179333281 1133244871 /nfs/dbraw/zinc/24/48/71/1133244871.db2.gz SHUMGGVCLKHRLD-UHFFFAOYSA-N 1 1 337.471 3.694 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@H]2C2CCC2)c1O ZINC000769244414 1133250402 /nfs/dbraw/zinc/25/04/02/1133250402.db2.gz NZZKBJIENRKSLP-AWEZNQCLSA-N 1 1 340.261 3.928 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769307969 1133257777 /nfs/dbraw/zinc/25/77/77/1133257777.db2.gz MIFHEISZUXBYSH-IBGZPJMESA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769307969 1133257784 /nfs/dbraw/zinc/25/77/84/1133257784.db2.gz MIFHEISZUXBYSH-IBGZPJMESA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)Cc2ccccc2OC)c1 ZINC000769326331 1133262995 /nfs/dbraw/zinc/26/29/95/1133262995.db2.gz JLGUMCGVKSTHJW-HNNXBMFYSA-N 1 1 329.440 3.863 20 10 EHCDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C2CC2)ccc1N1CCCCC1 ZINC000769332186 1133264944 /nfs/dbraw/zinc/26/49/44/1133264944.db2.gz YQTICAAWNLOBQD-KRWDZBQOSA-N 1 1 329.444 3.960 20 10 EHCDMO C1=CC[C@]2(CC1)CCC[N@H+](Cc1ccc(N3CCOCC3)cc1)C2 ZINC000769428946 1133284183 /nfs/dbraw/zinc/28/41/83/1133284183.db2.gz XFCWFQPMKPUTCX-NRFANRHFSA-N 1 1 326.484 3.846 20 10 EHCDMO CCOc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c(O)c1 ZINC000769490850 1133291283 /nfs/dbraw/zinc/29/12/83/1133291283.db2.gz ZIYBTTFSUUZTKJ-HNAYVOBHSA-N 1 1 327.424 3.753 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c(O)c1 ZINC000769490850 1133291285 /nfs/dbraw/zinc/29/12/85/1133291285.db2.gz ZIYBTTFSUUZTKJ-HNAYVOBHSA-N 1 1 327.424 3.753 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC000769506209 1133304735 /nfs/dbraw/zinc/30/47/35/1133304735.db2.gz DCDQYPZNKVKVEF-LJQANCHMSA-N 1 1 341.451 3.663 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC001179906515 1133305443 /nfs/dbraw/zinc/30/54/43/1133305443.db2.gz XGMIOWRLZZBHKG-UZQCKINESA-N 1 1 348.490 3.940 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC001179906515 1133305445 /nfs/dbraw/zinc/30/54/45/1133305445.db2.gz XGMIOWRLZZBHKG-UZQCKINESA-N 1 1 348.490 3.940 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001180349992 1133360201 /nfs/dbraw/zinc/36/02/01/1133360201.db2.gz RZVGTQBQZGLVIQ-INIZCTEOSA-N 1 1 331.843 3.798 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001180349992 1133360204 /nfs/dbraw/zinc/36/02/04/1133360204.db2.gz RZVGTQBQZGLVIQ-INIZCTEOSA-N 1 1 331.843 3.798 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2cc(F)cc(F)c2O)C2CC2)cc1 ZINC001180558727 1133391802 /nfs/dbraw/zinc/39/18/02/1133391802.db2.gz RHRUHMSXDFISMX-UHFFFAOYSA-N 1 1 332.394 3.901 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cc(F)cc(F)c2O)C2CC2)cc1 ZINC001180558727 1133391808 /nfs/dbraw/zinc/39/18/08/1133391808.db2.gz RHRUHMSXDFISMX-UHFFFAOYSA-N 1 1 332.394 3.901 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](CC(=O)OC(C)(C)C)C2)c1 ZINC000770333380 1133407167 /nfs/dbraw/zinc/40/71/67/1133407167.db2.gz WUHLQGPTNNFYQM-OAHLLOKOSA-N 1 1 349.471 3.735 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1F ZINC000770328869 1133412139 /nfs/dbraw/zinc/41/21/39/1133412139.db2.gz XODIWMHFTUTOMV-OXQOHEQNSA-N 1 1 344.478 3.952 20 10 EHCDMO CCOc1cc2c(cc1OCC)C[N@@H+](Cc1ccccc1O)CC2 ZINC000770509710 1133435639 /nfs/dbraw/zinc/43/56/39/1133435639.db2.gz RVUQQGAKJVUVAN-UHFFFAOYSA-N 1 1 327.424 3.748 20 10 EHCDMO CCOC(=O)[C@@H](Cc1ccccc1)[N@H+](Cc1ccccc1O)C1CC1 ZINC000770511027 1133435889 /nfs/dbraw/zinc/43/58/89/1133435889.db2.gz VVSIEJDTMRUISN-LJQANCHMSA-N 1 1 339.435 3.531 20 10 EHCDMO CCOC(=O)[C@@H](Cc1ccccc1)[N@@H+](Cc1ccccc1O)C1CC1 ZINC000770511027 1133435892 /nfs/dbraw/zinc/43/58/92/1133435892.db2.gz VVSIEJDTMRUISN-LJQANCHMSA-N 1 1 339.435 3.531 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@](OC)(C(F)(F)F)C2)cc1 ZINC000773889515 1133438970 /nfs/dbraw/zinc/43/89/70/1133438970.db2.gz WLVGTTZQSWNZEO-INIZCTEOSA-N 1 1 330.394 3.686 20 10 EHCDMO CC(C)OC[C@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000770687958 1133462098 /nfs/dbraw/zinc/46/20/98/1133462098.db2.gz HWTHYCKPSLENOW-HXUWFJFHSA-N 1 1 341.451 3.685 20 10 EHCDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001181234580 1133472483 /nfs/dbraw/zinc/47/24/83/1133472483.db2.gz MEGPOGXPFAUNOR-NJRZHNRPSA-N 1 1 344.499 3.677 20 10 EHCDMO COc1cc(C)c(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c(O)c1 ZINC001181486912 1133497732 /nfs/dbraw/zinc/49/77/32/1133497732.db2.gz MVHFLXQSWHHCFY-UHFFFAOYSA-N 1 1 327.424 3.827 20 10 EHCDMO Cc1cc(O)c(CN2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1C(C)C ZINC000746381421 1133514599 /nfs/dbraw/zinc/51/45/99/1133514599.db2.gz IGOLQDMCHFOGPO-GOSISDBHSA-N 1 1 330.516 3.988 20 10 EHCDMO Cc1cc(O)c(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)C ZINC000746381421 1133514605 /nfs/dbraw/zinc/51/46/05/1133514605.db2.gz IGOLQDMCHFOGPO-GOSISDBHSA-N 1 1 330.516 3.988 20 10 EHCDMO CC(C)[N@H+]1CC[C@H](C(=O)N(Cc2ccccc2)c2ccc(N)cc2)C1 ZINC001181984648 1133557578 /nfs/dbraw/zinc/55/75/78/1133557578.db2.gz SCZVQSLAYKDHNZ-SFHVURJKSA-N 1 1 337.467 3.532 20 10 EHCDMO C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774226773 1133642556 /nfs/dbraw/zinc/64/25/56/1133642556.db2.gz RWCWKRTUJUHZOI-FTGAXOIBSA-N 1 1 329.271 3.832 20 10 EHCDMO CO[C@H](C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C(F)(F)F ZINC000774291190 1133657656 /nfs/dbraw/zinc/65/76/56/1133657656.db2.gz DDCIPIFGONIBEV-KSBSHMNSSA-N 1 1 332.149 3.927 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC001183312985 1133791598 /nfs/dbraw/zinc/79/15/98/1133791598.db2.gz NHOGNXAIASYENM-HZPDHXFCSA-N 1 1 342.395 3.735 20 10 EHCDMO COc1cc(C)c(C[N@H+]2CCC[C@@H](c3cc(C(C)C)n[nH]3)C2)c(O)c1 ZINC001183662885 1133844336 /nfs/dbraw/zinc/84/43/36/1133844336.db2.gz SSWMFVBTUNKGMY-OAHLLOKOSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)c(C[N@@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c(O)c1 ZINC001183662885 1133844340 /nfs/dbraw/zinc/84/43/40/1133844340.db2.gz SSWMFVBTUNKGMY-OAHLLOKOSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)c(C[N@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c(O)c1 ZINC001183662885 1133844345 /nfs/dbraw/zinc/84/43/45/1133844345.db2.gz SSWMFVBTUNKGMY-OAHLLOKOSA-N 1 1 343.471 3.935 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1C[C@H]2COC[C@@]2(c2ccccc2)C1 ZINC001183799658 1133860126 /nfs/dbraw/zinc/86/01/26/1133860126.db2.gz LWKCAUNIQYWLNT-IFXJQAMLSA-N 1 1 347.817 3.585 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1C[C@H]2COC[C@@]2(c2ccccc2)C1 ZINC001183799658 1133860133 /nfs/dbraw/zinc/86/01/33/1133860133.db2.gz LWKCAUNIQYWLNT-IFXJQAMLSA-N 1 1 347.817 3.585 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nnnn1C1CCCCC1 ZINC000786785573 1133902830 /nfs/dbraw/zinc/90/28/30/1133902830.db2.gz OGUIMOCHHDDCDV-GJZGRUSLSA-N 1 1 342.491 3.656 20 10 EHCDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(O)cccc1OC ZINC000787330900 1133989846 /nfs/dbraw/zinc/98/98/46/1133989846.db2.gz FVSVQMVNISAMDG-MRXNPFEDSA-N 1 1 335.831 3.874 20 10 EHCDMO Cc1cccc(NCC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)n1 ZINC000788666439 1134158767 /nfs/dbraw/zinc/15/87/67/1134158767.db2.gz BZGCBUSOEDDMPF-GFCCVEGCSA-N 1 1 339.361 3.877 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1OC ZINC000774965371 1134162793 /nfs/dbraw/zinc/16/27/93/1134162793.db2.gz ZLGJYEWBHYXCEM-CQSZACIVSA-N 1 1 346.383 3.559 20 10 EHCDMO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1cccc(C(F)(F)F)c1O ZINC000788749134 1134169502 /nfs/dbraw/zinc/16/95/02/1134169502.db2.gz CLTWEBACUXCZNB-ZWNOBZJWSA-N 1 1 329.318 3.778 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000790709301 1134456282 /nfs/dbraw/zinc/45/62/82/1134456282.db2.gz DLZPLFBTINRUPW-ZDUSSCGKSA-N 1 1 325.408 3.907 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1 ZINC000790715704 1134457100 /nfs/dbraw/zinc/45/71/00/1134457100.db2.gz SDURYTNFFYNZQY-GOEBONIOSA-N 1 1 347.455 3.711 20 10 EHCDMO Cc1ccc(F)c(CN(C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000775169403 1134473371 /nfs/dbraw/zinc/47/33/71/1134473371.db2.gz XBQWIJVJRRSESA-UHFFFAOYSA-N 1 1 341.474 3.518 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000790935140 1134480896 /nfs/dbraw/zinc/48/08/96/1134480896.db2.gz VDTVTQLEKLSLSU-TZMCWYRMSA-N 1 1 342.277 3.589 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000790935140 1134480900 /nfs/dbraw/zinc/48/09/00/1134480900.db2.gz VDTVTQLEKLSLSU-TZMCWYRMSA-N 1 1 342.277 3.589 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCN(Cc2ccccc2)C1 ZINC000790947630 1134483223 /nfs/dbraw/zinc/48/32/23/1134483223.db2.gz UOBASVGFZACIPO-CQSZACIVSA-N 1 1 334.822 3.549 20 10 EHCDMO C[C@](O)(C[NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(Cl)c1 ZINC000790990068 1134489634 /nfs/dbraw/zinc/48/96/34/1134489634.db2.gz IICYNJZPKKLHIR-INIZCTEOSA-N 1 1 344.213 3.835 20 10 EHCDMO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(N2CCOCC2)cc1 ZINC000775259483 1134594945 /nfs/dbraw/zinc/59/49/45/1134594945.db2.gz UTYYDTXZGJGQAC-OAHLLOKOSA-N 1 1 337.423 3.515 20 10 EHCDMO CCc1ccc([C@@H]2C[N@H+](Cc3c(O)cccc3OC)CCO2)cc1 ZINC000792189559 1134666638 /nfs/dbraw/zinc/66/66/38/1134666638.db2.gz PEGUSDZOTCPFTK-FQEVSTJZSA-N 1 1 327.424 3.537 20 10 EHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3c(O)cccc3OC)CCO2)cc1 ZINC000792189559 1134666641 /nfs/dbraw/zinc/66/66/41/1134666641.db2.gz PEGUSDZOTCPFTK-FQEVSTJZSA-N 1 1 327.424 3.537 20 10 EHCDMO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204704 1134814572 /nfs/dbraw/zinc/81/45/72/1134814572.db2.gz VELSTAYVKMNBOH-YJBOKZPZSA-N 1 1 339.863 3.884 20 10 EHCDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204704 1134814581 /nfs/dbraw/zinc/81/45/81/1134814581.db2.gz VELSTAYVKMNBOH-YJBOKZPZSA-N 1 1 339.863 3.884 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@](C)(O)CC2)c(C(F)(F)F)c1 ZINC000793249481 1134888910 /nfs/dbraw/zinc/88/89/10/1134888910.db2.gz FHNRQQRUCHEPRN-INIZCTEOSA-N 1 1 330.394 3.508 20 10 EHCDMO Oc1ccc(Cl)c(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC001192013440 1134956204 /nfs/dbraw/zinc/95/62/04/1134956204.db2.gz NOJIKAREKIUNGW-KRWDZBQOSA-N 1 1 347.842 3.932 20 10 EHCDMO Oc1ccc(Cl)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC001192013440 1134956212 /nfs/dbraw/zinc/95/62/12/1134956212.db2.gz NOJIKAREKIUNGW-KRWDZBQOSA-N 1 1 347.842 3.932 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1O ZINC000793609695 1134971847 /nfs/dbraw/zinc/97/18/47/1134971847.db2.gz RFZKAFLANIIUGY-GJZGRUSLSA-N 1 1 340.261 3.607 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c(C(F)(F)F)c1 ZINC000793620878 1134973476 /nfs/dbraw/zinc/97/34/76/1134973476.db2.gz RTYWJFHBJMEFNL-QGZVFWFLSA-N 1 1 342.405 3.774 20 10 EHCDMO CC(C)[N@H+](Cc1cccs1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775650901 1135416020 /nfs/dbraw/zinc/41/60/20/1135416020.db2.gz HDJGNTKPTZUSNQ-UHFFFAOYSA-N 1 1 343.540 3.911 20 10 EHCDMO CC(C)[N@@H+](Cc1cccs1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775650901 1135416026 /nfs/dbraw/zinc/41/60/26/1135416026.db2.gz HDJGNTKPTZUSNQ-UHFFFAOYSA-N 1 1 343.540 3.911 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)NC(=O)OC(C)(C)C)c1O ZINC000775653628 1135419954 /nfs/dbraw/zinc/41/99/54/1135419954.db2.gz KQTYVLYWGRDGBH-DOTOQJQBSA-N 1 1 348.487 3.968 20 10 EHCDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3cc(OC)ccc3O)C2)cc1 ZINC000775690740 1135529667 /nfs/dbraw/zinc/52/96/67/1135529667.db2.gz SHUYJELESJGXNW-QGZVFWFLSA-N 1 1 341.451 3.864 20 10 EHCDMO Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1O ZINC000775728130 1135585448 /nfs/dbraw/zinc/58/54/48/1135585448.db2.gz OHVPMDVHKPXPLI-QGZVFWFLSA-N 1 1 346.471 3.674 20 10 EHCDMO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)C1 ZINC000775735560 1135592263 /nfs/dbraw/zinc/59/22/63/1135592263.db2.gz SDXDVFAUCBFESM-WOJBJXKFSA-N 1 1 347.572 3.544 20 10 EHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)C1 ZINC000775735560 1135592267 /nfs/dbraw/zinc/59/22/67/1135592267.db2.gz SDXDVFAUCBFESM-WOJBJXKFSA-N 1 1 347.572 3.544 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](N4CCCC4)[C@H]3C)c2c1 ZINC000808190142 1135628329 /nfs/dbraw/zinc/62/83/29/1135628329.db2.gz CUJGADQSIPKJGD-FOIQADDNSA-N 1 1 340.467 3.613 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CC[C@@H]([NH+]4CCCC4)[C@H]3C)c2c1 ZINC000808190142 1135628331 /nfs/dbraw/zinc/62/83/31/1135628331.db2.gz CUJGADQSIPKJGD-FOIQADDNSA-N 1 1 340.467 3.613 20 10 EHCDMO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3ccc(N(C)C)cc3)C2)[nH]n1 ZINC001197541292 1135703777 /nfs/dbraw/zinc/70/37/77/1135703777.db2.gz BMRVWRNEWROUCR-KRWDZBQOSA-N 1 1 326.488 3.979 20 10 EHCDMO CC(C)c1cc([C@H]2CCC[N@H+](Cc3ccc(N(C)C)cc3)C2)n[nH]1 ZINC001197541292 1135703781 /nfs/dbraw/zinc/70/37/81/1135703781.db2.gz BMRVWRNEWROUCR-KRWDZBQOSA-N 1 1 326.488 3.979 20 10 EHCDMO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3ccc(N(C)C)cc3)C2)n[nH]1 ZINC001197541292 1135703783 /nfs/dbraw/zinc/70/37/83/1135703783.db2.gz BMRVWRNEWROUCR-KRWDZBQOSA-N 1 1 326.488 3.979 20 10 EHCDMO C[C@H]([NH2+]Cc1csc(N(C)C2CC2)n1)c1ccc(N(C)C)cc1 ZINC000775836625 1135796177 /nfs/dbraw/zinc/79/61/77/1135796177.db2.gz OKWWNCAOIVIJSV-ZDUSSCGKSA-N 1 1 330.501 3.659 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)c1O ZINC000775871345 1135833465 /nfs/dbraw/zinc/83/34/65/1135833465.db2.gz REKCHCZBTPHQIE-DLBZAZTESA-N 1 1 339.863 3.932 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@H](c3ccccc3)CC2)c1O ZINC001198705010 1135850428 /nfs/dbraw/zinc/85/04/28/1135850428.db2.gz GGEOLXJBPDDKAT-IBGZPJMESA-N 1 1 343.398 3.698 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@H](c3ccccc3)CC2)c1O ZINC001198705010 1135850431 /nfs/dbraw/zinc/85/04/31/1135850431.db2.gz GGEOLXJBPDDKAT-IBGZPJMESA-N 1 1 343.398 3.698 20 10 EHCDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(N(C)C)c(F)c1 ZINC000809642663 1135864720 /nfs/dbraw/zinc/86/47/20/1135864720.db2.gz ITXVOZAFXDYJPR-SFHVURJKSA-N 1 1 330.447 3.665 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000809728496 1135872791 /nfs/dbraw/zinc/87/27/91/1135872791.db2.gz AAINZYQKQDORAQ-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000809765397 1135888601 /nfs/dbraw/zinc/88/86/01/1135888601.db2.gz NHERAFWQBXMSTO-DYVFJYSZSA-N 1 1 343.437 3.543 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCCC[C@@H](C)C2)c1O ZINC000776000915 1135916747 /nfs/dbraw/zinc/91/67/47/1135916747.db2.gz ZXKJYOQYHPMVOZ-LLVKDONJSA-N 1 1 328.250 3.785 20 10 EHCDMO C[C@@]1(C[NH2+]Cc2c(O)ccc(Cl)c2F)OCCc2sccc21 ZINC000810171482 1135930638 /nfs/dbraw/zinc/93/06/38/1135930638.db2.gz YLLUFKCZPUMVPR-INIZCTEOSA-N 1 1 341.835 3.824 20 10 EHCDMO CCCCN(C)C[C@@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000810162812 1135933653 /nfs/dbraw/zinc/93/36/53/1135933653.db2.gz FCLQIAVHLWTGRG-CYBMUJFWSA-N 1 1 343.309 3.673 20 10 EHCDMO C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001201686088 1136056847 /nfs/dbraw/zinc/05/68/47/1136056847.db2.gz ZJPKMBICMMZCNS-MBSDFSHPSA-N 1 1 349.522 3.852 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCN3c4ccccc4C[C@H]3C1)CCC2 ZINC000811784155 1136140161 /nfs/dbraw/zinc/14/01/61/1136140161.db2.gz PIFQNWAXSFTRMV-FQEVSTJZSA-N 1 1 334.463 3.518 20 10 EHCDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc(O)c3O)cc2)C1 ZINC000776337107 1136157886 /nfs/dbraw/zinc/15/78/86/1136157886.db2.gz RPXKWJGDJKSEJZ-AWEZNQCLSA-N 1 1 340.423 3.582 20 10 EHCDMO CCCC[N@@H+](Cc1cc(C(=O)OC)c(C)n1C)Cc1ccccc1O ZINC000812761987 1136238529 /nfs/dbraw/zinc/23/85/29/1136238529.db2.gz QQSGVZDIZZGDIO-UHFFFAOYSA-N 1 1 344.455 3.628 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nccc(OC)c2F)cc1F ZINC000850381001 1136246126 /nfs/dbraw/zinc/24/61/26/1136246126.db2.gz SMCUPDBJCUNJNT-UHFFFAOYSA-N 1 1 335.398 3.504 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)cc1 ZINC000812781482 1136246823 /nfs/dbraw/zinc/24/68/23/1136246823.db2.gz WBPIRXZPHPFGSZ-QFIPXVFZSA-N 1 1 338.495 3.669 20 10 EHCDMO CCn1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)nn1 ZINC000850522537 1136276208 /nfs/dbraw/zinc/27/62/08/1136276208.db2.gz UCCFEQUWFCHERN-INIZCTEOSA-N 1 1 327.476 3.529 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)c1nccn1C ZINC000850572913 1136289496 /nfs/dbraw/zinc/28/94/96/1136289496.db2.gz QOCZXMHEDBLHID-LSDHHAIUSA-N 1 1 330.451 3.961 20 10 EHCDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2)o1)Cc1ccccc1O ZINC000109772575 1136339672 /nfs/dbraw/zinc/33/96/72/1136339672.db2.gz OOLDPDJKLVQMRQ-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2)o1)Cc1ccccc1O ZINC000109772575 1136339677 /nfs/dbraw/zinc/33/96/77/1136339677.db2.gz OOLDPDJKLVQMRQ-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc2ccccc2n(C)c1=O)c1ccc(F)cc1O ZINC000813880865 1136371710 /nfs/dbraw/zinc/37/17/10/1136371710.db2.gz ILUBBFYRAAMANK-KRWDZBQOSA-N 1 1 340.398 3.624 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000814178180 1136412032 /nfs/dbraw/zinc/41/20/32/1136412032.db2.gz FVQDIZZMAACKPR-HXUWFJFHSA-N 1 1 328.500 3.925 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnc2ccccc2n1)C[C@@H]1CCCO1 ZINC000851840354 1136412794 /nfs/dbraw/zinc/41/27/94/1136412794.db2.gz DKLRCZBKINHMSR-SFHVURJKSA-N 1 1 349.434 3.517 20 10 EHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)c1C ZINC000814170236 1136415220 /nfs/dbraw/zinc/41/52/20/1136415220.db2.gz SOSFRVHDMBMJTO-UHFFFAOYSA-N 1 1 342.458 3.911 20 10 EHCDMO CCC[N@@H+](CC(=O)NCCC1=CCCCC1)Cc1ccccc1O ZINC000110733257 1136471697 /nfs/dbraw/zinc/47/16/97/1136471697.db2.gz JHIASGZAWMFZKY-UHFFFAOYSA-N 1 1 330.472 3.611 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239246 1136520989 /nfs/dbraw/zinc/52/09/89/1136520989.db2.gz CVASQHFETAXGTJ-IEBWSBKVSA-N 1 1 329.532 3.915 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000853239246 1136520991 /nfs/dbraw/zinc/52/09/91/1136520991.db2.gz CVASQHFETAXGTJ-IEBWSBKVSA-N 1 1 329.532 3.915 20 10 EHCDMO Cc1cc(C[N@H+]2CCCN(C(=O)OC(C)(C)C)CC2)ccc1N(C)C ZINC000815033607 1136543405 /nfs/dbraw/zinc/54/34/05/1136543405.db2.gz NAVXXOVRTODXET-UHFFFAOYSA-N 1 1 347.503 3.504 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C)cc1 ZINC000815118314 1136552035 /nfs/dbraw/zinc/55/20/35/1136552035.db2.gz MXIKHLGZJUIZLR-YJBOKZPZSA-N 1 1 347.503 3.630 20 10 EHCDMO C[C@@H]([NH2+]CCN1CCC[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815559201 1136610885 /nfs/dbraw/zinc/61/08/85/1136610885.db2.gz AALCREGVZJJZKW-QWHCGFSZSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccccc1F)c1cccc(C(F)(F)F)c1O ZINC000815563289 1136611218 /nfs/dbraw/zinc/61/12/18/1136611218.db2.gz YIJUUTOWLDPHJZ-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1 ZINC001170804377 1136643651 /nfs/dbraw/zinc/64/36/51/1136643651.db2.gz NPXUTBPSOINERL-OAQYLSRUSA-N 1 1 335.495 3.780 20 10 EHCDMO COCC[N@H+](Cc1cccs1)Cc1cc(Cl)c(F)cc1O ZINC000816482802 1136723585 /nfs/dbraw/zinc/72/35/85/1136723585.db2.gz UDEATADDFKRUQJ-UHFFFAOYSA-N 1 1 329.824 3.895 20 10 EHCDMO COCC[N@@H+](Cc1cccs1)Cc1cc(Cl)c(F)cc1O ZINC000816482802 1136723588 /nfs/dbraw/zinc/72/35/88/1136723588.db2.gz UDEATADDFKRUQJ-UHFFFAOYSA-N 1 1 329.824 3.895 20 10 EHCDMO Oc1cccc([C@@H]2C[N@@H+](Cc3ccc4ccccc4c3O)CCO2)c1 ZINC000816513624 1136729256 /nfs/dbraw/zinc/72/92/56/1136729256.db2.gz WYHNALPSRCANHB-FQEVSTJZSA-N 1 1 335.403 3.825 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000816552730 1136735912 /nfs/dbraw/zinc/73/59/12/1136735912.db2.gz UTKXICJJBHQJTH-HNNXBMFYSA-N 1 1 330.186 3.661 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(-n2ccnn2)cc1 ZINC000816559371 1136737001 /nfs/dbraw/zinc/73/70/01/1136737001.db2.gz HURQKESEDHTKIM-NSHDSACASA-N 1 1 346.793 3.616 20 10 EHCDMO Oc1c(C[NH2+]Cc2nc(-c3ccccc3)no2)ccc2ccccc21 ZINC000816569951 1136738172 /nfs/dbraw/zinc/73/81/72/1136738172.db2.gz CHFZRELFXHPZSL-UHFFFAOYSA-N 1 1 331.375 3.885 20 10 EHCDMO CCCC[N@@H+](Cc1ccc2c(c1)oc(=O)n2C)Cc1ccccc1O ZINC000816601048 1136739807 /nfs/dbraw/zinc/73/98/07/1136739807.db2.gz PRLFVSVPRNXOMD-UHFFFAOYSA-N 1 1 340.423 3.639 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000816619426 1136742678 /nfs/dbraw/zinc/74/26/78/1136742678.db2.gz GIRJYDWTARFAKP-OAHLLOKOSA-N 1 1 342.395 3.689 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000816619426 1136742680 /nfs/dbraw/zinc/74/26/80/1136742680.db2.gz GIRJYDWTARFAKP-OAHLLOKOSA-N 1 1 342.395 3.689 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1O ZINC000816642561 1136743767 /nfs/dbraw/zinc/74/37/67/1136743767.db2.gz CSIHHCMDMGVJDV-INIZCTEOSA-N 1 1 347.377 3.723 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1O ZINC000816642561 1136743770 /nfs/dbraw/zinc/74/37/70/1136743770.db2.gz CSIHHCMDMGVJDV-INIZCTEOSA-N 1 1 347.377 3.723 20 10 EHCDMO C[C@H]([NH2+]Cc1ccn(-c2ccccc2F)n1)c1ccc(N(C)C)cc1 ZINC000776885320 1136782833 /nfs/dbraw/zinc/78/28/33/1136782833.db2.gz XZPXHMNPFQZBKL-HNNXBMFYSA-N 1 1 338.430 3.928 20 10 EHCDMO CC(C)n1cc(C(C)(C)[NH2+]Cc2ccc(N3CCCCC3)cc2)nn1 ZINC000817419161 1136807219 /nfs/dbraw/zinc/80/72/19/1136807219.db2.gz CCWLARLWFYGWPE-UHFFFAOYSA-N 1 1 341.503 3.874 20 10 EHCDMO COC1([C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000817586724 1136826170 /nfs/dbraw/zinc/82/61/70/1136826170.db2.gz AGTZFDWWEJAHNS-VXGBXAGGSA-N 1 1 347.377 3.646 20 10 EHCDMO CCOc1cncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000857012590 1136832116 /nfs/dbraw/zinc/83/21/16/1136832116.db2.gz NIKJUQSNRIFRDY-UHFFFAOYSA-N 1 1 325.456 3.711 20 10 EHCDMO COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817938478 1136847651 /nfs/dbraw/zinc/84/76/51/1136847651.db2.gz LDVGIIVWNIGIFU-FZKQIMNGSA-N 1 1 347.890 3.765 20 10 EHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000817940756 1136848793 /nfs/dbraw/zinc/84/87/93/1136848793.db2.gz HREVHNLLKKWHOZ-WOJBJXKFSA-N 1 1 341.499 3.810 20 10 EHCDMO CC(C)Oc1ncccc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858098688 1136939488 /nfs/dbraw/zinc/93/94/88/1136939488.db2.gz DALDGVKSDNLNNZ-UHFFFAOYSA-N 1 1 335.398 3.503 20 10 EHCDMO CCCCn1cc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c(C)n1 ZINC000858156070 1136944812 /nfs/dbraw/zinc/94/48/12/1136944812.db2.gz KWEPRFKVYRGIKH-UHFFFAOYSA-N 1 1 336.430 3.626 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cn(C3CCC3)nn2)c(C)n1-c1ccccc1 ZINC000858294627 1136955799 /nfs/dbraw/zinc/95/57/99/1136955799.db2.gz LCMKGPFEZJXDNL-UHFFFAOYSA-N 1 1 335.455 3.700 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490947 1136972727 /nfs/dbraw/zinc/97/27/27/1136972727.db2.gz SYZKACALRYLDEN-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490947 1136972731 /nfs/dbraw/zinc/97/27/31/1136972731.db2.gz SYZKACALRYLDEN-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490945 1136972884 /nfs/dbraw/zinc/97/28/84/1136972884.db2.gz SYZKACALRYLDEN-CHWSQXEVSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490945 1136972886 /nfs/dbraw/zinc/97/28/86/1136972886.db2.gz SYZKACALRYLDEN-CHWSQXEVSA-N 1 1 341.293 3.537 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822529279 1137062525 /nfs/dbraw/zinc/06/25/25/1137062525.db2.gz BVYOJZOYHPTQHH-FQEVSTJZSA-N 1 1 328.500 3.842 20 10 EHCDMO C[N@@H+](CC[C@H]1CC1(Cl)Cl)Cc1ccc(N2CCOCC2)cc1 ZINC000822570763 1137065393 /nfs/dbraw/zinc/06/53/93/1137065393.db2.gz PVKFIFPYFLTUKI-HNNXBMFYSA-N 1 1 343.298 3.539 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@H](O)C2(C)C)cc1 ZINC000824422650 1137137062 /nfs/dbraw/zinc/13/70/62/1137137062.db2.gz DEBBYODSBDMURJ-SFHVURJKSA-N 1 1 330.497 3.730 20 10 EHCDMO COC1(C[NH2+]Cc2cc(C)cc(Br)c2O)CCCC1 ZINC000824445504 1137138310 /nfs/dbraw/zinc/13/83/10/1137138310.db2.gz BXPKCPCSNPSJKZ-UHFFFAOYSA-N 1 1 328.250 3.512 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000862398596 1137142695 /nfs/dbraw/zinc/14/26/95/1137142695.db2.gz MTBOOEFKFWCCSE-IUODEOHRSA-N 1 1 340.261 3.546 20 10 EHCDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000824582977 1137145260 /nfs/dbraw/zinc/14/52/60/1137145260.db2.gz GHPHISBXGKNYNR-INIZCTEOSA-N 1 1 330.394 3.630 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000824952678 1137159267 /nfs/dbraw/zinc/15/92/67/1137159267.db2.gz DGPCUSKOJDXESK-GUYCJALGSA-N 1 1 336.794 3.590 20 10 EHCDMO CCCC(O)(CCC)C[NH2+]Cc1cccc(Br)c1O ZINC000119706344 1137206676 /nfs/dbraw/zinc/20/66/76/1137206676.db2.gz ZOAFIOAKWNUVDZ-UHFFFAOYSA-N 1 1 330.266 3.576 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001144293951 1137267639 /nfs/dbraw/zinc/26/76/39/1137267639.db2.gz WLARNXMJEBBDSA-WDEREUQCSA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001144293951 1137267641 /nfs/dbraw/zinc/26/76/41/1137267641.db2.gz WLARNXMJEBBDSA-WDEREUQCSA-N 1 1 328.225 3.916 20 10 EHCDMO CCn1cc(C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C(C)C)cn1 ZINC000846055122 1137331441 /nfs/dbraw/zinc/33/14/41/1137331441.db2.gz JCDLHIKXCKDJFF-BQYQJAHWSA-N 1 1 326.488 3.893 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c1O ZINC000846156137 1137336494 /nfs/dbraw/zinc/33/64/94/1137336494.db2.gz YFWOYEUBAMJIKD-QMMMGPOBSA-N 1 1 329.293 3.808 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1O ZINC000846139372 1137338441 /nfs/dbraw/zinc/33/84/41/1137338441.db2.gz SICJOQSISRLYIP-RDTXWAMCSA-N 1 1 337.423 3.575 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000282788609 1137451572 /nfs/dbraw/zinc/45/15/72/1137451572.db2.gz QYJSEILYYJWRFO-CQSZACIVSA-N 1 1 345.874 3.958 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@H]1c1ccccc1 ZINC000876793975 1137661504 /nfs/dbraw/zinc/66/15/04/1137661504.db2.gz JZBVRHFILUPKHK-HTAPYJJXSA-N 1 1 336.479 3.841 20 10 EHCDMO Cc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c(O)c1 ZINC000877583670 1137682072 /nfs/dbraw/zinc/68/20/72/1137682072.db2.gz LFAVMLJNHBYADT-MRXNPFEDSA-N 1 1 343.389 3.882 20 10 EHCDMO CCOc1cc(C[N@@H+]2Cc3cccc(O)c3C2)ccc1OC(=O)CC ZINC000877702997 1137686461 /nfs/dbraw/zinc/68/64/61/1137686461.db2.gz NULIQONYRPBOKL-UHFFFAOYSA-N 1 1 341.407 3.622 20 10 EHCDMO CCOc1cc(C[N@H+]2Cc3cccc(O)c3C2)ccc1OC(=O)CC ZINC000877702997 1137686462 /nfs/dbraw/zinc/68/64/62/1137686462.db2.gz NULIQONYRPBOKL-UHFFFAOYSA-N 1 1 341.407 3.622 20 10 EHCDMO OC1CCN(c2ccc(C[NH2+][C@H](CF)c3ccc(F)cc3)cc2)CC1 ZINC000877759238 1137688515 /nfs/dbraw/zinc/68/85/15/1137688515.db2.gz ZRHMMGQPOMLEDN-HXUWFJFHSA-N 1 1 346.421 3.587 20 10 EHCDMO FC(F)(F)[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000877822050 1137691782 /nfs/dbraw/zinc/69/17/82/1137691782.db2.gz PVXAYJASKPHEOT-QGZVFWFLSA-N 1 1 342.405 3.830 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1Cl ZINC000826043402 1137717106 /nfs/dbraw/zinc/71/71/06/1137717106.db2.gz IVSVZACLJLIBLQ-VQIMIIECSA-N 1 1 349.833 3.654 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc2c(c1)OCCO2 ZINC000882909959 1137837702 /nfs/dbraw/zinc/83/77/02/1137837702.db2.gz IGWVCYTZHFEMDF-HNNXBMFYSA-N 1 1 335.350 3.683 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1OCCc2sccc21 ZINC000883127539 1137845576 /nfs/dbraw/zinc/84/55/76/1137845576.db2.gz XUYGECCHPIURSW-ABKXIKBNSA-N 1 1 325.380 3.524 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000883264120 1137851453 /nfs/dbraw/zinc/85/14/53/1137851453.db2.gz QRZAEPGEHHUMOC-NVXWUHKLSA-N 1 1 337.435 3.548 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1cccc(C(F)(F)F)c1O ZINC000883276202 1137851983 /nfs/dbraw/zinc/85/19/83/1137851983.db2.gz HOOYOXVXKZEADF-YPMHNXCESA-N 1 1 343.345 3.506 20 10 EHCDMO Cc1cc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)cs1 ZINC000883290889 1137853004 /nfs/dbraw/zinc/85/30/04/1137853004.db2.gz LENWGEYSPKRKFD-INIZCTEOSA-N 1 1 329.513 3.659 20 10 EHCDMO COc1cccc([C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000133710524 1137906672 /nfs/dbraw/zinc/90/66/72/1137906672.db2.gz FJGFCXYFUQQUAD-KRWDZBQOSA-N 1 1 340.467 3.725 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1c(O)cccc1F ZINC000886502605 1138084982 /nfs/dbraw/zinc/08/49/82/1138084982.db2.gz GIIWVGDEHDDIKM-CYBMUJFWSA-N 1 1 328.387 3.509 20 10 EHCDMO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886507561 1138086177 /nfs/dbraw/zinc/08/61/77/1138086177.db2.gz PQNSOLLCKTYXQR-CYBMUJFWSA-N 1 1 336.451 3.609 20 10 EHCDMO COc1ccccc1N1CCC([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886518920 1138089079 /nfs/dbraw/zinc/08/90/79/1138089079.db2.gz JNAQPUNSEJJQER-AWEZNQCLSA-N 1 1 344.430 3.860 20 10 EHCDMO COc1ccccc1N1CC[C@H](C[NH2+][C@H](C)c2c(O)cccc2F)C1 ZINC000886519359 1138089091 /nfs/dbraw/zinc/08/90/91/1138089091.db2.gz TWUUEMOCPMDCQD-HUUCEWRRSA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1c(O)cccc1F ZINC000886558662 1138096791 /nfs/dbraw/zinc/09/67/91/1138096791.db2.gz PDZOLEWLGGGZFY-PSLIRLAXSA-N 1 1 327.758 3.708 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2ccc(COC)o2)c1O ZINC000137074453 1138831521 /nfs/dbraw/zinc/83/15/21/1138831521.db2.gz OCVNPCOSNMGAIW-INIZCTEOSA-N 1 1 331.412 3.867 20 10 EHCDMO CCN(C[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2O)C1)CC(F)(F)F ZINC000177637648 1139630456 /nfs/dbraw/zinc/63/04/56/1139630456.db2.gz AGCXJMYGJPQEHM-HNNXBMFYSA-N 1 1 344.421 3.715 20 10 EHCDMO Cc1ncc(C[N@H+](C)Cc2cc(Br)cc(C)c2O)s1 ZINC000179790360 1139783288 /nfs/dbraw/zinc/78/32/88/1139783288.db2.gz UUVSBTLCDHHHRT-UHFFFAOYSA-N 1 1 341.274 3.860 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc(F)cc1O ZINC000185151255 1140137747 /nfs/dbraw/zinc/13/77/47/1140137747.db2.gz RXKYGPVQMDPEJC-SNVBAGLBSA-N 1 1 337.778 3.807 20 10 EHCDMO C[C@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1O ZINC000185646542 1140159962 /nfs/dbraw/zinc/15/99/62/1140159962.db2.gz DCSDJOIUWPAEIL-LBPRGKRZSA-N 1 1 348.384 3.846 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(O[C@H]2CCOC2)c1 ZINC000185725600 1140166662 /nfs/dbraw/zinc/16/66/62/1140166662.db2.gz OYTKGGVBWLBXOE-YOEHRIQHSA-N 1 1 345.414 3.858 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000777438967 1140269305 /nfs/dbraw/zinc/26/93/05/1140269305.db2.gz DVBGTKMXXBRGKH-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO CC(C)[N@@H+](Cc1c[nH]nc1-c1cccnc1)Cc1ccc(N(C)C)cc1 ZINC000271066776 1141303622 /nfs/dbraw/zinc/30/36/22/1141303622.db2.gz JIOVPJHSJYZRQW-UHFFFAOYSA-N 1 1 349.482 3.948 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000271167697 1141317924 /nfs/dbraw/zinc/31/79/24/1141317924.db2.gz BWSXPOHFLZLZHF-UHFFFAOYSA-N 1 1 326.227 3.802 20 10 EHCDMO CCC[N@@H+](Cc1c(C)nc2sc(C)nn12)Cc1ccccc1O ZINC000271196830 1141323368 /nfs/dbraw/zinc/32/33/68/1141323368.db2.gz OOXKVFVHXREPKT-UHFFFAOYSA-N 1 1 330.457 3.525 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(N(C)C)cc1 ZINC000271452180 1141370423 /nfs/dbraw/zinc/37/04/23/1141370423.db2.gz IIOLMYPMLLKJQZ-MSOLQXFVSA-N 1 1 334.410 3.805 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000274401249 1141516956 /nfs/dbraw/zinc/51/69/56/1141516956.db2.gz QBFFMPPDPLQCEC-XHDPSFHLSA-N 1 1 331.437 3.969 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cccc(-c2nn[nH]n2)c1)C1CCCC1 ZINC000738401384 598620958 /nfs/dbraw/zinc/62/09/58/598620958.db2.gz RQELBGGSZSNHEC-UHFFFAOYSA-N 1 1 349.438 3.517 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)Cc2ccsc2)c1O ZINC000120455149 1015209649 /nfs/dbraw/zinc/20/96/49/1015209649.db2.gz GNMRINKLWBSIOD-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccc3c(c1)OCO3)CCC2 ZINC000728284556 1018618126 /nfs/dbraw/zinc/61/81/26/1018618126.db2.gz FSCLZKILIQQKNI-SFHVURJKSA-N 1 1 337.419 3.947 20 10 EHCDMO CCOCCCN1CC[C@@H]([NH2+][C@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857610 1020074986 /nfs/dbraw/zinc/07/49/86/1020074986.db2.gz JHERGUYJBIHTRT-QXAKKESOSA-N 1 1 334.504 3.570 20 10 EHCDMO COC1CCN(c2ccc(C[N@@H+](C)Cc3ccccc3O)cc2)CC1 ZINC000294975211 1023140331 /nfs/dbraw/zinc/14/03/31/1023140331.db2.gz OVFTZPHMKBQIEK-UHFFFAOYSA-N 1 1 340.467 3.639 20 10 EHCDMO CN(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001168003529 1024118513 /nfs/dbraw/zinc/11/85/13/1024118513.db2.gz OPLMYFFTXLKVDW-WCRBZPEASA-N 1 1 327.516 3.590 20 10 EHCDMO CN(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001168003529 1024118519 /nfs/dbraw/zinc/11/85/19/1024118519.db2.gz OPLMYFFTXLKVDW-WCRBZPEASA-N 1 1 327.516 3.590 20 10 EHCDMO CN(C)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001168003529 1024118524 /nfs/dbraw/zinc/11/85/24/1024118524.db2.gz OPLMYFFTXLKVDW-WCRBZPEASA-N 1 1 327.516 3.590 20 10 EHCDMO CN(C)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001168003529 1024118526 /nfs/dbraw/zinc/11/85/26/1024118526.db2.gz OPLMYFFTXLKVDW-WCRBZPEASA-N 1 1 327.516 3.590 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1 ZINC000729512280 1024150659 /nfs/dbraw/zinc/15/06/59/1024150659.db2.gz HNQJNVOITSDEAU-KSZLIROESA-N 1 1 345.531 3.753 20 10 EHCDMO CC[NH+](Cc1ccc(N(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168004206 1024173516 /nfs/dbraw/zinc/17/35/16/1024173516.db2.gz RPWZGGPGUZSWBQ-CBQGHPETSA-N 1 1 341.543 3.980 20 10 EHCDMO COc1ccccc1O[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520069 1033212630 /nfs/dbraw/zinc/21/26/30/1033212630.db2.gz BDISWVIUEBCLQO-CQSZACIVSA-N 1 1 349.377 3.722 20 10 EHCDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520069 1033212646 /nfs/dbraw/zinc/21/26/46/1033212646.db2.gz BDISWVIUEBCLQO-CQSZACIVSA-N 1 1 349.377 3.722 20 10 EHCDMO CC(C)[N@@H+](CC[S@@](=O)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000729542779 1024606556 /nfs/dbraw/zinc/60/65/56/1024606556.db2.gz UAXVGVKTDRNCJN-XMMPIXPASA-N 1 1 344.524 3.771 20 10 EHCDMO C[C@H]([NH2+]CC1([S@](C)=O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000281145897 1024672428 /nfs/dbraw/zinc/67/24/28/1024672428.db2.gz UWSMPKKDAJJGLR-LXGOIASLSA-N 1 1 336.284 3.651 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)Cc2cccnc2)c1 ZINC000897970958 1033245557 /nfs/dbraw/zinc/24/55/57/1033245557.db2.gz VXKYYDCPCNNJLS-GFCCVEGCSA-N 1 1 335.245 3.579 20 10 EHCDMO COc1cc(C[NH2+]Cc2c(O)cccc2F)c(O)c(C(C)(C)C)c1 ZINC000896637131 1025789640 /nfs/dbraw/zinc/78/96/40/1025789640.db2.gz HYWLDKZWHCRVPW-UHFFFAOYSA-N 1 1 333.403 3.833 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc(F)c1OCC(F)(F)F ZINC000896641202 1025795857 /nfs/dbraw/zinc/79/58/57/1025795857.db2.gz MDWUJAKMYBEKDW-UHFFFAOYSA-N 1 1 347.283 3.901 20 10 EHCDMO CC[C@@H](C)NC(=O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176677024 1026426584 /nfs/dbraw/zinc/42/65/84/1026426584.db2.gz RMENQSPRQKBPAE-SJORKVTESA-N 1 1 340.467 3.870 20 10 EHCDMO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224290 1026900317 /nfs/dbraw/zinc/90/03/17/1026900317.db2.gz JKHZSAPHTQALSN-DLBZAZTESA-N 1 1 333.495 3.808 20 10 EHCDMO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224290 1026900321 /nfs/dbraw/zinc/90/03/21/1026900321.db2.gz JKHZSAPHTQALSN-DLBZAZTESA-N 1 1 333.495 3.808 20 10 EHCDMO Cc1ccccc1C[NH+]1CCN(Cc2c(O)ccc3ccncc32)CC1 ZINC000021969329 1029266211 /nfs/dbraw/zinc/26/62/11/1029266211.db2.gz OXLAPOSMDOIFRS-UHFFFAOYSA-N 1 1 347.462 3.567 20 10 EHCDMO C[C@@H]([NH2+][C@H](C(N)=O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000126123501 1029667974 /nfs/dbraw/zinc/66/79/74/1029667974.db2.gz VACTWYXWYNWTLT-UZLBHIALSA-N 1 1 337.467 3.554 20 10 EHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000160267483 1030643072 /nfs/dbraw/zinc/64/30/72/1030643072.db2.gz BDLOFBCUXHOBSW-CQSZACIVSA-N 1 1 325.474 3.517 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)ccc1N1CCCCC1 ZINC000827972824 1031914854 /nfs/dbraw/zinc/91/48/54/1031914854.db2.gz COCXHWWVIYZVJF-QUCCMNQESA-N 1 1 329.532 3.900 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc1OC ZINC000179434425 1034304436 /nfs/dbraw/zinc/30/44/36/1034304436.db2.gz AGZIBUGDQWRYTJ-UHFFFAOYSA-N 1 1 343.398 3.838 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)CCc2ccc(Cl)cc2)cc1OC ZINC000179443017 1034306041 /nfs/dbraw/zinc/30/60/41/1034306041.db2.gz WOEQGPKNDZFJGD-UHFFFAOYSA-N 1 1 335.831 3.737 20 10 EHCDMO COc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)cc(OC)c1O)CC2 ZINC000761194702 1034378879 /nfs/dbraw/zinc/37/88/79/1034378879.db2.gz FGCWDYUBBNHUSC-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1ccc2c(c1)C[N@H+](Cc1cc(Cl)cc(OC)c1O)CC2 ZINC000761194702 1034378884 /nfs/dbraw/zinc/37/88/84/1034378884.db2.gz FGCWDYUBBNHUSC-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1F ZINC000761226417 1034826929 /nfs/dbraw/zinc/82/69/29/1034826929.db2.gz RFXYBVMKGFAWLD-OAQYLSRUSA-N 1 1 342.458 3.665 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000186113577 1035586774 /nfs/dbraw/zinc/58/67/74/1035586774.db2.gz ATNMATIGVHYOAU-QWHCGFSZSA-N 1 1 326.375 3.524 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c1O ZINC000164413217 1035603054 /nfs/dbraw/zinc/60/30/54/1035603054.db2.gz QSUUBJUBKHUROX-GOSISDBHSA-N 1 1 341.451 3.748 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CCc3cc(F)ccc3C1)CCC2 ZINC001168446235 1036287988 /nfs/dbraw/zinc/28/79/88/1036287988.db2.gz PGUJDPJQHXXTIG-GOSISDBHSA-N 1 1 327.399 3.543 20 10 EHCDMO Oc1c(F)cc(F)cc1CN1CCC[N@H+](CC2CCCCC2)CC1 ZINC001204721035 1036836760 /nfs/dbraw/zinc/83/67/60/1036836760.db2.gz HPCUMTVFVWRHTR-UHFFFAOYSA-N 1 1 338.442 3.758 20 10 EHCDMO Oc1c(F)cc(F)cc1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001204721035 1036836783 /nfs/dbraw/zinc/83/67/83/1036836783.db2.gz HPCUMTVFVWRHTR-UHFFFAOYSA-N 1 1 338.442 3.758 20 10 EHCDMO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccccc1)c1ccc(F)cc1O ZINC000363849405 1038681000 /nfs/dbraw/zinc/68/10/00/1038681000.db2.gz GSFVNOQCZDVQLD-DJJJIMSYSA-N 1 1 325.387 3.705 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@H](C)Cc1ccsc1 ZINC000893719239 1039317319 /nfs/dbraw/zinc/31/73/19/1039317319.db2.gz JUIVMXSXFHIDKH-CYBMUJFWSA-N 1 1 335.469 3.924 20 10 EHCDMO CCOC[C@@H]1CCCC[N@H+]1Cc1cccc(Br)c1[O-] ZINC000313486833 1042017660 /nfs/dbraw/zinc/01/76/60/1042017660.db2.gz QKTZKIKXOXFPDG-ZDUSSCGKSA-N 1 1 328.250 3.546 20 10 EHCDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000313486833 1042017666 /nfs/dbraw/zinc/01/76/66/1042017666.db2.gz QKTZKIKXOXFPDG-ZDUSSCGKSA-N 1 1 328.250 3.546 20 10 EHCDMO CCOC[C@@H]1CCCC[N@H+]1Cc1cccc(Br)c1O ZINC000313486833 1042017671 /nfs/dbraw/zinc/01/76/71/1042017671.db2.gz QKTZKIKXOXFPDG-ZDUSSCGKSA-N 1 1 328.250 3.546 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCCO1 ZINC000278910652 1042918782 /nfs/dbraw/zinc/91/87/82/1042918782.db2.gz VSHFQTKLEYYTMG-ZDBHGNHJSA-N 1 1 334.243 3.544 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2ccccc2C)C2CC2)ccc1[N+](=O)[O-] ZINC000278950240 1043072018 /nfs/dbraw/zinc/07/20/18/1043072018.db2.gz ZHEYNLXBUGAQOV-QGZVFWFLSA-N 1 1 342.395 3.858 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000734448758 1131237617 /nfs/dbraw/zinc/23/76/17/1131237617.db2.gz OYWCEEGWTXWZKS-SFHVURJKSA-N 1 1 339.483 3.508 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1O ZINC000185455760 1126903428 /nfs/dbraw/zinc/90/34/28/1126903428.db2.gz GCCKAYKUKZZRLI-OCCSQVGLSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@H]([NH2+]CCOc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1O ZINC000186108155 1127274747 /nfs/dbraw/zinc/27/47/47/1127274747.db2.gz BATLILMANROKMW-JTQLQIEISA-N 1 1 344.308 3.675 20 10 EHCDMO CS[C@H]1CCCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000770346960 1127572949 /nfs/dbraw/zinc/57/29/49/1127572949.db2.gz FSZUKYIHKTVTBP-ZDUSSCGKSA-N 1 1 330.291 3.872 20 10 EHCDMO CCn1ccc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)n1 ZINC001648960855 1120281489 /nfs/dbraw/zinc/28/14/89/1120281489.db2.gz WWEIOKGQQBKOPA-UHFFFAOYSA-N 1 1 326.488 3.962 20 10 EHCDMO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC000921981560 1128996492 /nfs/dbraw/zinc/99/64/92/1128996492.db2.gz AICFAOSDTNAANY-GOSISDBHSA-N 1 1 325.456 3.956 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H](O)c1ccccc1F ZINC000917019890 1122440303 /nfs/dbraw/zinc/44/03/03/1122440303.db2.gz LNCMNPDHTBJVIR-NRFANRHFSA-N 1 1 342.458 3.981 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2c(F)cccc2F)cc1 ZINC000917019965 1122441243 /nfs/dbraw/zinc/44/12/43/1122441243.db2.gz NNZHQTULYFZRIT-IBGZPJMESA-N 1 1 348.437 3.976 20 10 EHCDMO CCCN(CCC)C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074627 1122471629 /nfs/dbraw/zinc/47/16/29/1122471629.db2.gz DHAMNQGCDLGPHD-UHFFFAOYSA-N 1 1 333.520 3.612 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cc2ccccc2OC)c1 ZINC000179905995 1123894517 /nfs/dbraw/zinc/89/45/17/1123894517.db2.gz HSMDSLJBIJBPSF-QGZVFWFLSA-N 1 1 327.424 3.617 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183066617 1125434844 /nfs/dbraw/zinc/43/48/44/1125434844.db2.gz VXIXKMDWFZEVAM-GOSISDBHSA-N 1 1 341.451 3.830 20 10 EHCDMO COC[C@H](C)[N@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137839161 1130566153 /nfs/dbraw/zinc/56/61/53/1130566153.db2.gz UIRTZRVDYCIMCZ-AWEZNQCLSA-N 1 1 333.403 3.577 20 10 EHCDMO COC[C@H](C)[N@@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137839161 1130566161 /nfs/dbraw/zinc/56/61/61/1130566161.db2.gz UIRTZRVDYCIMCZ-AWEZNQCLSA-N 1 1 333.403 3.577 20 10 EHCDMO Oc1ccccc1C[N@H+](C[C@H](O)COc1ccccc1)C1CCCC1 ZINC000732204316 1130900058 /nfs/dbraw/zinc/90/00/58/1130900058.db2.gz IMSBCSRZVVOCJZ-IBGZPJMESA-N 1 1 341.451 3.577 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000742167173 1131692597 /nfs/dbraw/zinc/69/25/97/1131692597.db2.gz TYYCWWVNQMDNOP-QGZVFWFLSA-N 1 1 326.440 3.864 20 10 EHCDMO COC[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CCO1 ZINC000742157329 1131694974 /nfs/dbraw/zinc/69/49/74/1131694974.db2.gz KOBDBCKCVNYZFD-KRWDZBQOSA-N 1 1 349.515 3.834 20 10 EHCDMO COC(=O)[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001172791416 1131846514 /nfs/dbraw/zinc/84/65/14/1131846514.db2.gz KDDRXKNTTPMRNZ-OALUTQOASA-N 1 1 344.499 3.841 20 10 EHCDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000743371535 1131904102 /nfs/dbraw/zinc/90/41/02/1131904102.db2.gz CFOUTSMUTKPMNT-MLGOLLRUSA-N 1 1 329.371 3.843 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000743870534 1131995427 /nfs/dbraw/zinc/99/54/27/1131995427.db2.gz WMGCTKVVTKUAFP-YESZJQIVSA-N 1 1 332.488 3.782 20 10 EHCDMO c1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001176939020 1133012281 /nfs/dbraw/zinc/01/22/81/1133012281.db2.gz AFWXRAOODRKDNI-HXUWFJFHSA-N 1 1 328.500 3.925 20 10 EHCDMO C[N@H+](CCC[NH2+]Cc1cc(Cl)cc(F)c1[O-])Cc1ccccc1 ZINC001177136854 1133034677 /nfs/dbraw/zinc/03/46/77/1133034677.db2.gz ZGZAGGXSCRGWHR-UHFFFAOYSA-N 1 1 336.838 3.796 20 10 EHCDMO C[N@@H+](CCC[NH2+]Cc1cc(Cl)cc(F)c1[O-])Cc1ccccc1 ZINC001177136854 1133034683 /nfs/dbraw/zinc/03/46/83/1133034683.db2.gz ZGZAGGXSCRGWHR-UHFFFAOYSA-N 1 1 336.838 3.796 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cnc1Cl ZINC000768209076 1133108851 /nfs/dbraw/zinc/10/88/51/1133108851.db2.gz YYQMLTKPSSMXPE-UHFFFAOYSA-N 1 1 345.874 3.512 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1O ZINC000768258669 1133118450 /nfs/dbraw/zinc/11/84/50/1133118450.db2.gz VGYOSEBPTUBKIF-UHFFFAOYSA-N 1 1 326.440 3.631 20 10 EHCDMO CCOc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(O)c1 ZINC000768336029 1133126660 /nfs/dbraw/zinc/12/66/60/1133126660.db2.gz GEQJIALHTMOFSM-UHFFFAOYSA-N 1 1 342.395 3.864 20 10 EHCDMO COc1cc(CNc2ccc3c(c2)[nH+]cn3C)ccc1OC(C)C ZINC001178037281 1133130930 /nfs/dbraw/zinc/13/09/30/1133130930.db2.gz ABWZZYFKJWLUMI-UHFFFAOYSA-N 1 1 325.412 3.981 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](c3ccccc3)CC1)[C@H](O)CO2 ZINC000768453569 1133141451 /nfs/dbraw/zinc/14/14/51/1133141451.db2.gz YXQMSZJPGFZUCV-OXJNMPFZSA-N 1 1 339.435 3.588 20 10 EHCDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c(O)cc1C ZINC000768465295 1133144587 /nfs/dbraw/zinc/14/45/87/1133144587.db2.gz FRRHYRIICPYGLS-IIBYNOLFSA-N 1 1 341.451 3.980 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1c1cccc(F)c1 ZINC000768466441 1133145552 /nfs/dbraw/zinc/14/55/52/1133145552.db2.gz QHRUOYPULAPVCJ-ZQBYOIRZSA-N 1 1 343.398 3.540 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c1 ZINC000769020224 1133214293 /nfs/dbraw/zinc/21/42/93/1133214293.db2.gz BGCPMHOYJRGKSP-FQEVSTJZSA-N 1 1 327.424 3.537 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@@H]2CCCS2)c1 ZINC001179275094 1133242477 /nfs/dbraw/zinc/24/24/77/1133242477.db2.gz ZIOVQTGZZMUBEE-LBPRGKRZSA-N 1 1 330.291 3.838 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC001179559339 1133261387 /nfs/dbraw/zinc/26/13/87/1133261387.db2.gz GJNVNAYPHXHHGH-PELKAZGASA-N 1 1 341.732 3.774 20 10 EHCDMO CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297100 /nfs/dbraw/zinc/29/71/00/1133297100.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 1 1 329.532 3.982 20 10 EHCDMO CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297103 /nfs/dbraw/zinc/29/71/03/1133297103.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 1 1 329.532 3.982 20 10 EHCDMO CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297106 /nfs/dbraw/zinc/29/71/06/1133297106.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 1 1 329.532 3.982 20 10 EHCDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297108 /nfs/dbraw/zinc/29/71/08/1133297108.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 1 1 329.532 3.982 20 10 EHCDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297112 /nfs/dbraw/zinc/29/71/12/1133297112.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 1 1 329.532 3.982 20 10 EHCDMO CCC[N@@H+](Cc1ccc(OCC)cc1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000769471273 1133297904 /nfs/dbraw/zinc/29/79/04/1133297904.db2.gz RQWDPFSPVGGJSC-QXAKKESOSA-N 1 1 333.472 3.816 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000769473208 1133298761 /nfs/dbraw/zinc/29/87/61/1133298761.db2.gz MBFPFKWUTIJYPZ-ORAYPTAESA-N 1 1 331.387 3.502 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000769475035 1133299487 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Cc1cc(O)c(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)C ZINC000746381422 1133514917 /nfs/dbraw/zinc/51/49/17/1133514917.db2.gz IGOLQDMCHFOGPO-SFHVURJKSA-N 1 1 330.516 3.988 20 10 EHCDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C1 ZINC001181822941 1133536124 /nfs/dbraw/zinc/53/61/24/1133536124.db2.gz GNEWAUPDMJVYQG-LJQANCHMSA-N 1 1 339.483 3.569 20 10 EHCDMO CC(C)n1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cn1 ZINC000771925131 1133609853 /nfs/dbraw/zinc/60/98/53/1133609853.db2.gz YKPSELAOPFUEFP-UHFFFAOYSA-N 1 1 325.412 3.965 20 10 EHCDMO CC(C)n1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cn1 ZINC000771925131 1133609855 /nfs/dbraw/zinc/60/98/55/1133609855.db2.gz YKPSELAOPFUEFP-UHFFFAOYSA-N 1 1 325.412 3.965 20 10 EHCDMO CCOC[C@H]1CCCC[N@@H+]1Cc1cc(C)cc(Br)c1O ZINC001182284702 1133616119 /nfs/dbraw/zinc/61/61/19/1133616119.db2.gz HTFOCRUYJBGMQY-CQSZACIVSA-N 1 1 342.277 3.854 20 10 EHCDMO CCOC[C@H]1CCCC[N@H+]1Cc1cc(C)cc(Br)c1O ZINC001182284702 1133616121 /nfs/dbraw/zinc/61/61/21/1133616121.db2.gz HTFOCRUYJBGMQY-CQSZACIVSA-N 1 1 342.277 3.854 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(-c3ccncc3)s2)cc1 ZINC000771933472 1133616810 /nfs/dbraw/zinc/61/68/10/1133616810.db2.gz JWYGDAKFSHYMIB-UHFFFAOYSA-N 1 1 338.480 3.903 20 10 EHCDMO C[C@@H]([NH2+]CCCN1CCCCC1=O)c1cc(Cl)c(Cl)cc1O ZINC000774170443 1133627393 /nfs/dbraw/zinc/62/73/93/1133627393.db2.gz DKBQFRVVLFWHIC-LLVKDONJSA-N 1 1 345.270 3.752 20 10 EHCDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)O[C@@H]2C=CCC2)C1 ZINC000774187125 1133628771 /nfs/dbraw/zinc/62/87/71/1133628771.db2.gz NWILVBGZYZCTSM-MRXNPFEDSA-N 1 1 338.451 3.670 20 10 EHCDMO CCOC(=O)N1CC[C@H]([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000774356056 1133669492 /nfs/dbraw/zinc/66/94/92/1133669492.db2.gz MDVWNSBLOMPXIJ-ZJUUUORDSA-N 1 1 347.242 3.580 20 10 EHCDMO CC[C@@H](C[N@@H+](CC)Cc1cc2c(cc1O)OC[C@H]2O)c1ccccc1 ZINC000774698527 1133880372 /nfs/dbraw/zinc/88/03/72/1133880372.db2.gz CIUQMRIOBZAJGP-MGPUTAFESA-N 1 1 341.451 3.834 20 10 EHCDMO COc1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)ccc1C ZINC000774820416 1134031235 /nfs/dbraw/zinc/03/12/35/1134031235.db2.gz KDHWGSYPDZNPMR-IBGZPJMESA-N 1 1 341.451 3.890 20 10 EHCDMO COc1c(O)c(C[N@H+](C)C[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000774874515 1134082930 /nfs/dbraw/zinc/08/29/30/1134082930.db2.gz CUNZNCSZTOSURS-CYBMUJFWSA-N 1 1 330.384 3.545 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)C[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000774874515 1134082937 /nfs/dbraw/zinc/08/29/37/1134082937.db2.gz CUNZNCSZTOSURS-CYBMUJFWSA-N 1 1 330.384 3.545 20 10 EHCDMO COc1c(O)c(C[N@@H+]2Cc3ccccc3C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000774884935 1134099935 /nfs/dbraw/zinc/09/99/35/1134099935.db2.gz NJCCWJSNKIJOQC-UHFFFAOYSA-N 1 1 342.395 3.602 20 10 EHCDMO COc1c(O)c(C[N@H+]2Cc3ccccc3C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000774884935 1134099940 /nfs/dbraw/zinc/09/99/40/1134099940.db2.gz NJCCWJSNKIJOQC-UHFFFAOYSA-N 1 1 342.395 3.602 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cccc(C(F)(F)F)c1O ZINC000788671661 1134159778 /nfs/dbraw/zinc/15/97/78/1134159778.db2.gz YMANOSJMYKIDBI-RNCFNFMXSA-N 1 1 325.334 3.862 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000774988741 1134180779 /nfs/dbraw/zinc/18/07/79/1134180779.db2.gz FWWANYVMWPHBNU-UHFFFAOYSA-N 1 1 344.411 3.896 20 10 EHCDMO C[N@@H+](CCc1ccccc1F)Cc1cc(Br)ccc1O ZINC001203649767 1134271415 /nfs/dbraw/zinc/27/14/15/1134271415.db2.gz FWEXYXSODXTCER-UHFFFAOYSA-N 1 1 338.220 3.968 20 10 EHCDMO C[C@@]12CC[N@@H+](Cc3cc4c(cc3O)CCC4)C[C@@H]1C2(Cl)Cl ZINC000789482196 1134281545 /nfs/dbraw/zinc/28/15/45/1134281545.db2.gz BDDJDGJNBUCVFC-JKSUJKDBSA-N 1 1 326.267 3.897 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc(-c3cc[nH]n3)o2)C2CC2)cc1 ZINC000789720716 1134325964 /nfs/dbraw/zinc/32/59/64/1134325964.db2.gz KVHLRBOWPCZKNE-UHFFFAOYSA-N 1 1 336.439 3.900 20 10 EHCDMO COc1ccc(CC[NH2+]Cc2c(O)ccc(Cl)c2F)cc1F ZINC000790959937 1134485268 /nfs/dbraw/zinc/48/52/68/1134485268.db2.gz MBZFIPUKIOEGOD-UHFFFAOYSA-N 1 1 327.758 3.665 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000790961934 1134486194 /nfs/dbraw/zinc/48/61/94/1134486194.db2.gz TYVZUSWYGGSMDI-MRVPVSSYSA-N 1 1 335.766 3.617 20 10 EHCDMO CN1CC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)[C@@H]1c1ccccc1 ZINC000790981872 1134495771 /nfs/dbraw/zinc/49/57/71/1134495771.db2.gz ZILLDKGROVUEOS-YJBOKZPZSA-N 1 1 334.822 3.720 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+]2CCC[C@@](C)(O)CC2)c(C)n1-c1ccccc1 ZINC000791630209 1134586461 /nfs/dbraw/zinc/58/64/61/1134586461.db2.gz AHRFOBSJXSFPQA-OAQYLSRUSA-N 1 1 340.467 3.514 20 10 EHCDMO Cc1cc(C(=O)C[N@H+]2CCC[C@@](C)(O)CC2)c(C)n1-c1ccccc1 ZINC000791630209 1134586466 /nfs/dbraw/zinc/58/64/66/1134586466.db2.gz AHRFOBSJXSFPQA-OAQYLSRUSA-N 1 1 340.467 3.514 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c(C(F)(F)F)c1 ZINC000792780832 1134792858 /nfs/dbraw/zinc/79/28/58/1134792858.db2.gz SQKVKMGTHYMCDP-ZDUSSCGKSA-N 1 1 342.405 3.772 20 10 EHCDMO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204699 1134815198 /nfs/dbraw/zinc/81/51/98/1134815198.db2.gz VELSTAYVKMNBOH-CRAIPNDOSA-N 1 1 339.863 3.884 20 10 EHCDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001191204699 1134815207 /nfs/dbraw/zinc/81/52/07/1134815207.db2.gz VELSTAYVKMNBOH-CRAIPNDOSA-N 1 1 339.863 3.884 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CN(C2CCCCC2)C(=O)O1 ZINC001191277529 1134838850 /nfs/dbraw/zinc/83/88/50/1134838850.db2.gz LHCBYRJHBYMUQN-SFHVURJKSA-N 1 1 346.471 3.758 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H]1CCN(c2ccc(F)cc2)C1=O ZINC001191278333 1134839802 /nfs/dbraw/zinc/83/98/02/1134839802.db2.gz RAKWWHHCOXNWGS-GOSISDBHSA-N 1 1 342.414 3.549 20 10 EHCDMO Oc1cccc(Cl)c1CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000793246891 1134887935 /nfs/dbraw/zinc/88/79/35/1134887935.db2.gz LSZLOEPWHOFZHF-CALCHBBNSA-N 1 1 342.870 3.609 20 10 EHCDMO CCn1ncnc1C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000793345553 1134902664 /nfs/dbraw/zinc/90/26/64/1134902664.db2.gz DYACOIQCDUMQDW-UHFFFAOYSA-N 1 1 344.503 3.888 20 10 EHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000793390815 1134922172 /nfs/dbraw/zinc/92/21/72/1134922172.db2.gz SIOZKRRIDRFYHK-OAQYLSRUSA-N 1 1 346.515 3.685 20 10 EHCDMO CC[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775499515 1134962172 /nfs/dbraw/zinc/96/21/72/1134962172.db2.gz IPGVJRBKNNDLKN-CYBMUJFWSA-N 1 1 328.243 3.945 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1O ZINC000806174470 1135398773 /nfs/dbraw/zinc/39/87/73/1135398773.db2.gz JGEGSBWIQRYWOD-MGPLVRAMSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](CO)c1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000806178532 1135411686 /nfs/dbraw/zinc/41/16/86/1135411686.db2.gz HHMDRQZKFLKROK-ZYHUDNBSSA-N 1 1 341.238 3.521 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCOC3(CCCC3)C2)c1O ZINC000775712832 1135555541 /nfs/dbraw/zinc/55/55/41/1135555541.db2.gz JWTMTOIDMWAVMY-UHFFFAOYSA-N 1 1 340.261 3.608 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCOC3(CCCC3)C2)c1O ZINC000775712832 1135555547 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EHCDMO [O-]c1c(Br)cccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000809728810 1135872436 /nfs/dbraw/zinc/87/24/36/1135872436.db2.gz IPEBJXMTRWZYSZ-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1ccc(F)cc1CN1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000809703732 1135875094 /nfs/dbraw/zinc/87/50/94/1135875094.db2.gz OZVFPCMHRGHNHR-NRFANRHFSA-N 1 1 340.442 3.629 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)Cc1ccc(N(C)C)c(F)c1 ZINC000809714509 1135876245 /nfs/dbraw/zinc/87/62/45/1135876245.db2.gz KKSIXQRXNZDYHC-UHFFFAOYSA-N 1 1 349.494 3.505 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCn2ccnc2C)cc1F ZINC000809753560 1135885512 /nfs/dbraw/zinc/88/55/12/1135885512.db2.gz WTDATZHVMDEZKU-UHFFFAOYSA-N 1 1 332.467 3.699 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](N(C)c3ccc(C)cc3)C2)c1O ZINC000809755761 1135886997 /nfs/dbraw/zinc/88/69/97/1135886997.db2.gz KPDFJMVFCHYHEH-IBGZPJMESA-N 1 1 340.467 3.810 20 10 EHCDMO C[C@@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1cc(F)cc(F)c1O ZINC000810253250 1135949239 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344.430 3.860 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]([S@@](C)=O)C1)c1cccc(C(F)(F)F)c1O ZINC000850500611 1136272831 /nfs/dbraw/zinc/27/28/31/1136272831.db2.gz FLKISIUHOQIPAP-JVTJSKFFSA-N 1 1 349.418 3.751 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1N1CCCC1)c1cc(F)cc(F)c1O ZINC000850502161 1136272912 /nfs/dbraw/zinc/27/29/12/1136272912.db2.gz SCOZLIXVCYDXFZ-GFCCVEGCSA-N 1 1 333.382 3.516 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cscn1 ZINC000850511781 1136273702 /nfs/dbraw/zinc/27/37/02/1136273702.db2.gz NAIKXGMZLUTFQF-CHWSQXEVSA-N 1 1 335.448 3.531 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)c1cccc(OC)c1 ZINC000850514029 1136274490 /nfs/dbraw/zinc/27/44/90/1136274490.db2.gz KSJUITLHZJHZRI-DIFFPNOSSA-N 1 1 337.366 3.717 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CCc3cc(F)cc(F)c3C1)CCC2 ZINC001170707286 1136336866 /nfs/dbraw/zinc/33/68/66/1136336866.db2.gz TTYYWCOYVDZHFK-MRXNPFEDSA-N 1 1 345.389 3.682 20 10 EHCDMO CCc1nc(C)c(C[NH2+]Cc2cc(C)cc(Br)c2O)o1 ZINC000813795683 1136363399 /nfs/dbraw/zinc/36/33/99/1136363399.db2.gz QUFKQLRXHYYSLN-UHFFFAOYSA-N 1 1 339.233 3.612 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nnc2n1CCCCC2 ZINC000852627110 1136471306 /nfs/dbraw/zinc/47/13/06/1136471306.db2.gz DESPRKBQYMXPMZ-QGZVFWFLSA-N 1 1 341.503 3.620 20 10 EHCDMO CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000111236079 1136524464 /nfs/dbraw/zinc/52/44/64/1136524464.db2.gz VYVLSFFJYYDDCA-OAHLLOKOSA-N 1 1 340.467 3.976 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)ccc1F)C[C@@H]1CCCO1 ZINC000111232909 1136524859 /nfs/dbraw/zinc/52/48/59/1136524859.db2.gz FOMBAZYDYTUGCQ-KRWDZBQOSA-N 1 1 333.378 3.852 20 10 EHCDMO Cc1cc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)ccc1N(C)C ZINC000815020318 1136538164 /nfs/dbraw/zinc/53/81/64/1136538164.db2.gz BEQXADUUANYZMD-UHFFFAOYSA-N 1 1 334.467 3.879 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)ccc1N(C)C ZINC000815020318 1136538167 /nfs/dbraw/zinc/53/81/67/1136538167.db2.gz BEQXADUUANYZMD-UHFFFAOYSA-N 1 1 334.467 3.879 20 10 EHCDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1N(C)C ZINC000815112541 1136550113 /nfs/dbraw/zinc/55/01/13/1136550113.db2.gz ULCZEQVJLFHVCQ-UHFFFAOYSA-N 1 1 327.428 3.644 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000815578629 1136613805 /nfs/dbraw/zinc/61/38/05/1136613805.db2.gz SHYYBDUALRUDIC-YPMHNXCESA-N 1 1 328.378 3.546 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000815578627 1136613821 /nfs/dbraw/zinc/61/38/21/1136613821.db2.gz SHYYBDUALRUDIC-DGCLKSJQSA-N 1 1 328.378 3.546 20 10 EHCDMO C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815587640 1136615619 /nfs/dbraw/zinc/61/56/19/1136615619.db2.gz PIPRCTGGEBMHGV-HNHYXYPQSA-N 1 1 337.341 3.720 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000815593131 1136615998 /nfs/dbraw/zinc/61/59/98/1136615998.db2.gz CMKKXNMBFVBWKY-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO CC(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816569897 1136738303 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/nfs/dbraw/zinc/13/80/18/1137138018.db2.gz KIAGABIIKPQJML-AWEZNQCLSA-N 1 1 347.256 3.614 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@H](C)NC(=O)OC(C)(C)C ZINC000824645190 1137145848 /nfs/dbraw/zinc/14/58/48/1137145848.db2.gz ZQENUHVHMWCOAA-ZJUUUORDSA-N 1 1 346.830 3.576 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c(O)c1 ZINC000862485145 1137146512 /nfs/dbraw/zinc/14/65/12/1137146512.db2.gz HXGADADCMIDJSX-RHSMWYFYSA-N 1 1 349.471 3.591 20 10 EHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3ccc(Br)cc3O)C2)cc1 ZINC000862540232 1137148892 /nfs/dbraw/zinc/14/88/92/1137148892.db2.gz BISRANLMUKIWRA-ZDUSSCGKSA-N 1 1 348.240 3.850 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821297 1137153739 /nfs/dbraw/zinc/15/37/39/1137153739.db2.gz XWDHQZHVWVDOCE-OAHLLOKOSA-N 1 1 342.395 3.689 20 10 EHCDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3cccc(OC)c3O)C2)c1 ZINC000825289880 1137171800 /nfs/dbraw/zinc/17/18/00/1137171800.db2.gz IDKNZWZVXFUMNS-QAQDUYKDSA-N 1 1 327.424 3.787 20 10 EHCDMO CC(=O)c1cc(F)cc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)c1O ZINC000844382245 1137218457 /nfs/dbraw/zinc/21/84/57/1137218457.db2.gz CUSIRYAMJVIGDR-UHFFFAOYSA-N 1 1 349.299 3.600 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001144293944 1137267714 /nfs/dbraw/zinc/26/77/14/1137267714.db2.gz WLARNXMJEBBDSA-MNOVXSKESA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001144293944 1137267715 /nfs/dbraw/zinc/26/77/15/1137267715.db2.gz WLARNXMJEBBDSA-MNOVXSKESA-N 1 1 328.225 3.916 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccnc1Br ZINC000865466048 1137286432 /nfs/dbraw/zinc/28/64/32/1137286432.db2.gz PMUIYKGVSZEEQD-UHFFFAOYSA-N 1 1 334.261 3.508 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1Br)c1ccc(N(C)C)cc1 ZINC000865531318 1137292336 /nfs/dbraw/zinc/29/23/36/1137292336.db2.gz HWPCXJUFQJKCHT-GFCCVEGCSA-N 1 1 334.261 3.761 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000846118174 1137333989 /nfs/dbraw/zinc/33/39/89/1137333989.db2.gz UYCQDTXXAZPYPK-ZDUSSCGKSA-N 1 1 332.188 3.694 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846054230 1137330931 /nfs/dbraw/zinc/33/09/31/1137330931.db2.gz IFHCBHJNTNZEQD-UHFFFAOYSA-N 1 1 332.188 3.776 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000846118174 1137333987 /nfs/dbraw/zinc/33/39/87/1137333987.db2.gz UYCQDTXXAZPYPK-ZDUSSCGKSA-N 1 1 332.188 3.694 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1ccc(F)cc1O ZINC000866423110 1137353727 /nfs/dbraw/zinc/35/37/27/1137353727.db2.gz NARHMBUZRZMMIJ-GOSISDBHSA-N 1 1 345.414 3.992 20 10 EHCDMO CCC[N@@H+](CC)CCNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C ZINC001148740742 1137432967 /nfs/dbraw/zinc/43/29/67/1137432967.db2.gz LBRZITJOZAIEOG-UHFFFAOYSA-N 1 1 341.499 3.864 20 10 EHCDMO CC(C)Nc1ccccc1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000871845517 1137560322 /nfs/dbraw/zinc/56/03/22/1137560322.db2.gz DAZBZVPGQXKSBD-UHFFFAOYSA-N 1 1 339.483 3.951 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c(O)c1 ZINC000876532110 1137654746 /nfs/dbraw/zinc/65/47/46/1137654746.db2.gz YCTCTKINNMLCPI-SFHVURJKSA-N 1 1 327.424 3.587 20 10 EHCDMO Cn1ncc2cc(C[N@@H+](Cc3ccccc3O)C3CCCC3)cnc21 ZINC000876722611 1137659778 /nfs/dbraw/zinc/65/97/78/1137659778.db2.gz ZYMPXGRIOCIDPL-UHFFFAOYSA-N 1 1 336.439 3.619 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876733017 1137659858 /nfs/dbraw/zinc/65/98/58/1137659858.db2.gz MEHRZHKIUMUBQC-PLMTUMEDSA-N 1 1 328.500 3.801 20 10 EHCDMO CCc1nc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)cs1 ZINC000877045430 1137668508 /nfs/dbraw/zinc/66/85/08/1137668508.db2.gz CMVGWWAICACDQS-AWEZNQCLSA-N 1 1 345.512 3.517 20 10 EHCDMO CCC1(CC)C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CCS1 ZINC000877380252 1137675140 /nfs/dbraw/zinc/67/51/40/1137675140.db2.gz ZDCPCVSPDNJPRB-UHFFFAOYSA-N 1 1 348.556 3.755 20 10 EHCDMO Cc1ccc2c(c1)CC[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC000877472562 1137677451 /nfs/dbraw/zinc/67/74/51/1137677451.db2.gz WOMGWIUDKKPMEL-UHFFFAOYSA-N 1 1 336.479 3.514 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](OCc3ccccn3)C2)c(Cl)c1 ZINC000877645844 1137684257 /nfs/dbraw/zinc/68/42/57/1137684257.db2.gz XWBUFDGWOUCVEB-OAHLLOKOSA-N 1 1 332.831 3.540 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC2(CCOCC2)O1 ZINC000877975601 1137698036 /nfs/dbraw/zinc/69/80/36/1137698036.db2.gz AMPCYHZDGSVEAF-FQEVSTJZSA-N 1 1 346.515 3.691 20 10 EHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCc2ncnn21 ZINC000878326729 1137711052 /nfs/dbraw/zinc/71/10/52/1137711052.db2.gz UYTIHOUNPTZQHV-VQIMIIECSA-N 1 1 348.450 3.734 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000882921264 1137838630 /nfs/dbraw/zinc/83/86/30/1137838630.db2.gz CAYFVIZDJBCQRB-IFXJQAMLSA-N 1 1 333.378 3.928 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(N2CCCC2=O)cc1 ZINC000882925115 1137838772 /nfs/dbraw/zinc/83/87/72/1137838772.db2.gz VWHLDLUOOAEEAE-GFCCVEGCSA-N 1 1 346.377 3.648 20 10 EHCDMO CCC[N@@H+](CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccccc1O ZINC000130721558 1137841340 /nfs/dbraw/zinc/84/13/40/1137841340.db2.gz VQAZUPIYRCRONA-KRWDZBQOSA-N 1 1 340.467 3.824 20 10 EHCDMO CC(C)(CO)[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883073707 1137843560 /nfs/dbraw/zinc/84/35/60/1137843560.db2.gz YHKGOMBUCDRATN-MRXNPFEDSA-N 1 1 335.394 3.562 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cc(Cl)cc2c1OCC2 ZINC000883087937 1137844297 /nfs/dbraw/zinc/84/42/97/1137844297.db2.gz NGOPZRZAXQWLJG-UHFFFAOYSA-N 1 1 325.742 3.549 20 10 EHCDMO COc1ccc(Cl)cc1NC(=O)CC[N@@H+](C)Cc1ccccc1O ZINC000109771416 1137897386 /nfs/dbraw/zinc/89/73/86/1137897386.db2.gz CBLQXXYWCCPWSZ-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886505358 1138085567 /nfs/dbraw/zinc/08/55/67/1138085567.db2.gz XRCNKYHXNTXLMB-UONOGXRCSA-N 1 1 344.430 3.910 20 10 EHCDMO CC(C)Oc1ccc([C@H](O)C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886527880 1138090419 /nfs/dbraw/zinc/09/04/19/1138090419.db2.gz BTQLQLAHPDXTNV-FZKQIMNGSA-N 1 1 333.403 3.703 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)cc1 ZINC000092706572 1138230603 /nfs/dbraw/zinc/23/06/03/1138230603.db2.gz CMGGILHNYFOBTR-IBGZPJMESA-N 1 1 345.531 3.517 20 10 EHCDMO Cc1cccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1O ZINC000183512952 1140043952 /nfs/dbraw/zinc/04/39/52/1140043952.db2.gz IXFXKYZRRWBIPG-SFHVURJKSA-N 1 1 327.424 3.587 20 10 EHCDMO C[C@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc(F)cc1O ZINC000185054357 1140133860 /nfs/dbraw/zinc/13/38/60/1140133860.db2.gz WCDAQAAWZATMMJ-AWEZNQCLSA-N 1 1 329.419 3.767 20 10 EHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)cc2[O-])C1 ZINC000185112675 1140136468 /nfs/dbraw/zinc/13/64/68/1140136468.db2.gz PDWLMVLGEMBVLT-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1O ZINC000185604431 1140158259 /nfs/dbraw/zinc/15/82/59/1140158259.db2.gz DIXCCIHUWOCBSI-QMMMGPOBSA-N 1 1 334.338 3.900 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(N(C)C)nc2ccccc12)c1ccc(F)cc1O ZINC000185613623 1140158691 /nfs/dbraw/zinc/15/86/91/1140158691.db2.gz BUUOKORFGVPUJN-CYBMUJFWSA-N 1 1 339.414 3.996 20 10 EHCDMO C[C@@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc(F)cc1O ZINC000185661512 1140161377 /nfs/dbraw/zinc/16/13/77/1140161377.db2.gz BETIAMHYCNXIKK-OAHLLOKOSA-N 1 1 339.414 3.821 20 10 EHCDMO C[C@@H]([NH2+]CCCC(=O)N1Cc2ccccc2C1)c1ccc(F)cc1O ZINC000186020552 1140182543 /nfs/dbraw/zinc/18/25/43/1140182543.db2.gz MFPDRWLFMNDIPY-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO COCCCOc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000186154425 1140189626 /nfs/dbraw/zinc/18/96/26/1140189626.db2.gz SHIBWSZEMCAPIB-CQSZACIVSA-N 1 1 333.403 3.797 20 10 EHCDMO COc1ccccc1-c1noc([C@H](C)[NH2+]Cc2cc(C)ccc2O)n1 ZINC000266172470 1140651445 /nfs/dbraw/zinc/65/14/45/1140651445.db2.gz RVJDWGYXOGRBFQ-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO CCc1ncc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)s1 ZINC000271033318 1141297758 /nfs/dbraw/zinc/29/77/58/1141297758.db2.gz ZQYMWMCZKBOHTD-OAHLLOKOSA-N 1 1 332.469 3.592 20 10 EHCDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000271225211 1141328777 /nfs/dbraw/zinc/32/87/77/1141328777.db2.gz QNUCHOPFKYYBGP-LFPIHBKWSA-N 1 1 348.487 3.822 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc1 ZINC000160167316 1014177900 /nfs/dbraw/zinc/17/79/00/1014177900.db2.gz XVWGPPAZCWFQGT-HXUWFJFHSA-N 1 1 340.467 3.639 20 10 EHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2O)C1 ZINC000160319632 1017932171 /nfs/dbraw/zinc/93/21/71/1017932171.db2.gz QVZDYTKBRHVXJC-KBPBESRZSA-N 1 1 325.474 3.515 20 10 EHCDMO Cc1c(F)cccc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001204512440 1018268579 /nfs/dbraw/zinc/26/85/79/1018268579.db2.gz IHXYKJQWNSOFKP-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1OC ZINC000276230961 1020947867 /nfs/dbraw/zinc/94/78/67/1020947867.db2.gz RUBVFQJQPNXVJI-AWEZNQCLSA-N 1 1 333.350 3.572 20 10 EHCDMO C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(N(C)C)cc1 ZINC001167970958 1022385715 /nfs/dbraw/zinc/38/57/15/1022385715.db2.gz QRKBLWVIHOTMQT-SRBWVJFJSA-N 1 1 327.516 3.809 20 10 EHCDMO C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(N(C)C)cc1 ZINC001167970958 1022385730 /nfs/dbraw/zinc/38/57/30/1022385730.db2.gz QRKBLWVIHOTMQT-SRBWVJFJSA-N 1 1 327.516 3.809 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H](C)c2nnc(C)[nH]2)cc1 ZINC000894771578 1022868689 /nfs/dbraw/zinc/86/86/89/1022868689.db2.gz NXYSOIFLHCSDCD-MRXNPFEDSA-N 1 1 349.482 3.990 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c(O)c1OC ZINC000891995931 1024265620 /nfs/dbraw/zinc/26/56/20/1024265620.db2.gz OWVQKDYOOXXODW-ZDUSSCGKSA-N 1 1 331.387 3.538 20 10 EHCDMO CCC1([NH+]2CCC2)CCN(Cc2cc(Cl)cc(F)c2O)CC1 ZINC000895827055 1024863348 /nfs/dbraw/zinc/86/33/48/1024863348.db2.gz BTWVJYPUYAHERQ-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO CSCC1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000896937625 1026113587 /nfs/dbraw/zinc/11/35/87/1026113587.db2.gz XHNPQCYQWACTOG-UHFFFAOYSA-N 1 1 330.291 3.730 20 10 EHCDMO COC(=O)Nc1ccc(CC[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000273350659 1027389853 /nfs/dbraw/zinc/38/98/53/1027389853.db2.gz BQAVHVAITJAXHW-GFCCVEGCSA-N 1 1 332.375 3.603 20 10 EHCDMO COc1cc(Cl)cc(C[NH2+]Cc2csc([C@H](C)OC)n2)c1O ZINC000273769949 1027611342 /nfs/dbraw/zinc/61/13/42/1027611342.db2.gz QNJWWWVEQINPAN-VIFPVBQESA-N 1 1 342.848 3.508 20 10 EHCDMO COc1cc(O)c(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1OC ZINC000160382373 1030720751 /nfs/dbraw/zinc/72/07/51/1030720751.db2.gz KSDJSEYKRJRYJA-UHFFFAOYSA-N 1 1 333.350 3.574 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC000904354016 1031973146 /nfs/dbraw/zinc/97/31/46/1031973146.db2.gz UFZWHEFTCBFUQD-QGZVFWFLSA-N 1 1 337.389 3.619 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](c1cccc(OC)c1)N(C)C)c1ccc(F)cc1O ZINC000796663769 1033882036 /nfs/dbraw/zinc/88/20/36/1033882036.db2.gz PTAIOAXWSZTKDB-MOPGFXCFSA-N 1 1 346.446 3.884 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc2c(cc1OC)OCO2 ZINC000761194743 1034377796 /nfs/dbraw/zinc/37/77/96/1034377796.db2.gz HETMCIUHNUBPNP-UHFFFAOYSA-N 1 1 329.396 3.542 20 10 EHCDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000171936783 1034723748 /nfs/dbraw/zinc/72/37/48/1034723748.db2.gz PZTYOBQTNSTCTN-CYBMUJFWSA-N 1 1 332.831 3.813 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3sccc32)c1 ZINC000274400023 1038524886 /nfs/dbraw/zinc/52/48/86/1038524886.db2.gz QBFFMPPDPLQCEC-ABAIWWIYSA-N 1 1 331.437 3.969 20 10 EHCDMO CCOc1ccc(N2CC[NH+](Cc3cccc(F)c3OC)CC2)cc1 ZINC001143533606 1039690568 /nfs/dbraw/zinc/69/05/68/1039690568.db2.gz IVOMHMFAJADFLT-UHFFFAOYSA-N 1 1 344.430 3.555 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)Cc2cccc(O)c2)c1 ZINC000781901358 1040364872 /nfs/dbraw/zinc/36/48/72/1040364872.db2.gz QYKKRCDVNYVGRU-UHFFFAOYSA-N 1 1 336.229 3.801 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)Cc2cccc(O)c2)c1 ZINC000781901358 1040364890 /nfs/dbraw/zinc/36/48/90/1040364890.db2.gz QYKKRCDVNYVGRU-UHFFFAOYSA-N 1 1 336.229 3.801 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000247371521 1040571547 /nfs/dbraw/zinc/57/15/47/1040571547.db2.gz KWASGUNPRFAHHO-FOIQADDNSA-N 1 1 339.483 3.506 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(F)cc1O ZINC000310090608 1041307820 /nfs/dbraw/zinc/30/78/20/1041307820.db2.gz QSYCTGNHKPXGET-KHYOSLBOSA-N 1 1 328.431 3.845 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cccc(N2CCOC2=O)c1)c1ccc(F)cc1O ZINC000796701579 1041931482 /nfs/dbraw/zinc/93/14/82/1041931482.db2.gz HHXHUMHRHGTHNJ-QGZVFWFLSA-N 1 1 344.386 3.729 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](O)COc1c(C)cccc1C)c1ccc(F)cc1O ZINC000796702960 1042511760 /nfs/dbraw/zinc/51/17/60/1042511760.db2.gz FLJUGRWCFSXYIX-FUHWJXTLSA-N 1 1 347.430 3.629 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000278949234 1043076094 /nfs/dbraw/zinc/07/60/94/1043076094.db2.gz ZGEWCNWERQJSLL-CQSZACIVSA-N 1 1 348.786 3.740 20 10 EHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)N1CCc2sccc2C1 ZINC000185174184 1126803106 /nfs/dbraw/zinc/80/31/06/1126803106.db2.gz SNYXDVJVPDYDNS-CHWSQXEVSA-N 1 1 334.460 3.690 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)c(F)c1)C[C@H]1CCCO1 ZINC000072952791 1126949327 /nfs/dbraw/zinc/94/93/27/1126949327.db2.gz BLTSAKSFPPFUCV-MRXNPFEDSA-N 1 1 333.378 3.852 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCOC2(CCC2)C1)CCCC3 ZINC000765725646 1127744456 /nfs/dbraw/zinc/74/44/56/1127744456.db2.gz RTCNPGHAMFLUEP-UHFFFAOYSA-N 1 1 327.424 3.772 20 10 EHCDMO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2cc(F)c(N(C)C)cc2F)C1 ZINC001648921054 1120200084 /nfs/dbraw/zinc/20/00/84/1120200084.db2.gz NZKSYUOUNCORMO-CQSZACIVSA-N 1 1 339.474 3.631 20 10 EHCDMO C[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001648921054 1120200087 /nfs/dbraw/zinc/20/00/87/1120200087.db2.gz NZKSYUOUNCORMO-CQSZACIVSA-N 1 1 339.474 3.631 20 10 EHCDMO C[C@H]1CCCC[C@@H]1OCC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000915360689 1121358783 /nfs/dbraw/zinc/35/87/83/1121358783.db2.gz JXAKUIXKYPFVON-RXVVDRJESA-N 1 1 346.515 3.550 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N1[C@H](C)CCC[C@@H]1C)Cc1ccc(N(C)C)cc1 ZINC000917074906 1122472341 /nfs/dbraw/zinc/47/23/41/1122472341.db2.gz KTWRXBIWBRQKAB-HDICACEKSA-N 1 1 345.531 3.753 20 10 EHCDMO CC(C)(C)c1cccc(C[N@H+]2CCCC[C@@](O)(C(F)(F)F)C2)c1O ZINC001143103597 1129059627 /nfs/dbraw/zinc/05/96/27/1129059627.db2.gz GLIHDQCZSMQTOG-KRWDZBQOSA-N 1 1 345.405 3.969 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H](C)c2cn(C)nn2)cc1 ZINC000922636266 1129609451 /nfs/dbraw/zinc/60/94/51/1129609451.db2.gz KFEXYWLXAQHVLK-KRWDZBQOSA-N 1 1 349.482 3.692 20 10 EHCDMO CCC[N@@H+](CC(=O)N[C@H](C)c1cccs1)Cc1ccccc1O ZINC000727831409 1130597498 /nfs/dbraw/zinc/59/74/98/1130597498.db2.gz ZOZGHXXSPPACJR-CQSZACIVSA-N 1 1 332.469 3.543 20 10 EHCDMO C[C@@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000732187499 1130892798 /nfs/dbraw/zinc/89/27/98/1130892798.db2.gz NZZAPCCIWYXJJQ-QGZVFWFLSA-N 1 1 336.479 3.587 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)CCC2 ZINC000732187499 1130892807 /nfs/dbraw/zinc/89/28/07/1130892807.db2.gz NZZAPCCIWYXJJQ-QGZVFWFLSA-N 1 1 336.479 3.587 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)CCC2 ZINC000732187499 1130892812 /nfs/dbraw/zinc/89/28/12/1130892812.db2.gz NZZAPCCIWYXJJQ-QGZVFWFLSA-N 1 1 336.479 3.587 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1)OCO2 ZINC000732980077 1130978731 /nfs/dbraw/zinc/97/87/31/1130978731.db2.gz GUTPKGMIFGZNNY-OAHLLOKOSA-N 1 1 333.334 3.736 20 10 EHCDMO C[C@H](NCC[N@@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766275600 1131634642 /nfs/dbraw/zinc/63/46/42/1131634642.db2.gz XMLBZTQBZOOZNK-SJORKVTESA-N 1 1 333.495 3.951 20 10 EHCDMO C[C@H](NCC[N@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766275600 1131634645 /nfs/dbraw/zinc/63/46/45/1131634645.db2.gz XMLBZTQBZOOZNK-SJORKVTESA-N 1 1 333.495 3.951 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)c(C(=O)OC)cc3ccccc32)CCS1 ZINC000743397605 1131912233 /nfs/dbraw/zinc/91/22/33/1131912233.db2.gz OOTPNOSSWLOMOK-CQSZACIVSA-N 1 1 345.464 3.659 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+](C1CCC3(CCOCC3)CC1)CCC2 ZINC001173050558 1131942871 /nfs/dbraw/zinc/94/28/71/1131942871.db2.gz AHERDZZAPAQTBV-UHFFFAOYSA-N 1 1 331.456 3.585 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)COc1cc(C)cc(C)c1 ZINC000743870282 1131995343 /nfs/dbraw/zinc/99/53/43/1131995343.db2.gz OPANZTBZUDXLQD-IBGZPJMESA-N 1 1 343.467 3.661 20 10 EHCDMO CCOC(=O)C[C@@H]1CC[C@H]([N@@H+](CC)Cc2ccc(N(C)C)cc2)C1 ZINC001173660093 1132114247 /nfs/dbraw/zinc/11/42/47/1132114247.db2.gz HUGWFYQRRSEUAE-MJGOQNOKSA-N 1 1 332.488 3.696 20 10 EHCDMO C[C@@]1(C[NH2+]Cc2cc(F)ccc2O)CCN(Cc2ccccc2)C1 ZINC000379772889 1132518722 /nfs/dbraw/zinc/51/87/22/1132518722.db2.gz RXBVFVULUJZELO-FQEVSTJZSA-N 1 1 328.431 3.533 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C(=O)OC)c1ccccc1C ZINC000767323933 1132985016 /nfs/dbraw/zinc/98/50/16/1132985016.db2.gz MPBGHDYWXVCWSC-LJQANCHMSA-N 1 1 327.424 3.827 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)OC)c1ccccc1C ZINC000767323933 1132985020 /nfs/dbraw/zinc/98/50/20/1132985020.db2.gz MPBGHDYWXVCWSC-LJQANCHMSA-N 1 1 327.424 3.827 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc2c(c(OC)c1)OCO2 ZINC000768132781 1133100267 /nfs/dbraw/zinc/10/02/67/1133100267.db2.gz LLFIXCTVBIGYRX-UHFFFAOYSA-N 1 1 342.439 3.512 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(OCCOC)c1 ZINC000768134081 1133101031 /nfs/dbraw/zinc/10/10/31/1133101031.db2.gz PBSIBRVQHYQUHX-UHFFFAOYSA-N 1 1 342.483 3.800 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000768351073 1133128111 /nfs/dbraw/zinc/12/81/11/1133128111.db2.gz GCJJUNXAIKBWPJ-UHFFFAOYSA-N 1 1 343.427 3.777 20 10 EHCDMO CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000768351073 1133128112 /nfs/dbraw/zinc/12/81/12/1133128112.db2.gz GCJJUNXAIKBWPJ-UHFFFAOYSA-N 1 1 343.427 3.777 20 10 EHCDMO c1ccc(C[C@H]2CC[N@@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000768365150 1133130253 /nfs/dbraw/zinc/13/02/53/1133130253.db2.gz QBTNEWCMMHBQRG-OAQYLSRUSA-N 1 1 336.479 3.588 20 10 EHCDMO CC(C)C[N@H+](Cc1ccccc1F)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768440610 1133138814 /nfs/dbraw/zinc/13/88/14/1133138814.db2.gz RHQHPFMWDDRUFB-LJQANCHMSA-N 1 1 345.414 3.615 20 10 EHCDMO COc1cc(O)c(C[N@@H+](Cc2ccccc2C)C2CC2)cc1OC ZINC000768439376 1133139092 /nfs/dbraw/zinc/13/90/92/1133139092.db2.gz GOXGCAXVYFEVRO-UHFFFAOYSA-N 1 1 327.424 3.882 20 10 EHCDMO CCC[N@@H+](Cc1cc(OC)c(C)cc1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000768446789 1133140638 /nfs/dbraw/zinc/14/06/38/1133140638.db2.gz OSIKVTCVFKDTQG-ATZDWAIDSA-N 1 1 333.472 3.735 20 10 EHCDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c(O)cc1C ZINC000768465293 1133144444 /nfs/dbraw/zinc/14/44/44/1133144444.db2.gz FRRHYRIICPYGLS-HRAATJIYSA-N 1 1 341.451 3.980 20 10 EHCDMO Cc1nn2c(C[N@@H+](C)Cc3ccccc3O)c(C(C)C)nc2s1 ZINC000768872858 1133194305 /nfs/dbraw/zinc/19/43/05/1133194305.db2.gz KYJRRXDUTWYEPO-UHFFFAOYSA-N 1 1 330.457 3.560 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)c(O)c1 ZINC000769108036 1133228043 /nfs/dbraw/zinc/22/80/43/1133228043.db2.gz XFFFAPGMGODFRG-QRWLVFNGSA-N 1 1 327.424 3.753 20 10 EHCDMO COc1cccc(O)c1C[N@H+](Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000769191962 1133234031 /nfs/dbraw/zinc/23/40/31/1133234031.db2.gz NFKUIKBSMXWIGF-KRWDZBQOSA-N 1 1 345.414 3.721 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c1 ZINC000769238698 1133248899 /nfs/dbraw/zinc/24/88/99/1133248899.db2.gz GRNIISQHOBDQEM-PZJWPPBQSA-N 1 1 341.451 3.879 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)Cc2ccccc2OC)c(O)c1 ZINC000769326916 1133262164 /nfs/dbraw/zinc/26/21/64/1133262164.db2.gz QVXNRZMKIANVPA-OAHLLOKOSA-N 1 1 329.440 3.863 20 10 EHCDMO c1cc2c(s1)CCC[N@H+](Cc1ccc(N3CCOCC3)cc1)C2 ZINC000769382942 1133273146 /nfs/dbraw/zinc/27/31/46/1133273146.db2.gz ZFLLMAOELVIJQI-UHFFFAOYSA-N 1 1 328.481 3.533 20 10 EHCDMO COC(=O)CC[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000769403970 1133278148 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COC[C@@H](C)C[N@@H+](C)Cc1cc(C)n(-c2ccc(OC)cc2)c1C ZINC001179920500 1133308046 /nfs/dbraw/zinc/30/80/46/1133308046.db2.gz SYTGQLUWERSJSH-HNNXBMFYSA-N 1 1 330.472 3.817 20 10 EHCDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cc3c(cc2O)OCO3)o1 ZINC000769549997 1133313508 /nfs/dbraw/zinc/31/35/08/1133313508.db2.gz QKZKJEVTUVSPIR-WFASDCNBSA-N 1 1 329.396 3.996 20 10 EHCDMO C[N@H+](CCOc1ccccc1F)Cc1cc(Cl)c(F)cc1O ZINC001180444298 1133370999 /nfs/dbraw/zinc/37/09/99/1133370999.db2.gz CTMLVANVAHDFMF-UHFFFAOYSA-N 1 1 327.758 3.835 20 10 EHCDMO C[N@@H+](CCOc1ccccc1F)Cc1cc(Cl)c(F)cc1O ZINC001180444298 1133371004 /nfs/dbraw/zinc/37/10/04/1133371004.db2.gz CTMLVANVAHDFMF-UHFFFAOYSA-N 1 1 327.758 3.835 20 10 EHCDMO CCOc1ccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c(O)c1 ZINC000770303649 1133408490 /nfs/dbraw/zinc/40/84/90/1133408490.db2.gz KLFLGAWKKJOGLS-LJQANCHMSA-N 1 1 341.451 3.625 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)cc1C ZINC000770381849 1133416609 /nfs/dbraw/zinc/41/66/09/1133416609.db2.gz SJQUQYAZEHOCIE-WBVHZDCISA-N 1 1 348.487 3.887 20 10 EHCDMO CS[C@@H]1CCCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000770346959 1133418802 /nfs/dbraw/zinc/41/88/02/1133418802.db2.gz FSZUKYIHKTVTBP-CYBMUJFWSA-N 1 1 330.291 3.872 20 10 EHCDMO CCN(CC)c1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1F ZINC000770351779 1133419796 /nfs/dbraw/zinc/41/97/96/1133419796.db2.gz KUTRXEMFLISYBD-IEBWSBKVSA-N 1 1 333.495 3.588 20 10 EHCDMO COC1(C[N@@H+](Cc2ccco2)Cc2ccc(N(C)C)cc2)CCC1 ZINC001181564557 1133503791 /nfs/dbraw/zinc/50/37/91/1133503791.db2.gz NADYODIULHTTQL-UHFFFAOYSA-N 1 1 328.456 3.917 20 10 EHCDMO Fc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)ccc1N1CCOCC1 ZINC000771940819 1133618166 /nfs/dbraw/zinc/61/81/66/1133618166.db2.gz WUKQCGXMDMABEZ-LJQANCHMSA-N 1 1 326.415 3.609 20 10 EHCDMO COCCOCCCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774158120 1133625707 /nfs/dbraw/zinc/62/57/07/1133625707.db2.gz QJDYFRZIBVPQRM-NSHDSACASA-N 1 1 336.259 3.793 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1cc(Cl)c(Cl)cc1O ZINC000774233753 1133637803 /nfs/dbraw/zinc/63/78/03/1133637803.db2.gz SFOZWYOHVPDCJW-MNOVXSKESA-N 1 1 344.238 3.794 20 10 EHCDMO C[C@@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]Cc1cccc(F)c1O ZINC001182335200 1133641768 /nfs/dbraw/zinc/64/17/68/1133641768.db2.gz UKOCMQXVNPLKGA-LBPRGKRZSA-N 1 1 330.378 3.883 20 10 EHCDMO CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC001182892530 1133744987 /nfs/dbraw/zinc/74/49/87/1133744987.db2.gz VSQOISQNRIEKJN-INIZCTEOSA-N 1 1 344.411 3.810 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccccc2F)CC2CC2)c(O)c1OC ZINC001182950914 1133750973 /nfs/dbraw/zinc/75/09/73/1133750973.db2.gz XDBNZVJKIHFBQA-UHFFFAOYSA-N 1 1 345.414 3.961 20 10 EHCDMO C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC001183046366 1133759942 /nfs/dbraw/zinc/75/99/42/1133759942.db2.gz WRYGGORJBIXAID-SNVBAGLBSA-N 1 1 346.830 3.530 20 10 EHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@H](C2CCOCC2)C1 ZINC001183510391 1133820935 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EHCDMO COc1cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c(O)cc1C ZINC000789482996 1134281677 /nfs/dbraw/zinc/28/16/77/1134281677.db2.gz STMYUXJIJGTXML-LSDHHAIUSA-N 1 1 330.255 3.725 20 10 EHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2cccc(N3CCOC3=O)c2)c1O ZINC000789767224 1134329630 /nfs/dbraw/zinc/32/96/30/1134329630.db2.gz FWTNCGPCZUQSIA-HNNXBMFYSA-N 1 1 340.423 3.850 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)Cc2ccccc2C)cc1OC ZINC000775203796 1134512019 /nfs/dbraw/zinc/51/20/19/1134512019.db2.gz HXRXRUICMFQCOI-OAHLLOKOSA-N 1 1 329.440 3.781 20 10 EHCDMO COC1(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCCCC1 ZINC000792157336 1134659173 /nfs/dbraw/zinc/65/91/73/1134659173.db2.gz UQWPDNKIFNMWFD-SFHVURJKSA-N 1 1 333.472 3.723 20 10 EHCDMO CN(C)c1ccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001190827884 1134755483 /nfs/dbraw/zinc/75/54/83/1134755483.db2.gz QHGPMIJZFGMHTH-HXUWFJFHSA-N 1 1 329.532 3.841 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCCCC[C@@H]2CCO)c1O ZINC000793609587 1134971119 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[O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000775739181 1135597492 /nfs/dbraw/zinc/59/74/92/1135597492.db2.gz MJXJLNZTSKVEAU-PXAZEXFGSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000775739181 1135597497 /nfs/dbraw/zinc/59/74/97/1135597497.db2.gz MJXJLNZTSKVEAU-PXAZEXFGSA-N 1 1 338.854 3.633 20 10 EHCDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000747465818 1135630887 /nfs/dbraw/zinc/63/08/87/1135630887.db2.gz BFFWHIAUNOHHPT-HOCLYGCPSA-N 1 1 325.408 3.574 20 10 EHCDMO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000809700837 1135869890 /nfs/dbraw/zinc/86/98/90/1135869890.db2.gz PEQMJWJARBJPCG-TZMCWYRMSA-N 1 1 342.277 3.670 20 10 EHCDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cccc(Br)c1O ZINC000809700837 1135869892 /nfs/dbraw/zinc/86/98/92/1135869892.db2.gz PEQMJWJARBJPCG-TZMCWYRMSA-N 1 1 342.277 3.670 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)cc1 ZINC000809705336 1135875248 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CCOCc1cc(C[NH2+]Cc2c(OC)cccc2OC)ccc1OC ZINC000850356029 1136240225 /nfs/dbraw/zinc/24/02/25/1136240225.db2.gz QCVFNAKHKOEIOI-UHFFFAOYSA-N 1 1 345.439 3.539 20 10 EHCDMO OC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(Cl)c1Cl ZINC000850402395 1136250316 /nfs/dbraw/zinc/25/03/16/1136250316.db2.gz IYZCUKIRBAAJBK-HNNXBMFYSA-N 1 1 338.234 3.752 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1)c1ccc(F)cc1O ZINC000850540197 1136282039 /nfs/dbraw/zinc/28/20/39/1136282039.db2.gz JFERPJLRHZGBCG-JCGIZDLHSA-N 1 1 331.435 3.717 20 10 EHCDMO Cc1cc(C[NH2+][C@H](C(N)=O)c2ccccc2)c(C)n1-c1cccc(C)c1 ZINC000747855082 1136335033 /nfs/dbraw/zinc/33/50/33/1136335033.db2.gz ZROACFCNXAXHHI-NRFANRHFSA-N 1 1 347.462 3.719 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccccc1O ZINC000109772494 1136340080 /nfs/dbraw/zinc/34/00/80/1136340080.db2.gz AVUKDPRRUIVGCJ-UHFFFAOYSA-N 1 1 326.440 3.760 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccccc1O ZINC000109772494 1136340082 /nfs/dbraw/zinc/34/00/82/1136340082.db2.gz AVUKDPRRUIVGCJ-UHFFFAOYSA-N 1 1 326.440 3.760 20 10 EHCDMO C[C@@H](Nc1[nH+]ccc2c(N)cccc21)c1ccc(N2CCOCC2)cc1 ZINC000853232847 1136520452 /nfs/dbraw/zinc/52/04/52/1136520452.db2.gz IQSKGVZNGPBYMG-OAHLLOKOSA-N 1 1 348.450 3.827 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815075598 1136548017 /nfs/dbraw/zinc/54/80/17/1136548017.db2.gz CCBCYQZCYJAOJE-KRWDZBQOSA-N 1 1 332.488 3.616 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2[C@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)cc1 ZINC000815120088 1136552213 /nfs/dbraw/zinc/55/22/13/1136552213.db2.gz AFZRWYIAJUYVKA-CALCHBBNSA-N 1 1 345.531 3.610 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2[C@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)cc1 ZINC000815120088 1136552217 /nfs/dbraw/zinc/55/22/17/1136552217.db2.gz AFZRWYIAJUYVKA-CALCHBBNSA-N 1 1 345.531 3.610 20 10 EHCDMO OC1CCN(c2ccc(CNc3cc[nH+]c4ccsc43)cc2)CC1 ZINC000853955390 1136576909 /nfs/dbraw/zinc/57/69/09/1136576909.db2.gz MVCKCZUFBDOITG-UHFFFAOYSA-N 1 1 339.464 3.870 20 10 EHCDMO Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000815575826 1136613213 /nfs/dbraw/zinc/61/32/13/1136613213.db2.gz BJQGUZRUUKKTIT-NEPJUHHUSA-N 1 1 341.377 3.903 20 10 EHCDMO CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815632249 1136622074 /nfs/dbraw/zinc/62/20/74/1136622074.db2.gz HXTFAUFLQGIJAS-RYUDHWBXSA-N 1 1 346.393 3.614 20 10 EHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816531694 1136730788 /nfs/dbraw/zinc/73/07/88/1136730788.db2.gz AJNSJRSVYJSSFS-SNVBAGLBSA-N 1 1 336.794 3.994 20 10 EHCDMO COc1ccccc1O[C@@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554722 1136735866 /nfs/dbraw/zinc/73/58/66/1136735866.db2.gz HGRMANPVILPXEU-NSHDSACASA-N 1 1 339.794 3.750 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC1([C@H](O)c2ccccc2)CC1 ZINC000816558374 1136736779 /nfs/dbraw/zinc/73/67/79/1136736779.db2.gz WCCQMWHOWBEIBL-QGZVFWFLSA-N 1 1 335.806 3.788 20 10 EHCDMO CCCNC(=O)C1([NH2+]Cc2cc(Cl)c(F)cc2O)CCCCC1 ZINC000816569600 1136738291 /nfs/dbraw/zinc/73/82/91/1136738291.db2.gz QPVBUACJXVLWMX-UHFFFAOYSA-N 1 1 342.842 3.503 20 10 EHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1ccc(C)c(F)c1 ZINC000776858798 1136748230 /nfs/dbraw/zinc/74/82/30/1136748230.db2.gz IHRMHXFOGOVXBW-UHFFFAOYSA-N 1 1 325.387 3.929 20 10 EHCDMO C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1[O-] ZINC000817585237 1136825369 /nfs/dbraw/zinc/82/53/69/1136825369.db2.gz DETSRCCQIDVBOA-XGNXJENSSA-N 1 1 341.293 3.678 20 10 EHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC)c1 ZINC000817940333 1136848637 /nfs/dbraw/zinc/84/86/37/1136848637.db2.gz GBMQCRLKTKPFTK-PMACEKPBSA-N 1 1 327.472 3.502 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817942258 1136849491 /nfs/dbraw/zinc/84/94/91/1136849491.db2.gz NPJXQQZFTKFAJF-IIBYNOLFSA-N 1 1 340.515 3.559 20 10 EHCDMO COc1cc(C)c([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817943932 1136849713 /nfs/dbraw/zinc/84/97/13/1136849713.db2.gz WUGPAYDAMHZDML-OXJNMPFZSA-N 1 1 341.499 3.729 20 10 EHCDMO C[C@@H](N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[C@H]1CCC[NH2+]C1 ZINC000817948335 1136850162 /nfs/dbraw/zinc/85/01/62/1136850162.db2.gz XZAYDBWPZQTPQV-JZXOWHBKSA-N 1 1 333.495 3.855 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490948 1136973011 /nfs/dbraw/zinc/97/30/11/1136973011.db2.gz SYZKACALRYLDEN-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490948 1136973013 /nfs/dbraw/zinc/97/30/13/1136973013.db2.gz SYZKACALRYLDEN-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO Cc1csc(C(C)(C)[NH2+]Cc2cccc(Br)c2O)n1 ZINC000116382823 1136994507 /nfs/dbraw/zinc/99/45/07/1136994507.db2.gz KBYUYXJWRPACJL-UHFFFAOYSA-N 1 1 341.274 3.945 20 10 EHCDMO C[C@H]1C[C@H](C[N@@H+](C)Cc2ccccc2O)CCN1C(=O)OC(C)(C)C ZINC000823409139 1137098852 /nfs/dbraw/zinc/09/88/52/1137098852.db2.gz VMCZVMVFONNZHT-JKSUJKDBSA-N 1 1 348.487 3.860 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000862331148 1137138259 /nfs/dbraw/zinc/13/82/59/1137138259.db2.gz GUPVOZHKLCAQGM-CYBMUJFWSA-N 1 1 340.261 3.546 20 10 EHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862332248 1137138327 /nfs/dbraw/zinc/13/83/27/1137138327.db2.gz ILVJQYPAYCXJQW-ZDUSSCGKSA-N 1 1 342.277 3.793 20 10 EHCDMO CC[C@@H](COCC(F)(F)F)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824554127 1137142698 /nfs/dbraw/zinc/14/26/98/1137142698.db2.gz BDWOZWYOCNMHIX-QMMMGPOBSA-N 1 1 329.721 3.632 20 10 EHCDMO CC(=O)Nc1cccc2c1CC[N@@H+](Cc1cc(Cl)c(C)cc1O)C2 ZINC000824605316 1137144722 /nfs/dbraw/zinc/14/47/22/1137144722.db2.gz HTEUMKYEJWDUJC-UHFFFAOYSA-N 1 1 344.842 3.871 20 10 EHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)cc1F ZINC000862540328 1137148692 /nfs/dbraw/zinc/14/86/92/1137148692.db2.gz CLMTYXCFOLDNNP-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824695770 1137148797 /nfs/dbraw/zinc/14/87/97/1137148797.db2.gz CMKOYSFRCFEWPG-APHBMKBZSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824695770 1137148799 /nfs/dbraw/zinc/14/87/99/1137148799.db2.gz CMKOYSFRCFEWPG-APHBMKBZSA-N 1 1 327.827 3.700 20 10 EHCDMO COc1c(O)c(C[NH2+]CC2(C(F)(F)F)CCCC2)ccc1[N+](=O)[O-] ZINC000862536913 1137149010 /nfs/dbraw/zinc/14/90/10/1137149010.db2.gz YMRBYGMNEMUYJB-UHFFFAOYSA-N 1 1 348.321 3.521 20 10 EHCDMO C[C@]1(C[NH2+]Cc2cccc(Br)c2O)CC1(Cl)Cl ZINC000824766277 1137150830 /nfs/dbraw/zinc/15/08/30/1137150830.db2.gz SYVCUNFRFMUQMX-LLVKDONJSA-N 1 1 339.060 3.828 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1O ZINC000824820272 1137153992 /nfs/dbraw/zinc/15/39/92/1137153992.db2.gz COLZKOZHKGCFIB-HNNXBMFYSA-N 1 1 342.395 3.689 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000824952460 1137159272 /nfs/dbraw/zinc/15/92/72/1137159272.db2.gz AVJCACDRFZJKHG-LRDDRELGSA-N 1 1 336.794 3.590 20 10 EHCDMO CC1(C)CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC[S@@]1=O ZINC000825023656 1137162293 /nfs/dbraw/zinc/16/22/93/1137162293.db2.gz FZQODFRAXFBAQC-DEOSSOPVSA-N 1 1 343.492 3.792 20 10 EHCDMO Cc1cc([O-])c(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000825125014 1137166411 /nfs/dbraw/zinc/16/64/11/1137166411.db2.gz CNBYWKFRGMFGOO-UHFFFAOYSA-N 1 1 348.874 3.584 20 10 EHCDMO CC(C)OCCOC1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000825208152 1137168944 /nfs/dbraw/zinc/16/89/44/1137168944.db2.gz RXOZRKCSHHROBS-UHFFFAOYSA-N 1 1 345.842 3.591 20 10 EHCDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000844384168 1137215807 /nfs/dbraw/zinc/21/58/07/1137215807.db2.gz CCYLIQUWUCGFLN-QUCCMNQESA-N 1 1 346.515 3.691 20 10 EHCDMO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000844385965 1137216151 /nfs/dbraw/zinc/21/61/51/1137216151.db2.gz LCGWUMOKGIDRNW-SFHVURJKSA-N 1 1 346.515 3.691 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@@H](OC(C)C)C3)cc2)CC1 ZINC000844381592 1137218392 /nfs/dbraw/zinc/21/83/92/1137218392.db2.gz LRJOMMOALWJGKT-OAQYLSRUSA-N 1 1 346.515 3.691 20 10 EHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(Br)cc1[O-] ZINC000844923069 1137263230 /nfs/dbraw/zinc/26/32/30/1137263230.db2.gz GJKOBDGHHQWBPP-GFCCVEGCSA-N 1 1 349.272 3.725 20 10 EHCDMO C[N@H+](Cc1cccs1)Cc1cc(Br)c(F)cc1O ZINC001144299586 1137268559 /nfs/dbraw/zinc/26/85/59/1137268559.db2.gz BDWHPFFTUFGECN-UHFFFAOYSA-N 1 1 330.222 3.987 20 10 EHCDMO C[N@@H+](Cc1cccs1)Cc1cc(Br)c(F)cc1O ZINC001144299586 1137268560 /nfs/dbraw/zinc/26/85/60/1137268560.db2.gz BDWHPFFTUFGECN-UHFFFAOYSA-N 1 1 330.222 3.987 20 10 EHCDMO COc1cc2c(c(OC)c1)N(C[C@@H]1CCCC[N@H+]1C(C)C)CCC2 ZINC001171189006 1137296331 /nfs/dbraw/zinc/29/63/31/1137296331.db2.gz IBMVHJPYESMXHF-KRWDZBQOSA-N 1 1 332.488 3.719 20 10 EHCDMO Oc1cc(O)c(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(O)c1 ZINC001144500160 1137301098 /nfs/dbraw/zinc/30/10/98/1137301098.db2.gz QFVNAGXNMGXFLR-UHFFFAOYSA-N 1 1 331.799 3.746 20 10 EHCDMO COc1ccc(C[NH2+][C@H](Cc2ccccc2)c2nccn2C)cc1C ZINC000846058559 1137327635 /nfs/dbraw/zinc/32/76/35/1137327635.db2.gz QOMZHTPEWCKTPK-LJQANCHMSA-N 1 1 335.451 3.811 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1O ZINC000846167134 1137337398 /nfs/dbraw/zinc/33/73/98/1137337398.db2.gz GUPBTRZVTZCYPO-MRVPVSSYSA-N 1 1 329.293 3.808 20 10 EHCDMO C[C@@H]([NH2+]CCc1cn(C)c2ncccc12)c1ccc(Cl)cc1O ZINC000866573142 1137366071 /nfs/dbraw/zinc/36/60/71/1137366071.db2.gz IFVTWYUBGZFGHJ-GFCCVEGCSA-N 1 1 329.831 3.826 20 10 EHCDMO CN(C)c1ccc(/C=C\C[NH2+]Cc2ncccc2Br)cc1 ZINC001204063704 1137441227 /nfs/dbraw/zinc/44/12/27/1137441227.db2.gz LMEDWWMKCJTAGX-HYXAFXHYSA-N 1 1 346.272 3.713 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2nc(N)c3ccccc3n2)cc1 ZINC000795155548 1137519801 /nfs/dbraw/zinc/51/98/01/1137519801.db2.gz FSHRTIZIGWBROT-UHFFFAOYSA-N 1 1 349.482 3.690 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2nc(N)c3ccccc3n2)cc1 ZINC000795155548 1137519803 /nfs/dbraw/zinc/51/98/03/1137519803.db2.gz FSHRTIZIGWBROT-UHFFFAOYSA-N 1 1 349.482 3.690 20 10 EHCDMO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](C)Cc1ccc(N3CCCC3)cc1)C2 ZINC001172121487 1137538825 /nfs/dbraw/zinc/53/88/25/1137538825.db2.gz JWHDGKSDFBYRPD-AERCQKQUSA-N 1 1 327.516 3.734 20 10 EHCDMO COc1ccc(C[NH2+][C@H](C)c2nc(C)cs2)cc1Cn1cccn1 ZINC000873038005 1137588660 /nfs/dbraw/zinc/58/86/60/1137588660.db2.gz HYOVLVZWKSJYQE-CQSZACIVSA-N 1 1 342.468 3.556 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCCc4sccc4C3)cc2)CC1 ZINC000876719577 1137659851 /nfs/dbraw/zinc/65/98/51/1137659851.db2.gz OQCBUNCSOQCHOJ-UHFFFAOYSA-N 1 1 342.508 3.658 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c(O)c1 ZINC000877498063 1137678760 /nfs/dbraw/zinc/67/87/60/1137678760.db2.gz JPXYPDDKMFDQCP-KRWDZBQOSA-N 1 1 325.456 3.613 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCSC4(CCC4)CC3)cc2)CC1 ZINC000877587406 1137682217 /nfs/dbraw/zinc/68/22/17/1137682217.db2.gz KFDMNRUNJNZMOV-UHFFFAOYSA-N 1 1 346.540 3.509 20 10 EHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCc2ncnn21 ZINC000878326726 1137710926 /nfs/dbraw/zinc/71/09/26/1137710926.db2.gz UYTIHOUNPTZQHV-APWZRJJASA-N 1 1 348.450 3.734 20 10 EHCDMO COc1cc(C[NH2+]Cc2cc(F)cc(F)c2O)ccc1OC(F)F ZINC000882881012 1137836613 /nfs/dbraw/zinc/83/66/13/1137836613.db2.gz UKKALDWQOFNPCN-UHFFFAOYSA-N 1 1 345.292 3.570 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(Br)o2)c1 ZINC000130703130 1137841090 /nfs/dbraw/zinc/84/10/90/1137841090.db2.gz BLFIWWUOMPKODB-UHFFFAOYSA-N 1 1 340.217 3.778 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1cc(C)ccc1C)Cc1ccccc1O ZINC000130722969 1137841294 /nfs/dbraw/zinc/84/12/94/1137841294.db2.gz IYNDARJFACXYRW-UHFFFAOYSA-N 1 1 326.440 3.860 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCN(c3ccccc3)CC2)c1O ZINC000130766757 1137842030 /nfs/dbraw/zinc/84/20/30/1137842030.db2.gz GQDOOXFUGHLQAP-UHFFFAOYSA-N 1 1 326.440 3.503 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(C)cc(Br)c1O)[C@@H]1CCCOC1 ZINC000883353007 1137856951 /nfs/dbraw/zinc/85/69/51/1137856951.db2.gz MJDCROMAERHQJF-DOMZBBRYSA-N 1 1 342.277 3.758 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CCN1CCCC1=O)Cc1ccccc1O ZINC000119282999 1137939940 /nfs/dbraw/zinc/93/99/40/1137939940.db2.gz SGGKGZFNULJBJT-QGZVFWFLSA-N 1 1 338.451 3.578 20 10 EHCDMO COc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccc1OC(F)F ZINC000886493698 1138083352 /nfs/dbraw/zinc/08/33/52/1138083352.db2.gz XMAAPLZESDLGDN-SNVBAGLBSA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)c1c(O)cccc1F ZINC000886536159 1138092569 /nfs/dbraw/zinc/09/25/69/1138092569.db2.gz BSQAHPXBMDFHLR-LBPRGKRZSA-N 1 1 348.384 3.846 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1c(O)cccc1F ZINC000886645046 1138105704 /nfs/dbraw/zinc/10/57/04/1138105704.db2.gz QKNXLWNQXMHPCF-ZDUSSCGKSA-N 1 1 331.387 3.602 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](COC)c2ccc(C)o2)ccc1OC ZINC000080237585 1138161798 /nfs/dbraw/zinc/16/17/98/1138161798.db2.gz ABQZHSQOIFIXFF-QGZVFWFLSA-N 1 1 333.428 3.610 20 10 EHCDMO CCc1cnc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)s1 ZINC000130664818 1138468012 /nfs/dbraw/zinc/46/80/12/1138468012.db2.gz LGNGZGZYDGOPEP-ZDUSSCGKSA-N 1 1 349.475 3.532 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3c(Cl)cnn3C)cc2)CC1 ZINC000131352538 1138512317 /nfs/dbraw/zinc/51/23/17/1138512317.db2.gz XRDGXLZRDHZZOM-UHFFFAOYSA-N 1 1 332.879 3.600 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)C[C@@H](C)c2nccs2)c1O ZINC000183994390 1140072577 /nfs/dbraw/zinc/07/25/77/1140072577.db2.gz HGFNHGDQELPTDZ-SNVBAGLBSA-N 1 1 338.860 3.940 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@@H](C)c2nccs2)c1O ZINC000183994390 1140072581 /nfs/dbraw/zinc/07/25/81/1140072581.db2.gz HGFNHGDQELPTDZ-SNVBAGLBSA-N 1 1 338.860 3.940 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)C[C@@H](C)c2nccs2)c1O ZINC000184744878 1140118702 /nfs/dbraw/zinc/11/87/02/1140118702.db2.gz SELGPKAUIZLGNP-SNVBAGLBSA-N 1 1 326.849 3.746 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000186831513 1140224140 /nfs/dbraw/zinc/22/41/40/1140224140.db2.gz PHNHPOLIOSVAAJ-GFCCVEGCSA-N 1 1 334.416 3.555 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644083 522616103 /nfs/dbraw/zinc/61/61/03/522616103.db2.gz RHZLUOHKCQRDTP-WFASDCNBSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644083 522616113 /nfs/dbraw/zinc/61/61/13/522616113.db2.gz RHZLUOHKCQRDTP-WFASDCNBSA-N 1 1 341.293 3.537 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cc1OC ZINC000160205191 1014356049 /nfs/dbraw/zinc/35/60/49/1014356049.db2.gz LMPXHXLTHAKSHM-HOCLYGCPSA-N 1 1 327.424 3.787 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)[C@H](C)CO1 ZINC001204432512 1015566220 /nfs/dbraw/zinc/56/62/20/1015566220.db2.gz TWNNAJFRJWPXPJ-HZPDHXFCSA-N 1 1 330.497 3.994 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@H](c3ccccc3C)C2)c(O)cc1C ZINC000160290927 1017056616 /nfs/dbraw/zinc/05/66/16/1017056616.db2.gz IPZLXVOJUBGQNC-FQEVSTJZSA-N 1 1 327.424 3.591 20 10 EHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2O)C1 ZINC000160319865 1017932470 /nfs/dbraw/zinc/93/24/70/1017932470.db2.gz QVZDYTKBRHVXJC-KGLIPLIRSA-N 1 1 325.474 3.515 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H]3CN3CCCC3)c2c1 ZINC000172485477 1032736319 /nfs/dbraw/zinc/73/63/19/1032736319.db2.gz MIDGLJUJBSAMNY-KRWDZBQOSA-N 1 1 340.467 3.614 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CCC[C@H]3C[NH+]3CCCC3)c2c1 ZINC000172485477 1032736335 /nfs/dbraw/zinc/73/63/35/1032736335.db2.gz MIDGLJUJBSAMNY-KRWDZBQOSA-N 1 1 340.467 3.614 20 10 EHCDMO Oc1cc2c(cc1C[N@H+](Cc1ccco1)Cc1cccs1)OCO2 ZINC000160662897 1020148882 /nfs/dbraw/zinc/14/88/82/1020148882.db2.gz WWTFUSBDLOYPOV-UHFFFAOYSA-N 1 1 343.404 3.978 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+](Cc1ccco1)Cc1cccs1)OCO2 ZINC000160662897 1020148892 /nfs/dbraw/zinc/14/88/92/1020148892.db2.gz WWTFUSBDLOYPOV-UHFFFAOYSA-N 1 1 343.404 3.978 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000172772833 1032936685 /nfs/dbraw/zinc/93/66/85/1032936685.db2.gz XHODJHGLQVDQIR-SFHVURJKSA-N 1 1 340.423 3.630 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(Cl)nc1)C[C@@H]1CCCO1 ZINC000072629255 1021012327 /nfs/dbraw/zinc/01/23/27/1021012327.db2.gz OMEHCPOGHGCMRB-INIZCTEOSA-N 1 1 332.831 3.622 20 10 EHCDMO CCOC(=O)N[C@H](C[NH2+][C@@H](CC)c1ccc(F)cc1O)CC(C)C ZINC000796677212 1021384639 /nfs/dbraw/zinc/38/46/39/1021384639.db2.gz AYIGKJIANSDWIG-HOCLYGCPSA-N 1 1 340.439 3.733 20 10 EHCDMO CC[C@@H](c1ccc(F)cc1[O-])[N@H+]1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000296653935 1021404290 /nfs/dbraw/zinc/40/42/90/1021404290.db2.gz ZDQRPZGVPMNZPB-BBRMVZONSA-N 1 1 336.451 3.596 20 10 EHCDMO CC[C@@H](c1ccc(F)cc1O)[N@@H+]1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000296653935 1021404298 /nfs/dbraw/zinc/40/42/98/1021404298.db2.gz ZDQRPZGVPMNZPB-BBRMVZONSA-N 1 1 336.451 3.596 20 10 EHCDMO CC[C@@H](c1ccc(F)cc1O)[N@H+]1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000296653935 1021404301 /nfs/dbraw/zinc/40/43/01/1021404301.db2.gz ZDQRPZGVPMNZPB-BBRMVZONSA-N 1 1 336.451 3.596 20 10 EHCDMO COCc1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)ccc1F ZINC000293736361 1022903242 /nfs/dbraw/zinc/90/32/42/1022903242.db2.gz WTQHELKCBRNYIY-UHFFFAOYSA-N 1 1 327.758 3.760 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nnc([C@@H](C)CC)[nH]2)c(O)c1 ZINC000277060392 1023728178 /nfs/dbraw/zinc/72/81/78/1023728178.db2.gz BRYZESOXSVVCNS-STQMWFEESA-N 1 1 332.448 3.663 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3nc(C)no3)C2)cc1F ZINC000091832585 1024775163 /nfs/dbraw/zinc/77/51/63/1024775163.db2.gz PGZXACQJFLNNQE-MRXNPFEDSA-N 1 1 346.450 3.743 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cc3ccccc3o2)c(O)c1OC ZINC000892120309 1024847295 /nfs/dbraw/zinc/84/72/95/1024847295.db2.gz GLROAYLODZQYGT-UHFFFAOYSA-N 1 1 327.380 3.788 20 10 EHCDMO CC(C)CN(C)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435631666 1025049135 /nfs/dbraw/zinc/04/91/35/1025049135.db2.gz GJEXPSHMLRWBSC-UHFFFAOYSA-N 1 1 341.499 3.522 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)c(O)c1OC ZINC000892154422 1025052437 /nfs/dbraw/zinc/05/24/37/1025052437.db2.gz YEQMSGSSGBLLGD-UKRRQHHQSA-N 1 1 331.412 3.976 20 10 EHCDMO Cc1cc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc(C)[nH+]1 ZINC000301456897 1026812480 /nfs/dbraw/zinc/81/24/80/1026812480.db2.gz HVMIMEHYPYXDCZ-AWEZNQCLSA-N 1 1 348.397 3.776 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc(F)cc1O ZINC000273396290 1027410341 /nfs/dbraw/zinc/41/03/41/1027410341.db2.gz LXGHHKWWXJRPIC-AWEZNQCLSA-N 1 1 329.419 3.767 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000273533788 1027479224 /nfs/dbraw/zinc/47/92/24/1027479224.db2.gz VNRNOGUEAQFBHD-XLIONFOSSA-N 1 1 345.414 3.892 20 10 EHCDMO CC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(Br)c1[O-] ZINC000708147005 1028177612 /nfs/dbraw/zinc/17/76/12/1028177612.db2.gz VWSCENUJASJKIY-UHFFFAOYSA-N 1 1 349.700 3.582 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000271751989 1029152210 /nfs/dbraw/zinc/15/22/10/1029152210.db2.gz VSAVNNPTXWUFGX-GOSISDBHSA-N 1 1 337.423 3.625 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000278242736 1029780952 /nfs/dbraw/zinc/78/09/52/1029780952.db2.gz NZLLVCOTEBSFAH-GFCCVEGCSA-N 1 1 334.397 3.708 20 10 EHCDMO Cc1nc(C2([NH2+]Cc3cc4c(cc3O)CCC4)CCCCC2)no1 ZINC000729849176 1030802324 /nfs/dbraw/zinc/80/23/24/1030802324.db2.gz HARPMIKRUQWRBG-UHFFFAOYSA-N 1 1 327.428 3.522 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000052686793 1031154582 /nfs/dbraw/zinc/15/45/82/1031154582.db2.gz LLCNKPWTJXZKER-UHFFFAOYSA-N 1 1 337.467 3.747 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000052686793 1031154593 /nfs/dbraw/zinc/15/45/93/1031154593.db2.gz LLCNKPWTJXZKER-UHFFFAOYSA-N 1 1 337.467 3.747 20 10 EHCDMO COc1cccc([C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)OC)c1 ZINC000527733673 1031164955 /nfs/dbraw/zinc/16/49/55/1031164955.db2.gz DPLBYCOPXZBISB-MRXNPFEDSA-N 1 1 339.794 3.671 20 10 EHCDMO COc1ccc([C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C2CC2)cn1 ZINC000527840365 1031311605 /nfs/dbraw/zinc/31/16/05/1031311605.db2.gz FGLQPZXWPLZMRZ-KRWDZBQOSA-N 1 1 336.794 3.829 20 10 EHCDMO C[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000128842617 1031358495 /nfs/dbraw/zinc/35/84/95/1031358495.db2.gz MJPSDKXVVIMJEE-OAHLLOKOSA-N 1 1 346.421 3.994 20 10 EHCDMO COc1ccc(O)c(C[NH2+][C@H](c2ccco2)c2ccccc2OC)c1 ZINC000181363569 1031980274 /nfs/dbraw/zinc/98/02/74/1031980274.db2.gz KYBUGRRQJSKZRM-FQEVSTJZSA-N 1 1 339.391 3.882 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCN(C)c3ccccc3C2)c1O ZINC000761193995 1034378754 /nfs/dbraw/zinc/37/87/54/1034378754.db2.gz OPDPKRDRVFTKBQ-UHFFFAOYSA-N 1 1 332.831 3.506 20 10 EHCDMO COc1cccc(O)c1CNCC1([NH+]2CCCCC2)CCCCC1 ZINC000725841478 1034674757 /nfs/dbraw/zinc/67/47/57/1034674757.db2.gz FERCVLXPANLNMZ-UHFFFAOYSA-N 1 1 332.488 3.679 20 10 EHCDMO CC[C@@](C)([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1nccs1 ZINC000152656683 1037492555 /nfs/dbraw/zinc/49/25/55/1037492555.db2.gz QNSOOJJGMZMESI-GOSISDBHSA-N 1 1 349.475 3.534 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(-c3cccs3)no2)c1 ZINC000182432895 1038598991 /nfs/dbraw/zinc/59/89/91/1038598991.db2.gz JOXBXRYHJAXQGK-GHMZBOCLSA-N 1 1 345.424 3.924 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000756420235 1038659175 /nfs/dbraw/zinc/65/91/75/1038659175.db2.gz DABFCVLYEXNFDG-TYNCELHUSA-N 1 1 329.396 3.746 20 10 EHCDMO Cc1nc([C@@H]2CC[N@@H+](Cc3cc4oc5ccccc5c4cc3O)C2)no1 ZINC000905685716 1039040289 /nfs/dbraw/zinc/04/02/89/1039040289.db2.gz UXXXDXZKJJZZBK-CYBMUJFWSA-N 1 1 349.390 3.973 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@H](Cc2nccs2)C1 ZINC000905733468 1039069583 /nfs/dbraw/zinc/06/95/83/1039069583.db2.gz HOUWLHKYQZHYRX-CQSZACIVSA-N 1 1 339.464 3.852 20 10 EHCDMO CCC[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@@H]21)Cc1ccccc1O ZINC000728927197 1039503661 /nfs/dbraw/zinc/50/36/61/1039503661.db2.gz MAZJKAONMUWZFJ-MJGOQNOKSA-N 1 1 344.499 3.785 20 10 EHCDMO Cc1cc(O)c(C[NH+]2CCN(C(=O)OC(C)(C)C)CC2)cc1C(C)C ZINC000028738663 1039594355 /nfs/dbraw/zinc/59/43/55/1039594355.db2.gz ILOBHZDQUSGLIR-UHFFFAOYSA-N 1 1 348.487 3.877 20 10 EHCDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@@H](C)Cc1ccsc1 ZINC000190259308 1040371157 /nfs/dbraw/zinc/37/11/57/1040371157.db2.gz KBRMLQSUJYNVAG-ZDUSSCGKSA-N 1 1 335.469 3.924 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2c(C)noc2C)c(O)c(C(C)(C)C)c1 ZINC000163996323 1041110197 /nfs/dbraw/zinc/11/01/97/1041110197.db2.gz BLVXJQNDMVVURX-UHFFFAOYSA-N 1 1 332.444 3.935 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000164276078 1041233856 /nfs/dbraw/zinc/23/38/56/1041233856.db2.gz GCJLQPYLBQYYRV-GOSISDBHSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000164276078 1041233873 /nfs/dbraw/zinc/23/38/73/1041233873.db2.gz GCJLQPYLBQYYRV-GOSISDBHSA-N 1 1 333.378 3.861 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1O ZINC000164276342 1041234217 /nfs/dbraw/zinc/23/42/17/1041234217.db2.gz GEHRPKNCQDSJKY-GOSISDBHSA-N 1 1 349.377 3.561 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1O ZINC000164276342 1041234233 /nfs/dbraw/zinc/23/42/33/1041234233.db2.gz GEHRPKNCQDSJKY-GOSISDBHSA-N 1 1 349.377 3.561 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccc(C)cc3)C2)c(O)c1OC ZINC000893532706 1042396488 /nfs/dbraw/zinc/39/64/88/1042396488.db2.gz WOKXYVSYBQLGRC-MRXNPFEDSA-N 1 1 327.424 3.707 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000278884532 1042829830 /nfs/dbraw/zinc/82/98/30/1042829830.db2.gz OMWZBUPYGWFFSE-SNVBAGLBSA-N 1 1 336.775 3.813 20 10 EHCDMO C[C@H]([NH2+]C1CCN(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1O ZINC000185073584 1126751072 /nfs/dbraw/zinc/75/10/72/1126751072.db2.gz CWQSQVJOTORDBU-AWEZNQCLSA-N 1 1 346.421 3.986 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000185337408 1126868902 /nfs/dbraw/zinc/86/89/02/1126868902.db2.gz HEAUSTMKLIGOFU-AEFFLSMTSA-N 1 1 342.458 3.747 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1O ZINC000185455723 1126903906 /nfs/dbraw/zinc/90/39/06/1126903906.db2.gz GCCKAYKUKZZRLI-TZMCWYRMSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@@H]([NH2+]CCOc1ncccc1C(F)(F)F)c1ccc(F)cc1O ZINC000186145623 1127354765 /nfs/dbraw/zinc/35/47/65/1127354765.db2.gz PVPVUIFUWNTEHG-SNVBAGLBSA-N 1 1 344.308 3.675 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc4c(c3)CCC4)CC2)cc1 ZINC000734484339 1131239541 /nfs/dbraw/zinc/23/95/41/1131239541.db2.gz RFFSIRITOVONPJ-UHFFFAOYSA-N 1 1 336.479 3.896 20 10 EHCDMO CC[C@@H]1CN(c2ccccc2)CC[N@H+]1Cc1cccc(OC)c1O ZINC000764680166 1127519717 /nfs/dbraw/zinc/51/97/17/1127519717.db2.gz ZYDLFKTWQWZZIA-QGZVFWFLSA-N 1 1 326.440 3.502 20 10 EHCDMO Cc1cc(CC[NH2+][C@@H]2CCN(C)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716045 1127525543 /nfs/dbraw/zinc/52/55/43/1127525543.db2.gz GOMITFPOVOSDHR-OXQOHEQNSA-N 1 1 325.500 3.709 20 10 EHCDMO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)c1 ZINC000153505093 1121238877 /nfs/dbraw/zinc/23/88/77/1121238877.db2.gz OIFMUPQWDUVXCO-OAQYLSRUSA-N 1 1 340.442 3.999 20 10 EHCDMO COc1cccc2[nH]cc(CC[NH2+][C@H](C)c3ccc(F)cc3O)c21 ZINC000186507144 1129051567 /nfs/dbraw/zinc/05/15/67/1129051567.db2.gz NTRSPSSVOUSVFZ-GFCCVEGCSA-N 1 1 328.387 3.915 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H](O)c1ccccc1F ZINC000917019891 1122440035 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/nfs/dbraw/zinc/03/59/82/1134035982.db2.gz IZSNLNWWLQSMDT-PMACEKPBSA-N 1 1 346.515 3.636 20 10 EHCDMO C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788629213 1134153633 /nfs/dbraw/zinc/15/36/33/1134153633.db2.gz SENJEDGCETUGKH-PGUXBMHVSA-N 1 1 328.378 3.544 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cccc(C(F)(F)F)c1O ZINC000788671668 1134159643 /nfs/dbraw/zinc/15/96/43/1134159643.db2.gz YMANOSJMYKIDBI-ZANVPECISA-N 1 1 325.334 3.862 20 10 EHCDMO COc1c(O)c(C[NH2+]CCC(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000774982100 1134177225 /nfs/dbraw/zinc/17/72/25/1134177225.db2.gz BROTUBGOWHNTHL-UHFFFAOYSA-N 1 1 344.411 3.767 20 10 EHCDMO CCOC[C@@H]([NH2+]Cc1cc(C)cc(Br)c1O)C(C)C ZINC000788971136 1134198093 /nfs/dbraw/zinc/19/80/93/1134198093.db2.gz IZZJLPLIUODERC-CQSZACIVSA-N 1 1 330.266 3.614 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1O ZINC000789478436 1134289282 /nfs/dbraw/zinc/28/92/82/1134289282.db2.gz IIASDEYDSXBPSL-DZGCQCFKSA-N 1 1 330.255 3.725 20 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/nfs/dbraw/zinc/66/12/94/1134661294.db2.gz RCDXITLOSFUSNV-ZDUSSCGKSA-N 1 1 326.843 3.635 20 10 EHCDMO COc1cccc(C[N@@H+]2CCc3cc(Br)ccc3C2)c1O ZINC000792181868 1134664384 /nfs/dbraw/zinc/66/43/84/1134664384.db2.gz VLGFCEHDFJTMNR-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cccc(C[N@H+]2CCc3cc(Br)ccc3C2)c1O ZINC000792181868 1134664385 /nfs/dbraw/zinc/66/43/85/1134664385.db2.gz VLGFCEHDFJTMNR-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@H](c3ccc(CC)cc3)C2)c(O)c1 ZINC000792186518 1134665163 /nfs/dbraw/zinc/66/51/63/1134665163.db2.gz FMUZNFVWEQDRHU-NRFANRHFSA-N 1 1 341.451 3.927 20 10 EHCDMO COCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1CC[C@@H](C)C1 ZINC000792193495 1134666458 /nfs/dbraw/zinc/66/64/58/1134666458.db2.gz XJZKGJJTQFUYPN-IUODEOHRSA-N 1 1 327.852 3.691 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nnc(-c3cc(C)oc3C)o2)c1 ZINC000775365546 1134670152 /nfs/dbraw/zinc/67/01/52/1134670152.db2.gz WHDMVTZNQCHOGQ-LLVKDONJSA-N 1 1 343.383 3.511 20 10 EHCDMO CCc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)on1 ZINC000792882909 1134812673 /nfs/dbraw/zinc/81/26/73/1134812673.db2.gz RPQYWMABJKACNT-UHFFFAOYSA-N 1 1 327.350 3.612 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1C ZINC000793248151 1134889457 /nfs/dbraw/zinc/88/94/57/1134889457.db2.gz YJCLTUPHNSPMDA-OYRHEFFESA-N 1 1 336.479 3.573 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1C ZINC000793248151 1134889476 /nfs/dbraw/zinc/88/94/76/1134889476.db2.gz YJCLTUPHNSPMDA-OYRHEFFESA-N 1 1 336.479 3.573 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1C ZINC000793248151 1134889484 /nfs/dbraw/zinc/88/94/84/1134889484.db2.gz YJCLTUPHNSPMDA-OYRHEFFESA-N 1 1 336.479 3.573 20 10 EHCDMO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H](C)CC(C)C ZINC001191682743 1134898762 /nfs/dbraw/zinc/89/87/62/1134898762.db2.gz RPSMGNNBADGIOZ-ZDUSSCGKSA-N 1 1 327.852 3.703 20 10 EHCDMO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H](C)CC(C)C ZINC001191682743 1134898770 /nfs/dbraw/zinc/89/87/70/1134898770.db2.gz RPSMGNNBADGIOZ-ZDUSSCGKSA-N 1 1 327.852 3.703 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1O ZINC000775674658 1135488578 /nfs/dbraw/zinc/48/85/78/1135488578.db2.gz HWWNERMWCSLIMH-KRWDZBQOSA-N 1 1 325.408 3.809 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCc3cccc(Br)c3C2)c1 ZINC000775702672 1135536241 /nfs/dbraw/zinc/53/62/41/1135536241.db2.gz VAPXVQYAYXXQAH-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCc3cccc(Br)c3C2)c1 ZINC000775702672 1135536244 /nfs/dbraw/zinc/53/62/44/1135536244.db2.gz VAPXVQYAYXXQAH-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO CC[C@]1(C)CC(=O)N(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000808137005 1135621697 /nfs/dbraw/zinc/62/16/97/1135621697.db2.gz SYRQAYUQUZBKLN-OAQYLSRUSA-N 1 1 343.515 3.715 20 10 EHCDMO CC[C@]1(C)CC(=O)N(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000808137005 1135621700 /nfs/dbraw/zinc/62/17/00/1135621700.db2.gz SYRQAYUQUZBKLN-OAQYLSRUSA-N 1 1 343.515 3.715 20 10 EHCDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000747465817 1135631060 /nfs/dbraw/zinc/63/10/60/1135631060.db2.gz BFFWHIAUNOHHPT-GOEBONIOSA-N 1 1 325.408 3.574 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000809703503 1135874330 /nfs/dbraw/zinc/87/43/30/1135874330.db2.gz LDMSROCJULFMKC-JOCHJYFZSA-N 1 1 336.479 3.799 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000809703503 1135874334 /nfs/dbraw/zinc/87/43/34/1135874334.db2.gz LDMSROCJULFMKC-JOCHJYFZSA-N 1 1 336.479 3.799 20 10 EHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000809767392 1135880029 /nfs/dbraw/zinc/88/00/29/1135880029.db2.gz JRVUBRWMIZWOJU-LBPRGKRZSA-N 1 1 348.306 3.737 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000809738196 1135882778 /nfs/dbraw/zinc/88/27/78/1135882778.db2.gz SYGWNXVWKMLTSE-UHFFFAOYSA-N 1 1 347.256 3.929 20 10 EHCDMO CN1CCC([N@@H+](Cc2ccccc2)Cc2cc(F)ccc2O)CC1 ZINC000809763657 1135888421 /nfs/dbraw/zinc/88/84/21/1135888421.db2.gz DHPXGEITQHPSKO-UHFFFAOYSA-N 1 1 328.431 3.628 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1OC ZINC000776012893 1135917679 /nfs/dbraw/zinc/91/76/79/1135917679.db2.gz KLYHYEGZIJUGGP-JQWIXIFHSA-N 1 1 333.350 3.572 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2Cc3ccccc3C2)c1 ZINC001201901774 1136071293 /nfs/dbraw/zinc/07/12/93/1136071293.db2.gz RDCHEUKRFSRUKG-UHFFFAOYSA-N 1 1 332.241 3.720 20 10 EHCDMO C[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)Oc1ccc(Cl)cc1 ZINC001201981141 1136076053 /nfs/dbraw/zinc/07/60/53/1136076053.db2.gz KCDWGKQRBIHCRT-JTQLQIEISA-N 1 1 327.758 3.881 20 10 EHCDMO CCOc1ccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c(O)c1 ZINC000811508462 1136101897 /nfs/dbraw/zinc/10/18/97/1136101897.db2.gz RFAACQINBOAJNU-SFHVURJKSA-N 1 1 338.451 3.776 20 10 EHCDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000106856666 1136154363 /nfs/dbraw/zinc/15/43/63/1136154363.db2.gz YBDFGZAYJPTCMV-OAHLLOKOSA-N 1 1 342.439 3.644 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ncnc32)cc1 ZINC000850351704 1136239729 /nfs/dbraw/zinc/23/97/29/1136239729.db2.gz GVEGKLYBWHTZRV-CRAIPNDOSA-N 1 1 327.476 3.700 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cccc(C(F)(F)F)c1O ZINC000850533925 1136281202 /nfs/dbraw/zinc/28/12/02/1136281202.db2.gz DHMQGOOUYKBAAT-SNVBAGLBSA-N 1 1 339.361 3.873 20 10 EHCDMO C[N@@H+](CCCc1nc(-c2cccs2)no1)Cc1ccccc1O ZINC000109770159 1136340092 /nfs/dbraw/zinc/34/00/92/1136340092.db2.gz UEOJRWVHUBOCLR-UHFFFAOYSA-N 1 1 329.425 3.568 20 10 EHCDMO CCCc1nc(C)c(C[NH2+]Cc2ccc(OC)c(COCC)c2)o1 ZINC000813792143 1136362789 /nfs/dbraw/zinc/36/27/89/1136362789.db2.gz KGRVESUDNXKSIC-UHFFFAOYSA-N 1 1 332.444 3.770 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853094007 1136508420 /nfs/dbraw/zinc/50/84/20/1136508420.db2.gz WDYPPXNLWOJXLL-ZDUSSCGKSA-N 1 1 343.298 3.911 20 10 EHCDMO Cc1cc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC000815014871 1136537541 /nfs/dbraw/zinc/53/75/41/1136537541.db2.gz CACCTJXSTRVWJR-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC000815014871 1136537545 /nfs/dbraw/zinc/53/75/45/1136537545.db2.gz CACCTJXSTRVWJR-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cccc(C)c1[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000853522004 1136540123 /nfs/dbraw/zinc/54/01/23/1136540123.db2.gz ICMCWSYPCNWIGO-MJGOQNOKSA-N 1 1 339.435 3.772 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](CC(F)(F)F)C2)cc1C(C)C ZINC000853611716 1136549752 /nfs/dbraw/zinc/54/97/52/1136549752.db2.gz UHIVYXGZOMFVFU-AWEZNQCLSA-N 1 1 331.378 3.977 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](CC(F)(F)F)C2)cc1C(C)C ZINC000853611716 1136549755 /nfs/dbraw/zinc/54/97/55/1136549755.db2.gz UHIVYXGZOMFVFU-AWEZNQCLSA-N 1 1 331.378 3.977 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@](C)(C(F)F)O1 ZINC000853631075 1136551198 /nfs/dbraw/zinc/55/11/98/1136551198.db2.gz SAYRUGNJPGKBGD-ZMZPIMSZSA-N 1 1 343.414 3.640 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@](C)(C(F)F)O1 ZINC000853631075 1136551200 /nfs/dbraw/zinc/55/12/00/1136551200.db2.gz SAYRUGNJPGKBGD-ZMZPIMSZSA-N 1 1 343.414 3.640 20 10 EHCDMO CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1[O-] ZINC000854230059 1136600000 /nfs/dbraw/zinc/60/00/00/1136600000.db2.gz FQUXMQWDFXFBMM-KGLIPLIRSA-N 1 1 329.282 3.569 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc2c1OCO2)c1cccc(C(F)(F)F)c1O ZINC000815562459 1136610947 /nfs/dbraw/zinc/61/09/47/1136610947.db2.gz GFPJJSKXTMLARJ-JTQLQIEISA-N 1 1 339.313 3.991 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000815593133 1136616026 /nfs/dbraw/zinc/61/60/26/1136616026.db2.gz CMKKXNMBFVBWKY-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1cccc(C(F)(F)F)c1O ZINC000815642715 1136625145 /nfs/dbraw/zinc/62/51/45/1136625145.db2.gz KEADTOLCSIHQKO-VHSXEESVSA-N 1 1 326.318 3.923 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000816528590 1136730123 /nfs/dbraw/zinc/73/01/23/1136730123.db2.gz JKVBBIOMTKHLJL-HNNXBMFYSA-N 1 1 338.810 3.704 20 10 EHCDMO Oc1c(C[N@@H+]2CCO[C@@H](COc3ccccc3)C2)ccc2ccccc21 ZINC000816591003 1136734952 /nfs/dbraw/zinc/73/49/52/1136734952.db2.gz QWFFTWIQXJRKMQ-HXUWFJFHSA-N 1 1 349.430 3.825 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@@H](COc3ccccc3)C2)ccc2ccccc21 ZINC000816591003 1136734955 /nfs/dbraw/zinc/73/49/55/1136734955.db2.gz QWFFTWIQXJRKMQ-HXUWFJFHSA-N 1 1 349.430 3.825 20 10 EHCDMO OC[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(Cl)cc1 ZINC000816612526 1136741012 /nfs/dbraw/zinc/74/10/12/1136741012.db2.gz QZQYAGFFQZAARS-LBPRGKRZSA-N 1 1 344.213 3.704 20 10 EHCDMO COc1cccc(C[N@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1O ZINC000816659251 1136746053 /nfs/dbraw/zinc/74/60/53/1136746053.db2.gz HGCDAPXSHQWUBF-MRXNPFEDSA-N 1 1 333.815 3.708 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000817938553 1136847328 /nfs/dbraw/zinc/84/73/28/1136847328.db2.gz MXAQCSBBFYEKMT-FZKQIMNGSA-N 1 1 349.425 3.705 20 10 EHCDMO Cc1ccc2c(c1)OCCC[C@@H]2NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940817 1136848171 /nfs/dbraw/zinc/84/81/71/1136848171.db2.gz HZDDJKNDNZZJFZ-UXHICEINSA-N 1 1 339.483 3.564 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCCc3ccc(F)cc32)cc1 ZINC000817940356 1136848810 /nfs/dbraw/zinc/84/88/10/1136848810.db2.gz GCTMBFOAMTWTQD-WOJBJXKFSA-N 1 1 327.447 3.559 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1nccc2ccccc21 ZINC000817942544 1136848993 /nfs/dbraw/zinc/84/89/93/1136848993.db2.gz PMRZCFNXMZKWSQ-FOIQADDNSA-N 1 1 334.467 3.651 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1[O-] ZINC000817979579 1136854899 /nfs/dbraw/zinc/85/48/99/1136854899.db2.gz LXVHWYZLVSILKN-QIIPPGSGSA-N 1 1 346.421 3.714 20 10 EHCDMO CC(C)CCNC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000857758566 1136905649 /nfs/dbraw/zinc/90/56/49/1136905649.db2.gz KXFZSUMTUNPGOS-GOSISDBHSA-N 1 1 345.531 3.660 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000858168526 1136945890 /nfs/dbraw/zinc/94/58/90/1136945890.db2.gz NAZFZNOZWUNAHO-UHFFFAOYSA-N 1 1 349.381 3.964 20 10 EHCDMO CCC[C@H](C[NH2+]Cc1cc(C)cc(Br)c1O)OCC ZINC001203249273 1136952328 /nfs/dbraw/zinc/95/23/28/1136952328.db2.gz OEZBLBNBFZBUHN-CYBMUJFWSA-N 1 1 330.266 3.758 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCc2scnc21)c1ccc(N2CCOCC2)cc1 ZINC000858355950 1136961245 /nfs/dbraw/zinc/96/12/45/1136961245.db2.gz SNJZQFZKQVSVFR-YOEHRIQHSA-N 1 1 343.496 3.708 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cc(CO)ccc2F)C2CC2)cc1 ZINC000859081477 1137002457 /nfs/dbraw/zinc/00/24/57/1137002457.db2.gz FWHGHTHGMIPOOK-UHFFFAOYSA-N 1 1 328.431 3.549 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CC[C@H]3CC3(Cl)Cl)CC2)cc1 ZINC000822582334 1137064307 /nfs/dbraw/zinc/06/43/07/1137064307.db2.gz CKWXFRXVIUCRCC-AWEZNQCLSA-N 1 1 343.298 3.791 20 10 EHCDMO CCC[N@H+](Cc1cn(-c2ccc(F)cc2)nn1)Cc1ccccc1O ZINC000862236728 1137133903 /nfs/dbraw/zinc/13/39/03/1137133903.db2.gz CFOBRATZHXJGFH-UHFFFAOYSA-N 1 1 340.402 3.524 20 10 EHCDMO CCC[N@@H+](Cc1cn(-c2ccc(F)cc2)nn1)Cc1ccccc1O ZINC000862236728 1137133904 /nfs/dbraw/zinc/13/39/04/1137133904.db2.gz CFOBRATZHXJGFH-UHFFFAOYSA-N 1 1 340.402 3.524 20 10 EHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862242811 1137134424 /nfs/dbraw/zinc/13/44/24/1137134424.db2.gz RKSVFWLDCHOGBS-OAHLLOKOSA-N 1 1 326.431 3.812 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597974 1137144482 /nfs/dbraw/zinc/14/44/82/1137144482.db2.gz YKJLZAZSTKXHKC-AWEZNQCLSA-N 1 1 343.471 3.801 20 10 EHCDMO COc1cc(C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597974 1137144484 /nfs/dbraw/zinc/14/44/84/1137144484.db2.gz YKJLZAZSTKXHKC-AWEZNQCLSA-N 1 1 343.471 3.801 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597974 1137144485 /nfs/dbraw/zinc/14/44/85/1137144485.db2.gz YKJLZAZSTKXHKC-AWEZNQCLSA-N 1 1 343.471 3.801 20 10 EHCDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000824582978 1137145497 /nfs/dbraw/zinc/14/54/97/1137145497.db2.gz GHPHISBXGKNYNR-MRXNPFEDSA-N 1 1 330.394 3.630 20 10 EHCDMO Cc1ccc(O)c(C[NH2+]C2CCN([C@@H](C)Cc3ccccc3)CC2)c1 ZINC000862478541 1137146078 /nfs/dbraw/zinc/14/60/78/1137146078.db2.gz JEXRLWVTHVFSFY-SFHVURJKSA-N 1 1 338.495 3.886 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824695771 1137148699 /nfs/dbraw/zinc/14/86/99/1137148699.db2.gz CMKOYSFRCFEWPG-DAXOMENPSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824695771 1137148701 /nfs/dbraw/zinc/14/87/01/1137148701.db2.gz CMKOYSFRCFEWPG-DAXOMENPSA-N 1 1 327.827 3.700 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000863302398 1137180490 /nfs/dbraw/zinc/18/04/90/1137180490.db2.gz KKLFDTJTIKVWHH-GDBMZVCRSA-N 1 1 349.471 3.509 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)C[C@H](c2ccsc2)O1 ZINC000119946010 1137219743 /nfs/dbraw/zinc/21/97/43/1137219743.db2.gz RLPSNCPBPKFXSG-ORAYPTAESA-N 1 1 329.465 3.904 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2cc(OC)c(OC)cc2C)c1O ZINC000120099415 1137233781 /nfs/dbraw/zinc/23/37/81/1137233781.db2.gz GSUUSDDQIHVIBE-UHFFFAOYSA-N 1 1 345.439 3.749 20 10 EHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(Br)ccc1[O-] ZINC000844923133 1137263175 /nfs/dbraw/zinc/26/31/75/1137263175.db2.gz HDDBGFYVSAEBDC-LBPRGKRZSA-N 1 1 349.272 3.725 20 10 EHCDMO CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000844924563 1137263198 /nfs/dbraw/zinc/26/31/98/1137263198.db2.gz LXSQHBSZXZWLDF-HNNXBMFYSA-N 1 1 330.394 3.841 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc3c(cc[nH]c3=O)o2)cc1F ZINC000865456916 1137285431 /nfs/dbraw/zinc/28/54/31/1137285431.db2.gz URHPPHJOOXTQQG-UHFFFAOYSA-N 1 1 343.402 3.809 20 10 EHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1c[nH]c3nc(Cl)ccc13)CCC2 ZINC001144416299 1137288287 /nfs/dbraw/zinc/28/82/87/1137288287.db2.gz FFAYFZZBYLQHBJ-UHFFFAOYSA-N 1 1 343.814 3.576 20 10 EHCDMO CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1C[N@@H+](Cc1ccccc1O)C2 ZINC000846003993 1137324607 /nfs/dbraw/zinc/32/46/07/1137324607.db2.gz XHJOAEXTPHXAIP-JXFKEZNVSA-N 1 1 346.471 3.519 20 10 EHCDMO COc1cccc([C@H](C)NC[C@@H]2CCC[N@@H+]2C2CCCCC2)c1O ZINC000846167962 1137337337 /nfs/dbraw/zinc/33/73/37/1137337337.db2.gz PKFDGGKGCSDCLP-RDJZCZTQSA-N 1 1 332.488 3.849 20 10 EHCDMO COc1cccc([C@H](C)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1O ZINC000846167962 1137337338 /nfs/dbraw/zinc/33/73/38/1137337338.db2.gz PKFDGGKGCSDCLP-RDJZCZTQSA-N 1 1 332.488 3.849 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1ccc(F)cc1O ZINC000866421688 1137353344 /nfs/dbraw/zinc/35/33/44/1137353344.db2.gz AUOBECLSNMTZOU-ZDUSSCGKSA-N 1 1 331.387 3.602 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](c3cc(C)ccn3)C2)c1O ZINC000846981753 1137380144 /nfs/dbraw/zinc/38/01/44/1137380144.db2.gz WFNYAVSGQZJNDJ-AWEZNQCLSA-N 1 1 344.842 3.941 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@H]3c3ccccc3)cc2)CC1 ZINC000876557968 1137655366 /nfs/dbraw/zinc/65/53/66/1137655366.db2.gz NCSXZBQDWPDQFE-QFIPXVFZSA-N 1 1 336.479 3.985 20 10 EHCDMO CCOC(=O)c1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)on1 ZINC000876722581 1137659750 /nfs/dbraw/zinc/65/97/50/1137659750.db2.gz ZDHCFDCBGHPVAQ-UHFFFAOYSA-N 1 1 344.411 3.502 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000825934091 1137670394 /nfs/dbraw/zinc/67/03/94/1137670394.db2.gz GRHCNLUBLZQMBO-UHFFFAOYSA-N 1 1 333.229 3.714 20 10 EHCDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccc(F)cc1 ZINC000877665671 1137684882 /nfs/dbraw/zinc/68/48/82/1137684882.db2.gz DMTHIPWSSWVPMZ-GOSISDBHSA-N 1 1 348.374 3.863 20 10 EHCDMO C[C@H]1C[C@@H](C[N@H+]2Cc3cccc(O)c3C2)CCN1C(=O)OC(C)(C)C ZINC000877703148 1137686515 /nfs/dbraw/zinc/68/65/15/1137686515.db2.gz TWSOZQUYTYGKMX-GJZGRUSLSA-N 1 1 346.471 3.743 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH+]2CCC3(CCCCO3)CC2)c1O ZINC000880454807 1137778841 /nfs/dbraw/zinc/77/88/41/1137778841.db2.gz JSSQQCGUHMKYNX-UHFFFAOYSA-N 1 1 337.847 3.783 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000883289152 1137852839 /nfs/dbraw/zinc/85/28/39/1137852839.db2.gz FYZFDRFMRYYXER-OAHLLOKOSA-N 1 1 345.437 3.567 20 10 EHCDMO C[C@@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000883289454 1137852891 /nfs/dbraw/zinc/85/28/91/1137852891.db2.gz PHAJQDUAPYGWSO-OAHLLOKOSA-N 1 1 345.437 3.567 20 10 EHCDMO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109772993 1137897441 /nfs/dbraw/zinc/89/74/41/1137897441.db2.gz OGWZRGMNGXISFT-HNNXBMFYSA-N 1 1 326.440 3.975 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000121017260 1137954431 /nfs/dbraw/zinc/95/44/31/1137954431.db2.gz KWASGUNPRFAHHO-YWZLYKJASA-N 1 1 339.483 3.506 20 10 EHCDMO CCOCCOCc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886503703 1138085341 /nfs/dbraw/zinc/08/53/41/1138085341.db2.gz AIVBTOVAWSYTIC-HNNXBMFYSA-N 1 1 347.430 3.935 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(N2CCOCC2)c1 ZINC000886538933 1138093082 /nfs/dbraw/zinc/09/30/82/1138093082.db2.gz QFSMLIACUOURPA-OAHLLOKOSA-N 1 1 344.430 3.527 20 10 EHCDMO Cc1noc(C[C@@H]([NH2+][C@H](C)c2c(O)cccc2F)c2ccccc2)n1 ZINC000886601265 1138100531 /nfs/dbraw/zinc/10/05/31/1138100531.db2.gz NUYPMFWNJNUDQT-MLGOLLRUSA-N 1 1 341.386 3.857 20 10 EHCDMO COCCOCc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886612411 1138102012 /nfs/dbraw/zinc/10/20/12/1138102012.db2.gz KSSIWDSCJYARGK-AWEZNQCLSA-N 1 1 333.403 3.545 20 10 EHCDMO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1c(O)cccc1F ZINC000886713346 1138123008 /nfs/dbraw/zinc/12/30/08/1138123008.db2.gz ZUWBRBCCIZIIQA-CABCVRRESA-N 1 1 337.435 3.548 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CC[C@H](CNc3ccccn3)C2)c(O)c1 ZINC000092812794 1138232069 /nfs/dbraw/zinc/23/20/69/1138232069.db2.gz IRIRSAMKDPIUHS-MRXNPFEDSA-N 1 1 341.455 3.510 20 10 EHCDMO COc1cccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)c1O ZINC000093342137 1138236457 /nfs/dbraw/zinc/23/64/57/1138236457.db2.gz JVYSWDOPGCJIRF-UHFFFAOYSA-N 1 1 341.451 3.830 20 10 EHCDMO CCC[N@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1O ZINC000174373410 1139417240 /nfs/dbraw/zinc/41/72/40/1139417240.db2.gz XMMXHPSEJSHCGM-UHFFFAOYSA-N 1 1 329.425 3.916 20 10 EHCDMO CCC[N@@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1O ZINC000174373410 1139417246 /nfs/dbraw/zinc/41/72/46/1139417246.db2.gz XMMXHPSEJSHCGM-UHFFFAOYSA-N 1 1 329.425 3.916 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000180282867 1139824408 /nfs/dbraw/zinc/82/44/08/1139824408.db2.gz KNDBHLHLTNCRRC-BSEYFRJRSA-N 1 1 347.480 3.721 20 10 EHCDMO C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1[O-] ZINC000185356737 1140146677 /nfs/dbraw/zinc/14/66/77/1140146677.db2.gz VLVPQJQEJNDIOD-LBPRGKRZSA-N 1 1 341.293 3.537 20 10 EHCDMO COCCCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000186154408 1140189725 /nfs/dbraw/zinc/18/97/25/1140189725.db2.gz SHIBWSZEMCAPIB-AWEZNQCLSA-N 1 1 333.403 3.797 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000186232148 1140193505 /nfs/dbraw/zinc/19/35/05/1140193505.db2.gz WCSRMWZJVHPHOR-MENVHETRSA-N 1 1 337.341 3.990 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)cc1OC ZINC000186869834 1140225948 /nfs/dbraw/zinc/22/59/48/1140225948.db2.gz VWMMOIOBQNEEAR-CQSZACIVSA-N 1 1 334.441 3.511 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2csc(C)n2)cc1OC ZINC000186869834 1140225952 /nfs/dbraw/zinc/22/59/52/1140225952.db2.gz VWMMOIOBQNEEAR-CQSZACIVSA-N 1 1 334.441 3.511 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2O)n1 ZINC000191823928 1140486949 /nfs/dbraw/zinc/48/69/49/1140486949.db2.gz KDHIOGSQSMGIJE-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@H+]2Cc2cccc(C)c2O)n1 ZINC000191823928 1140486953 /nfs/dbraw/zinc/48/69/53/1140486953.db2.gz KDHIOGSQSMGIJE-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2csc([C@@H](C)OC)n2)c(O)c1 ZINC000267596218 1140808323 /nfs/dbraw/zinc/80/83/23/1140808323.db2.gz CCUQMRKKHBGPGV-GFCCVEGCSA-N 1 1 336.457 3.635 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Br)cc2O)s1 ZINC000274144216 1141479597 /nfs/dbraw/zinc/47/95/97/1141479597.db2.gz DQUCZEYYTGZCFN-HTQZYQBOSA-N 1 1 342.262 3.726 20 10 EHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)c(O)cc1C ZINC000160179598 1014200492 /nfs/dbraw/zinc/20/04/92/1014200492.db2.gz SGGADOHEBRXUCQ-OAHLLOKOSA-N 1 1 332.469 3.984 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnc(C2CC2)s1)C[C@@H]1CCCO1 ZINC000160203276 1014356663 /nfs/dbraw/zinc/35/66/63/1014356663.db2.gz RMTBEXNUQOOUAP-INIZCTEOSA-N 1 1 344.480 3.907 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ncccc1Cl)C[C@@H]1CCCO1 ZINC000528417725 1032257599 /nfs/dbraw/zinc/25/75/99/1032257599.db2.gz IUDRWVWDFLOXDW-HNNXBMFYSA-N 1 1 332.831 3.622 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ncccc1Cl)C[C@@H]1CCCO1 ZINC000528417725 1032257613 /nfs/dbraw/zinc/25/76/13/1032257613.db2.gz IUDRWVWDFLOXDW-HNNXBMFYSA-N 1 1 332.831 3.622 20 10 EHCDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cc2c(cc1O)OCO2 ZINC000054547726 1033153461 /nfs/dbraw/zinc/15/34/61/1033153461.db2.gz CLNUOZILNOMUAN-UHFFFAOYSA-N 1 1 339.313 3.772 20 10 EHCDMO COc1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c(O)c1OC ZINC000892053700 1024499948 /nfs/dbraw/zinc/49/99/48/1024499948.db2.gz YCMSRUSEWDJGPM-KRWDZBQOSA-N 1 1 345.464 3.700 20 10 EHCDMO C[C@@H]1CC([NH2+]Cc2cccc(O)c2O)C[C@@H](C)N1Cc1ccccc1 ZINC001168029578 1024548482 /nfs/dbraw/zinc/54/84/82/1024548482.db2.gz TVAYILMKOLNEIF-HZPDHXFCSA-N 1 1 340.467 3.629 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)c(O)c1OC ZINC000895868914 1024926888 /nfs/dbraw/zinc/92/68/88/1024926888.db2.gz KTXTVGCSDROGPG-UHFFFAOYSA-N 1 1 326.396 3.523 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]Cc1cc(Cl)c2c(c1)OCCCO2 ZINC000896640253 1025795783 /nfs/dbraw/zinc/79/57/83/1025795783.db2.gz HRTNCLQIXZLRSV-UHFFFAOYSA-N 1 1 337.778 3.636 20 10 EHCDMO CCn1cnnc1C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000158449402 1025969795 /nfs/dbraw/zinc/96/97/95/1025969795.db2.gz HTVBLFPUDCHBNA-INIZCTEOSA-N 1 1 327.476 3.529 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc(F)cc1O ZINC000273396295 1027410963 /nfs/dbraw/zinc/41/09/63/1027410963.db2.gz LXGHHKWWXJRPIC-CQSZACIVSA-N 1 1 329.419 3.767 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OC)c(Cl)c2)c1 ZINC000273490682 1027454291 /nfs/dbraw/zinc/45/42/91/1027454291.db2.gz OGMQIAOSCBCADW-NSHDSACASA-N 1 1 349.814 3.692 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(Br)cc1O ZINC000273500950 1027462363 /nfs/dbraw/zinc/46/23/63/1027462363.db2.gz QCBOZNIIJVSEAG-ZANVPECISA-N 1 1 336.233 3.606 20 10 EHCDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107843 1027649469 /nfs/dbraw/zinc/64/94/69/1027649469.db2.gz ORQLGIBNZSJDNK-ZWKOTPCHSA-N 1 1 342.527 3.967 20 10 EHCDMO C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107843 1027649488 /nfs/dbraw/zinc/64/94/88/1027649488.db2.gz ORQLGIBNZSJDNK-ZWKOTPCHSA-N 1 1 342.527 3.967 20 10 EHCDMO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 ZINC000738107843 1027649544 /nfs/dbraw/zinc/64/95/44/1027649544.db2.gz ORQLGIBNZSJDNK-ZWKOTPCHSA-N 1 1 342.527 3.967 20 10 EHCDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 ZINC000738107843 1027649561 /nfs/dbraw/zinc/64/95/61/1027649561.db2.gz ORQLGIBNZSJDNK-ZWKOTPCHSA-N 1 1 342.527 3.967 20 10 EHCDMO CC[C@H](C[NH2+]Cc1ccc(N2CCN(C)CC2)cc1)CC(F)(F)F ZINC000840960082 1028062026 /nfs/dbraw/zinc/06/20/26/1028062026.db2.gz FBTKRHIYBZROSJ-HNNXBMFYSA-N 1 1 343.437 3.507 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000278293693 1030011968 /nfs/dbraw/zinc/01/19/68/1030011968.db2.gz BZDNBTVIGHPMKI-HNNXBMFYSA-N 1 1 342.395 3.821 20 10 EHCDMO c1cc(N2CCCCC2)ccc1CNC1CC[NH+](CC2CC2)CC1 ZINC001168352753 1030782549 /nfs/dbraw/zinc/78/25/49/1030782549.db2.gz CIAXGWOIPUYOJG-UHFFFAOYSA-N 1 1 327.516 3.641 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3ccccc3)cc2F)CC1 ZINC000173400526 1033302620 /nfs/dbraw/zinc/30/26/20/1033302620.db2.gz AHZYITNMRPONAT-KRWDZBQOSA-N 1 1 341.474 3.818 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC000323929860 1033980866 /nfs/dbraw/zinc/98/08/66/1033980866.db2.gz QGMGYOSIWZDGGZ-CYBMUJFWSA-N 1 1 333.325 3.897 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC000761201910 1034421123 /nfs/dbraw/zinc/42/11/23/1034421123.db2.gz IMXJOCOJTSVKFK-ZFWWWQNUSA-N 1 1 327.877 3.914 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C(C)C)C2CCOCC2)c1O ZINC000177268326 1034927164 /nfs/dbraw/zinc/92/71/64/1034927164.db2.gz CCKXRHKKTIVQNP-UHFFFAOYSA-N 1 1 325.836 3.638 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C(C)C)C2CCOCC2)c1O ZINC000177268326 1034927173 /nfs/dbraw/zinc/92/71/73/1034927173.db2.gz CCKXRHKKTIVQNP-UHFFFAOYSA-N 1 1 325.836 3.638 20 10 EHCDMO CCOC[C@H]1C[N@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000530106775 1034970200 /nfs/dbraw/zinc/97/02/00/1034970200.db2.gz NYVKCFNHBRUZFN-OAHLLOKOSA-N 1 1 341.407 3.529 20 10 EHCDMO CCOC[C@H]1C[N@@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000530106775 1034970211 /nfs/dbraw/zinc/97/02/11/1034970211.db2.gz NYVKCFNHBRUZFN-OAHLLOKOSA-N 1 1 341.407 3.529 20 10 EHCDMO CC(C)[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CCCC1 ZINC000324034814 1037298022 /nfs/dbraw/zinc/29/80/22/1037298022.db2.gz PQOFBISYQZLFIN-OAQYLSRUSA-N 1 1 329.532 3.887 20 10 EHCDMO C[N@H+](Cc1nc(-c2cccc(Cl)c2)no1)Cc1ccccc1O ZINC000109770707 1037682823 /nfs/dbraw/zinc/68/28/23/1037682823.db2.gz ZOTCLVQQUNADNA-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[N@@H+](Cc1nc(-c2cccc(Cl)c2)no1)Cc1ccccc1O ZINC000109770707 1037682832 /nfs/dbraw/zinc/68/28/32/1037682832.db2.gz ZOTCLVQQUNADNA-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@@H+](C)Cc1ccccc1O ZINC000111235461 1037730904 /nfs/dbraw/zinc/73/09/04/1037730904.db2.gz QCYCUUXABADUIZ-GOEBONIOSA-N 1 1 344.480 3.638 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)s2)c1 ZINC000756469820 1038862010 /nfs/dbraw/zinc/86/20/10/1038862010.db2.gz KJKTZGKOCSCAHA-VIFPVBQESA-N 1 1 325.817 3.745 20 10 EHCDMO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cccc(Br)c1O ZINC000760648048 1041055839 /nfs/dbraw/zinc/05/58/39/1041055839.db2.gz CNNUQCQRCFRMEN-VIFPVBQESA-N 1 1 326.156 3.975 20 10 EHCDMO C[N@H+](Cc1nc(-c2ccc(Cl)cc2)no1)Cc1ccccc1O ZINC000109772387 1041488421 /nfs/dbraw/zinc/48/84/21/1041488421.db2.gz AUFVYJWWWVJJTE-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[N@@H+](Cc1nc(-c2ccc(Cl)cc2)no1)Cc1ccccc1O ZINC000109772387 1041488426 /nfs/dbraw/zinc/48/84/26/1041488426.db2.gz AUFVYJWWWVJJTE-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(Cn2cccn2)cc1)c1ccc(F)cc1O ZINC000184920125 1126712977 /nfs/dbraw/zinc/71/29/77/1126712977.db2.gz NICACFSBJNBPPT-CQSZACIVSA-N 1 1 325.387 3.627 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cccnc1Cl)C[C@@H]1CCCO1 ZINC000171923043 1127629780 /nfs/dbraw/zinc/62/97/80/1127629780.db2.gz LJSSCUYDZQCUHI-INIZCTEOSA-N 1 1 332.831 3.622 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccnc1Cl)C[C@@H]1CCCO1 ZINC000171923043 1127629783 /nfs/dbraw/zinc/62/97/83/1127629783.db2.gz LJSSCUYDZQCUHI-INIZCTEOSA-N 1 1 332.831 3.622 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H]4OCCC[C@@H]4C3)c2c1 ZINC000129159386 1120142188 /nfs/dbraw/zinc/14/21/88/1120142188.db2.gz AGZCBVWEZFWRJR-FOIQADDNSA-N 1 1 327.424 3.555 20 10 EHCDMO Cc1ccccc1NC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074319 1122471671 /nfs/dbraw/zinc/47/16/71/1122471671.db2.gz XFWLZMHUBXRLIT-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO Cc1ccccc1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074319 1122471675 /nfs/dbraw/zinc/47/16/75/1122471675.db2.gz XFWLZMHUBXRLIT-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000179696288 1123821897 /nfs/dbraw/zinc/82/18/97/1123821897.db2.gz SGXNKEPIOLNGKW-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CCCC[C@](C)(F)C2)c(Br)c1 ZINC001237064354 1125257872 /nfs/dbraw/zinc/25/78/72/1125257872.db2.gz HTNSHMBUSHBOMZ-HNNXBMFYSA-N 1 1 346.240 3.877 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@](C)(F)C2)c(Br)c1 ZINC001237064354 1125257874 /nfs/dbraw/zinc/25/78/74/1125257874.db2.gz HTNSHMBUSHBOMZ-HNNXBMFYSA-N 1 1 346.240 3.877 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC3(CCCC3)C2)c(Br)c1 ZINC001237072856 1125262729 /nfs/dbraw/zinc/26/27/29/1125262729.db2.gz LQXVZQSTVXSIKE-UHFFFAOYSA-N 1 1 340.261 3.929 20 10 EHCDMO CCC[N@@H+](CC(=O)N(C)C1CCC(C)CC1)Cc1ccccc1O ZINC000727831274 1130597828 /nfs/dbraw/zinc/59/78/28/1130597828.db2.gz SLFMMRWDUGWHGE-UHFFFAOYSA-N 1 1 332.488 3.641 20 10 EHCDMO COC[C@@H]1CCC[N@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000733196611 1131003366 /nfs/dbraw/zinc/00/33/66/1131003366.db2.gz DXTWHCOHXUNDIM-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1 ZINC000733196611 1131003368 /nfs/dbraw/zinc/00/33/68/1131003368.db2.gz DXTWHCOHXUNDIM-GOSISDBHSA-N 1 1 340.467 3.635 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@](C)(O)c2ccccc2)cc1 ZINC000738298265 1131467226 /nfs/dbraw/zinc/46/72/26/1131467226.db2.gz GZYDFPISXVKHKH-OAQYLSRUSA-N 1 1 326.484 3.872 20 10 EHCDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1C ZINC000741725177 1131637316 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GILYWLCDTGFSDY-UHFFFAOYSA-N 1 1 346.858 3.767 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@H]2CCCS2)c1 ZINC001179275093 1133242727 /nfs/dbraw/zinc/24/27/27/1133242727.db2.gz ZIOVQTGZZMUBEE-GFCCVEGCSA-N 1 1 330.291 3.838 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c(O)c1 ZINC000769242887 1133244118 /nfs/dbraw/zinc/24/41/18/1133244118.db2.gz LYXRHKWGNPSCLW-FPOVZHCZSA-N 1 1 341.451 3.879 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c1 ZINC000769238696 1133249208 /nfs/dbraw/zinc/24/92/08/1133249208.db2.gz GRNIISQHOBDQEM-FPOVZHCZSA-N 1 1 341.451 3.879 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1F ZINC000769380571 1133272852 /nfs/dbraw/zinc/27/28/52/1133272852.db2.gz GQHHKMMCHVWSEO-HOTGVXAUSA-N 1 1 348.384 3.560 20 10 EHCDMO CN(C)c1ccc(CNCC[N@@H+]2CCC(C)(C)C2)c(C(F)(F)F)c1 ZINC001179768719 1133277273 /nfs/dbraw/zinc/27/72/73/1133277273.db2.gz UJUIEUHULSSGFK-UHFFFAOYSA-N 1 1 343.437 3.593 20 10 EHCDMO CN(C)c1ccc(CNCC[N@H+]2CCC(C)(C)C2)c(C(F)(F)F)c1 ZINC001179768719 1133277278 /nfs/dbraw/zinc/27/72/78/1133277278.db2.gz UJUIEUHULSSGFK-UHFFFAOYSA-N 1 1 343.437 3.593 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000773823680 1133279123 /nfs/dbraw/zinc/27/91/23/1133279123.db2.gz UZDJYQFYCNLRJX-KRWDZBQOSA-N 1 1 339.487 3.518 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000773823680 1133279127 /nfs/dbraw/zinc/27/91/27/1133279127.db2.gz UZDJYQFYCNLRJX-KRWDZBQOSA-N 1 1 339.487 3.518 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000773823680 1133279132 /nfs/dbraw/zinc/27/91/32/1133279132.db2.gz UZDJYQFYCNLRJX-KRWDZBQOSA-N 1 1 339.487 3.518 20 10 EHCDMO OCCC[N@@H+](Cc1cc(Cl)ccc1O)[C@@H]1CCc2ccccc21 ZINC000769427492 1133283954 /nfs/dbraw/zinc/28/39/54/1133283954.db2.gz WLFWREHNFKHQTQ-GOSISDBHSA-N 1 1 331.843 3.918 20 10 EHCDMO CC(C)OC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769462955 1133296352 /nfs/dbraw/zinc/29/63/52/1133296352.db2.gz 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CCC(CC)NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000862023748 1137127376 /nfs/dbraw/zinc/12/73/76/1137127376.db2.gz KJHMTCBOXNNRJS-KRWDZBQOSA-N 1 1 345.531 3.802 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000862331149 1137138395 /nfs/dbraw/zinc/13/83/95/1137138395.db2.gz GUPVOZHKLCAQGM-ZDUSSCGKSA-N 1 1 340.261 3.546 20 10 EHCDMO Cc1c(Br)cncc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000824474366 1137138869 /nfs/dbraw/zinc/13/88/69/1137138869.db2.gz NOUGZIGTAFXJSM-UHFFFAOYSA-N 1 1 348.288 3.851 20 10 EHCDMO CC[N@@H+](Cc1cc(F)c(N(C)C)cc1F)[C@H]1CCOC(C)(C)C1 ZINC000862370684 1137141047 /nfs/dbraw/zinc/14/10/47/1137141047.db2.gz QDMBJVRBQRSNMC-AWEZNQCLSA-N 1 1 326.431 3.810 20 10 EHCDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000824582574 1137145451 /nfs/dbraw/zinc/14/54/51/1137145451.db2.gz AQSRWGROILUKCC-OAQYLSRUSA-N 1 1 341.451 3.830 20 10 EHCDMO CCC[N@@H+](Cc1ccc(O[C@@H]2CCOC2)cc1)Cc1ccccc1O ZINC000824649624 1137145938 /nfs/dbraw/zinc/14/59/38/1137145938.db2.gz GHHKXZPEWDCJSA-HXUWFJFHSA-N 1 1 341.451 3.972 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c(O)c1 ZINC000824690770 1137148563 /nfs/dbraw/zinc/14/85/63/1137148563.db2.gz LIJZFYAXLLHLII-KRWDZBQOSA-N 1 1 335.831 3.610 20 10 EHCDMO C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(Br)cc2[O-])c1 ZINC000825421869 1137177365 /nfs/dbraw/zinc/17/73/65/1137177365.db2.gz HNNUPWSAAWHDQF-UHFFFAOYSA-N 1 1 349.272 3.506 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3cc(Cl)cc(OC)c3)CC2)cc1 ZINC001144478551 1137298093 /nfs/dbraw/zinc/29/80/93/1137298093.db2.gz JHNDHMUEWIRWEJ-UHFFFAOYSA-N 1 1 346.858 3.679 20 10 EHCDMO CN(C)c1ccc(/C=C/CN2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cc1 ZINC000846066938 1137332629 /nfs/dbraw/zinc/33/26/29/1137332629.db2.gz JPZODFYKXWINLP-BWAMLYQTSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+]2CCN(C)C[C@H]2Cc2ccccc2)cc1 ZINC000846066938 1137332630 /nfs/dbraw/zinc/33/26/30/1137332630.db2.gz JPZODFYKXWINLP-BWAMLYQTSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCN(C)C[C@H]2Cc2ccccc2)cc1 ZINC000846066938 1137332632 /nfs/dbraw/zinc/33/26/32/1137332632.db2.gz JPZODFYKXWINLP-BWAMLYQTSA-N 1 1 349.522 3.625 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 ZINC000846119268 1137334172 /nfs/dbraw/zinc/33/41/72/1137334172.db2.gz GVYNMLNWJXKUEX-JBACZVJFSA-N 1 1 339.435 3.895 20 10 EHCDMO CCCC[N@@H+](C)CCNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C ZINC001144940687 1137366125 /nfs/dbraw/zinc/36/61/25/1137366125.db2.gz CILFVLSMHDREBG-UHFFFAOYSA-N 1 1 341.499 3.864 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCC3CCOCC3)c2c1 ZINC000121123919 1137367396 /nfs/dbraw/zinc/36/73/96/1137367396.db2.gz AOZULKCYEGKMKI-UHFFFAOYSA-N 1 1 329.440 3.803 20 10 EHCDMO CCC[N@H+]1CCCC[C@H]1C(=O)NCc1ccc(N(CC)CC)c(F)c1 ZINC001144978528 1137377381 /nfs/dbraw/zinc/37/73/81/1137377381.db2.gz RHLJNNILZSTSEX-IBGZPJMESA-N 1 1 349.494 3.553 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000773257096 1137481979 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338.167 3.927 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)cc1Cl ZINC000825752455 1137624874 /nfs/dbraw/zinc/62/48/74/1137624874.db2.gz AWLOQQVQACJIEM-SUNYJGFJSA-N 1 1 339.863 3.512 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)Cc2ccccc21 ZINC000876544839 1137655030 /nfs/dbraw/zinc/65/50/30/1137655030.db2.gz YTZPSEBAEJCZTK-KRWDZBQOSA-N 1 1 336.479 3.767 20 10 EHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876766162 1137660808 /nfs/dbraw/zinc/66/08/08/1137660808.db2.gz CURVBZUAKZFJKX-QGZVFWFLSA-N 1 1 336.479 3.595 20 10 EHCDMO CN(C(=O)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1)c1ccc(N)cc1 ZINC000877074339 1137669535 /nfs/dbraw/zinc/66/95/35/1137669535.db2.gz HOMCEMSFGSPLMY-GOSISDBHSA-N 1 1 343.858 3.550 20 10 EHCDMO CN(C(=O)[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1)c1ccc(N)cc1 ZINC000877074339 1137669536 /nfs/dbraw/zinc/66/95/36/1137669536.db2.gz HOMCEMSFGSPLMY-GOSISDBHSA-N 1 1 343.858 3.550 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@H]2CCCC[C@H]12 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3.685 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H](c1cccs1)N1CCCC1 ZINC000882878796 1137836457 /nfs/dbraw/zinc/83/64/57/1137836457.db2.gz SPJSUNQXGWAJTK-HNNXBMFYSA-N 1 1 338.423 3.659 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000882911588 1137837843 /nfs/dbraw/zinc/83/78/43/1137837843.db2.gz XQPMEPOPVUEAQK-GOSISDBHSA-N 1 1 347.361 3.683 20 10 EHCDMO C[C@H](Nc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1)c1ccccc1O ZINC000883347825 1137856814 /nfs/dbraw/zinc/85/68/14/1137856814.db2.gz ZTLDKCZHWHKLFV-LPHOPBHVSA-N 1 1 337.467 3.850 20 10 EHCDMO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000883384276 1137858774 /nfs/dbraw/zinc/85/87/74/1137858774.db2.gz OEVDBMAATFBINJ-RTWAWAEBSA-N 1 1 340.442 3.638 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2ncccc2c1 ZINC000121305480 1137956776 /nfs/dbraw/zinc/95/67/76/1137956776.db2.gz WFTYRCMEYAKLCE-UHFFFAOYSA-N 1 1 347.462 3.703 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@@H](C)c1c(O)cccc1F)O[C@H](C)C2 ZINC000886500317 1138084582 /nfs/dbraw/zinc/08/45/82/1138084582.db2.gz PEAZLYJQPUURRW-NEPJUHHUSA-N 1 1 331.387 3.714 20 10 EHCDMO COc1ccc(N2CCC([NH2+][C@H](C)c3c(O)cccc3F)CC2)cc1 ZINC000886520453 1138088893 /nfs/dbraw/zinc/08/88/93/1138088893.db2.gz FFKFTSPNPZLVRJ-CQSZACIVSA-N 1 1 344.430 3.860 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(N2CCOCC2)c1 ZINC000886538932 1138093202 /nfs/dbraw/zinc/09/32/02/1138093202.db2.gz QFSMLIACUOURPA-HNNXBMFYSA-N 1 1 344.430 3.527 20 10 EHCDMO CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)NC(=O)OC(C)(C)C ZINC000301809246 1138650957 /nfs/dbraw/zinc/65/09/57/1138650957.db2.gz FSTQPOCPEINSMU-IUODEOHRSA-N 1 1 340.439 3.731 20 10 EHCDMO COc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)ccn1 ZINC000192646464 1140541752 /nfs/dbraw/zinc/54/17/52/1140541752.db2.gz QKFUNMRBBJUTQP-VIFPVBQESA-N 1 1 327.211 3.953 20 10 EHCDMO C[C@H]([NH2+]CCC(=O)N1CCCCC1)c1cc(Cl)c(Cl)cc1O ZINC000192693163 1140544320 /nfs/dbraw/zinc/54/43/20/1140544320.db2.gz UBHKQMAZDGRRBA-NSHDSACASA-N 1 1 345.270 3.752 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](COC)c2ccc(CC)o2)ccc1OC ZINC000266184738 1140652511 /nfs/dbraw/zinc/65/25/11/1140652511.db2.gz WNKOCURHKXBFLY-SFHVURJKSA-N 1 1 347.455 3.864 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1OC ZINC000271055386 1141301309 /nfs/dbraw/zinc/30/13/09/1141301309.db2.gz ADLQXNRCHUGJDW-CYBMUJFWSA-N 1 1 331.387 3.538 20 10 EHCDMO COc1ccc2c(c1)CC[N@@H+](Cc1c(O)cccc1Br)C2 ZINC001140099181 1016728641 /nfs/dbraw/zinc/72/86/41/1016728641.db2.gz ZEEXFLQGMKPHLY-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc2c(c1)CC[N@H+](Cc1c(O)cccc1Br)C2 ZINC001140099181 1016728652 /nfs/dbraw/zinc/72/86/52/1016728652.db2.gz ZEEXFLQGMKPHLY-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+](Cc1ccco1)Cc1ccccc1)OCO2 ZINC000162215213 1032541169 /nfs/dbraw/zinc/54/11/69/1032541169.db2.gz KSHFINIOBSWDHW-UHFFFAOYSA-N 1 1 337.375 3.916 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857714 1020074662 /nfs/dbraw/zinc/07/46/62/1020074662.db2.gz JHERGUYJBIHTRT-WDSOQIARSA-N 1 1 334.504 3.570 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(Br)cc(C)c2O)C[C@H](CC)O1 ZINC000398744116 1021150658 /nfs/dbraw/zinc/15/06/58/1021150658.db2.gz SJPCLEJGBQLZTB-GASCZTMLSA-N 1 1 342.277 3.853 20 10 EHCDMO CC[C@@H]1C[N@H+](Cc2cc(Br)cc(C)c2O)C[C@H](CC)O1 ZINC000398744116 1021150661 /nfs/dbraw/zinc/15/06/61/1021150661.db2.gz SJPCLEJGBQLZTB-GASCZTMLSA-N 1 1 342.277 3.853 20 10 EHCDMO COc1ccc(N2CCC[N@H+]([C@@H](C)Cc3ccsc3)CC2)cc1 ZINC000783434313 1021949563 /nfs/dbraw/zinc/94/95/63/1021949563.db2.gz TZPLOIXRHXWIIM-INIZCTEOSA-N 1 1 330.497 3.900 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2[O-])CC1(C)C ZINC000894905144 1022127743 /nfs/dbraw/zinc/12/77/43/1022127743.db2.gz SMRXTHNUDLRYTC-CYBMUJFWSA-N 1 1 346.240 3.541 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(F)cc1O ZINC000796714922 1022241499 /nfs/dbraw/zinc/24/14/99/1022241499.db2.gz DJVYFPHTUSHWSE-SFHVURJKSA-N 1 1 325.387 3.958 20 10 EHCDMO COc1cc(C[N@@H+](Cc2cc(F)cc(F)c2[O-])C2CC2)ccc1O ZINC000894491561 1022400955 /nfs/dbraw/zinc/40/09/55/1022400955.db2.gz PBKUKOIWGZIWHM-UHFFFAOYSA-N 1 1 335.350 3.549 20 10 EHCDMO COc1cc(C[N@@H+](Cc2cc(F)cc(F)c2O)C2CC2)ccc1O ZINC000894491561 1022400961 /nfs/dbraw/zinc/40/09/61/1022400961.db2.gz PBKUKOIWGZIWHM-UHFFFAOYSA-N 1 1 335.350 3.549 20 10 EHCDMO CC(C)OC(=O)C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000894780201 1022904822 /nfs/dbraw/zinc/90/48/22/1022904822.db2.gz ZLWRQAMDEVMBBR-KRWDZBQOSA-N 1 1 349.377 3.843 20 10 EHCDMO Cc1noc(C[C@H]([NH2+][C@H](C)c2ccc(F)cc2O)c2ccccc2)n1 ZINC000277213617 1024226783 /nfs/dbraw/zinc/22/67/83/1024226783.db2.gz WXZXAXFJDYAIBO-PXAZEXFGSA-N 1 1 341.386 3.857 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1(c2ccc3c(c2)OCCO3)CC1 ZINC000897862772 1033212086 /nfs/dbraw/zinc/21/20/86/1033212086.db2.gz QLUYGKMWEMPBTK-UHFFFAOYSA-N 1 1 349.789 3.735 20 10 EHCDMO COC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)c1ccco1 ZINC000281039066 1024585128 /nfs/dbraw/zinc/58/51/28/1024585128.db2.gz ZFCJOGJFJJADET-HNNXBMFYSA-N 1 1 342.361 3.842 20 10 EHCDMO Cc1ccc(CNc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)c(O)c1 ZINC000895647578 1024679619 /nfs/dbraw/zinc/67/96/19/1024679619.db2.gz QRPMBRTXIMEUEO-HXUWFJFHSA-N 1 1 337.467 3.597 20 10 EHCDMO Cc1nc([C@H]2CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)no1 ZINC000896239798 1025281255 /nfs/dbraw/zinc/28/12/55/1025281255.db2.gz LVJBYDSPLRVKJM-KRWDZBQOSA-N 1 1 335.407 3.740 20 10 EHCDMO CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Br)ccc1[O-] ZINC000020129063 1025774563 /nfs/dbraw/zinc/77/45/63/1025774563.db2.gz CXBOXAMCDFLSQF-HNNXBMFYSA-N 1 1 341.293 3.681 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCOc3ccccc32)c1 ZINC000273368938 1027397366 /nfs/dbraw/zinc/39/73/66/1027397366.db2.gz CBZAMABDJBXYLK-CXAGYDPISA-N 1 1 341.407 3.743 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2OC)c1 ZINC000273417907 1027419871 /nfs/dbraw/zinc/41/98/71/1027419871.db2.gz REUYHTZNRZWUKJ-NEPJUHHUSA-N 1 1 347.386 3.738 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(Br)cc1O ZINC000273500946 1027462813 /nfs/dbraw/zinc/46/28/13/1027462813.db2.gz QCBOZNIIJVSEAG-RNCFNFMXSA-N 1 1 336.233 3.606 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)c1O ZINC000162540970 1028955454 /nfs/dbraw/zinc/95/54/54/1028955454.db2.gz XWMDVOIQCAQQNS-INIZCTEOSA-N 1 1 341.407 3.509 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@H]2C[C@@H](O)c2ccco2)c1 ZINC000271770766 1029161902 /nfs/dbraw/zinc/16/19/02/1029161902.db2.gz GEIDMDHOUNZVNO-QFBILLFUSA-N 1 1 345.439 3.862 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000271902564 1029222964 /nfs/dbraw/zinc/22/29/64/1029222964.db2.gz ZNONPKKJRPGOOX-YOEHRIQHSA-N 1 1 333.453 3.550 20 10 EHCDMO COC(=O)[C@H](C)C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000780893051 1033842127 /nfs/dbraw/zinc/84/21/27/1033842127.db2.gz MJDSZZNIOLBXTK-OAHLLOKOSA-N 1 1 339.435 3.833 20 10 EHCDMO CC(C)c1cc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)on1 ZINC000169287656 1034239421 /nfs/dbraw/zinc/23/94/21/1034239421.db2.gz BWEPQTZVGCKFJA-CQSZACIVSA-N 1 1 347.434 3.625 20 10 EHCDMO Cc1cc(Cl)ccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000171936621 1034723518 /nfs/dbraw/zinc/72/35/18/1034723518.db2.gz RCUKCQZQQAGKMQ-ZDUSSCGKSA-N 1 1 332.831 3.813 20 10 EHCDMO CC(C)(C)c1ncc2c(n1)CC[N@@H+](Cc1cc3c(cc1O)CCC3)C2 ZINC000530102563 1034965696 /nfs/dbraw/zinc/96/56/96/1034965696.db2.gz OWAJYKYTIVOCGJ-UHFFFAOYSA-N 1 1 337.467 3.527 20 10 EHCDMO CC(C)(C)c1ncc2c(n1)CC[N@H+](Cc1cc3c(cc1O)CCC3)C2 ZINC000530102563 1034965701 /nfs/dbraw/zinc/96/57/01/1034965701.db2.gz OWAJYKYTIVOCGJ-UHFFFAOYSA-N 1 1 337.467 3.527 20 10 EHCDMO Cc1c(O)ccc(C[N@@H+]2CCc3c(Br)cccc3C2)c1O ZINC001140749065 1035023840 /nfs/dbraw/zinc/02/38/40/1035023840.db2.gz PXWGFQHXUZCSAR-UHFFFAOYSA-N 1 1 348.240 3.727 20 10 EHCDMO Cc1c(O)ccc(C[N@H+]2CCc3c(Br)cccc3C2)c1O ZINC001140749065 1035023847 /nfs/dbraw/zinc/02/38/47/1035023847.db2.gz PXWGFQHXUZCSAR-UHFFFAOYSA-N 1 1 348.240 3.727 20 10 EHCDMO C[C@@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000157609779 1037754343 /nfs/dbraw/zinc/75/43/43/1037754343.db2.gz ZTGXUXJHUOFQPC-XLIONFOSSA-N 1 1 327.516 3.812 20 10 EHCDMO C[C@@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000157609779 1037754361 /nfs/dbraw/zinc/75/43/61/1037754361.db2.gz ZTGXUXJHUOFQPC-XLIONFOSSA-N 1 1 327.516 3.812 20 10 EHCDMO Cc1nc([C@H](C)[NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(C)s1 ZINC000898450434 1039046810 /nfs/dbraw/zinc/04/68/10/1039046810.db2.gz RIPSGSYACHRNAM-UGSOOPFHSA-N 1 1 346.544 3.779 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000894085539 1040042006 /nfs/dbraw/zinc/04/20/06/1040042006.db2.gz PENZMSONISHOHM-BSEYFRJRSA-N 1 1 347.480 3.640 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164230541 1041225304 /nfs/dbraw/zinc/22/53/04/1041225304.db2.gz MXFUDQSGDMNJKF-DLBZAZTESA-N 1 1 332.488 3.526 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(F)cc1O ZINC000310090607 1041313961 /nfs/dbraw/zinc/31/39/61/1041313961.db2.gz QSYCTGNHKPXGET-DOXZYTNZSA-N 1 1 328.431 3.845 20 10 EHCDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1ccc(N2CCOCC2)cc1 ZINC000178510929 1042881075 /nfs/dbraw/zinc/88/10/75/1042881075.db2.gz NLAWBSONHQNIHR-UHFFFAOYSA-N 1 1 336.435 3.901 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000278951968 1043073157 /nfs/dbraw/zinc/07/31/57/1043073157.db2.gz ZPEOFQOHVATOKA-MRXNPFEDSA-N 1 1 330.384 3.796 20 10 EHCDMO Cc1cc(N(Cc2ccco2)Cc2ccc(N(C)C)cc2)nc(C)[nH+]1 ZINC000780558429 1125767865 /nfs/dbraw/zinc/76/78/65/1125767865.db2.gz OWAOTWCJUFXFQW-UHFFFAOYSA-N 1 1 336.439 3.959 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1C ZINC000734481551 1131239472 /nfs/dbraw/zinc/23/94/72/1131239472.db2.gz VPDWIJQIQUYMST-LJQANCHMSA-N 1 1 338.451 3.636 20 10 EHCDMO Cc1cc(CC[NH2+][C@H]2CCN(C)[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716041 1127525571 /nfs/dbraw/zinc/52/55/71/1127525571.db2.gz GOMITFPOVOSDHR-JXFKEZNVSA-N 1 1 325.500 3.709 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@@H](C)C1 ZINC000282127333 1121865356 /nfs/dbraw/zinc/86/53/56/1121865356.db2.gz BFCVKGOJXZXKAU-QFBILLFUSA-N 1 1 341.451 3.971 20 10 EHCDMO CC(C)[N@H+](Cc1nc(-c2ccco2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074881 1122472228 /nfs/dbraw/zinc/47/22/28/1122472228.db2.gz JRWKDCSKORBTSF-UHFFFAOYSA-N 1 1 340.427 3.806 20 10 EHCDMO CC(C)[N@@H+](Cc1nc(-c2ccco2)no1)Cc1ccc(N(C)C)cc1 ZINC000917074881 1122472233 /nfs/dbraw/zinc/47/22/33/1122472233.db2.gz JRWKDCSKORBTSF-UHFFFAOYSA-N 1 1 340.427 3.806 20 10 EHCDMO CC[N@H+](CC(=O)Nc1ccccc1OC)Cc1cc(Cl)ccc1O ZINC000154860161 1122952655 /nfs/dbraw/zinc/95/26/55/1122952655.db2.gz JTDUCEVUFDCALT-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1ccccc1OC)Cc1cc(Cl)ccc1O ZINC000154860161 1122952658 /nfs/dbraw/zinc/95/26/58/1122952658.db2.gz JTDUCEVUFDCALT-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c1O ZINC000175567627 1123725686 /nfs/dbraw/zinc/72/56/86/1123725686.db2.gz GPEVJJIFBMGROL-UHFFFAOYSA-N 1 1 341.382 3.729 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1O ZINC000175567627 1123725690 /nfs/dbraw/zinc/72/56/90/1123725690.db2.gz GPEVJJIFBMGROL-UHFFFAOYSA-N 1 1 341.382 3.729 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000179804713 1123863654 /nfs/dbraw/zinc/86/36/54/1123863654.db2.gz CLIIEUXEEDHMJN-UHFFFAOYSA-N 1 1 325.408 3.786 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000922542457 1129568862 /nfs/dbraw/zinc/56/88/62/1129568862.db2.gz VVFNLKJZYJHODP-LLVKDONJSA-N 1 1 335.354 3.790 20 10 EHCDMO C[N@@H+](Cc1ccccc1)C1CCN(Cc2c(O)cccc2F)CC1 ZINC001137837482 1130521699 /nfs/dbraw/zinc/52/16/99/1130521699.db2.gz IUVXHNJQYMMWEZ-UHFFFAOYSA-N 1 1 328.431 3.628 20 10 EHCDMO CCN(CC)c1ccc(CNC(=O)[C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC000731373527 1130792032 /nfs/dbraw/zinc/79/20/32/1130792032.db2.gz KPANOHZIMMKLET-OWCLPIDISA-N 1 1 349.494 3.549 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nc(-c2ccco2)no1)C1CCCC1 ZINC000731846417 1130849433 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C[C@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)[C@H](c2ccccc2)CO1 ZINC000743407041 1131916675 /nfs/dbraw/zinc/91/66/75/1131916675.db2.gz PTIVFUFBERTFNI-YWZLYKJASA-N 1 1 334.419 3.902 20 10 EHCDMO N=c1ccc(/N=N/c2ccccc2)c(N)n1-c1ccc2[nH+]ccn2c1 ZINC001174277334 1132310142 /nfs/dbraw/zinc/31/01/42/1132310142.db2.gz RKVBPHCLLOGNPE-GFIZNMFYSA-N 1 1 329.367 3.602 20 10 EHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)c1O ZINC000768132664 1133100060 /nfs/dbraw/zinc/10/00/60/1133100060.db2.gz IDZXVQHSWZMFHT-UHFFFAOYSA-N 1 1 328.456 3.879 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cncc2ccccc21 ZINC000768207324 1133107813 /nfs/dbraw/zinc/10/78/13/1133107813.db2.gz CMRXAEZLCHYKLP-UHFFFAOYSA-N 1 1 347.462 3.703 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2cn3cccc(F)c3n2)C2CC2)cc1 ZINC000768256938 1133117420 /nfs/dbraw/zinc/11/74/20/1133117420.db2.gz GGOOGJFGEVSEGT-UHFFFAOYSA-N 1 1 338.430 3.704 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cn3cccc(F)c3n2)C2CC2)cc1 ZINC000768256938 1133117422 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COc1ccc(N2CCC[N@H+](Cc3c(F)cccc3F)CC2)cc1 ZINC000768999464 1133218962 /nfs/dbraw/zinc/21/89/62/1133218962.db2.gz XPUFHGMXUZHMOC-UHFFFAOYSA-N 1 1 332.394 3.686 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3c(F)cccc3F)CC2)cc1 ZINC000768999464 1133218966 /nfs/dbraw/zinc/21/89/66/1133218966.db2.gz XPUFHGMXUZHMOC-UHFFFAOYSA-N 1 1 332.394 3.686 20 10 EHCDMO Fc1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)ccc1N1CCOCC1 ZINC000769005338 1133219746 /nfs/dbraw/zinc/21/97/46/1133219746.db2.gz BMUVBCCEINIIPH-LJQANCHMSA-N 1 1 332.463 3.817 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H](O)c1cccc2ccccc21 ZINC001179123044 1133230169 /nfs/dbraw/zinc/23/01/69/1133230169.db2.gz LQXOALODRXDWBF-GOSISDBHSA-N 1 1 329.346 3.647 20 10 EHCDMO CCCc1ccc([C@H](C)[N@@H+](CC(N)=O)Cc2cc(C)ccc2O)cc1 ZINC000769103743 1133232426 /nfs/dbraw/zinc/23/24/26/1133232426.db2.gz BOUBIULQXHWJAE-INIZCTEOSA-N 1 1 340.467 3.702 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@H](C)[C@H]2C)c1O ZINC000769222261 1133245988 /nfs/dbraw/zinc/24/59/88/1133245988.db2.gz FZPVPJCSNYVICQ-WDEREUQCSA-N 1 1 328.250 3.784 20 10 EHCDMO COc1cccc(O)c1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000769398827 1133275921 /nfs/dbraw/zinc/27/59/21/1133275921.db2.gz JVBAHBJMFFGGFL-UHFFFAOYSA-N 1 1 341.451 3.830 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1O ZINC000769425480 1133282512 /nfs/dbraw/zinc/28/25/12/1133282512.db2.gz IAQNXSHZZCETIO-TXEJJXNPSA-N 1 1 340.261 3.785 20 10 EHCDMO Fc1cccc([C@H]2CC[N@@H+]2Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000769507597 1133305176 /nfs/dbraw/zinc/30/51/76/1133305176.db2.gz MQHLKMCYCQNYCS-LJQANCHMSA-N 1 1 344.405 3.748 20 10 EHCDMO Fc1cccc([C@H]2CC[N@H+]2Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000769507597 1133305179 /nfs/dbraw/zinc/30/51/79/1133305179.db2.gz MQHLKMCYCQNYCS-LJQANCHMSA-N 1 1 344.405 3.748 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC001179906513 1133305545 /nfs/dbraw/zinc/30/55/45/1133305545.db2.gz XGMIOWRLZZBHKG-IYZQMXKPSA-N 1 1 348.490 3.940 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC001179906513 1133305549 /nfs/dbraw/zinc/30/55/49/1133305549.db2.gz XGMIOWRLZZBHKG-IYZQMXKPSA-N 1 1 348.490 3.940 20 10 EHCDMO COc1cccc(C[NH+]2CC(OCc3cccc4ccccc43)C2)c1O ZINC000769550982 1133313242 /nfs/dbraw/zinc/31/32/42/1133313242.db2.gz KDRHYIRDTWSVHI-UHFFFAOYSA-N 1 1 349.430 3.955 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000769777097 1133340367 /nfs/dbraw/zinc/34/03/67/1133340367.db2.gz MWKVBCQWUUZGAP-NRFANRHFSA-N 1 1 332.403 3.572 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CC[C@H](C(C)C)C2)c1O ZINC000770305657 1133409353 /nfs/dbraw/zinc/40/93/53/1133409353.db2.gz GZBRFPJMZAVNIT-NSHDSACASA-N 1 1 328.250 3.641 20 10 EHCDMO Cn1cc(Br)cc1C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000770324396 1133411473 /nfs/dbraw/zinc/41/14/73/1133411473.db2.gz NHWUQNCRJMOCRE-UHFFFAOYSA-N 1 1 343.652 3.779 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1F ZINC000770376690 1133415447 /nfs/dbraw/zinc/41/54/47/1133415447.db2.gz XBNMBRNOWBKUJD-ROUUACIJSA-N 1 1 334.479 3.920 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@@]2(C)CO)cc1 ZINC001180917522 1133428395 /nfs/dbraw/zinc/42/83/95/1133428395.db2.gz VHQCKVTWISJXDQ-IBGZPJMESA-N 1 1 330.497 3.731 20 10 EHCDMO CC(C)[C@@H](CC[N@@H+](C)Cc1ccccc1O)NC(=O)OC(C)(C)C ZINC000770504474 1133435871 /nfs/dbraw/zinc/43/58/71/1133435871.db2.gz GXYFZNZVRNFAKB-MRXNPFEDSA-N 1 1 336.476 3.763 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000771924558 1133610301 /nfs/dbraw/zinc/61/03/01/1133610301.db2.gz NXRJAVUIRWPNHO-UHFFFAOYSA-N 1 1 339.391 3.902 20 10 EHCDMO CC[C@H](CCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC001182892531 1133745051 /nfs/dbraw/zinc/74/50/51/1133745051.db2.gz VSQOISQNRIEKJN-MRXNPFEDSA-N 1 1 344.411 3.810 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@@H+]2CCn3nc(C(C)(C)C)cc3C2)cc1 ZINC001184106274 1133893882 /nfs/dbraw/zinc/89/38/82/1133893882.db2.gz LWNACLPINQJSLP-SREVYHEPSA-N 1 1 338.499 3.776 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCn3nc(C(C)(C)C)cc3C2)cc1 ZINC001184106274 1133893889 /nfs/dbraw/zinc/89/38/89/1133893889.db2.gz LWNACLPINQJSLP-SREVYHEPSA-N 1 1 338.499 3.776 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc4cnccc4c3)CC2)cc1 ZINC000787127134 1133962403 /nfs/dbraw/zinc/96/24/03/1133962403.db2.gz IIFKOHSSRCWVHV-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO COc1cccc(C[N@@H+](Cc2ccccc2)C2CCOCC2)c1O ZINC001203595766 1133982085 /nfs/dbraw/zinc/98/20/85/1133982085.db2.gz KOKTZNYOHJZZMB-UHFFFAOYSA-N 1 1 327.424 3.582 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774834091 1134035568 /nfs/dbraw/zinc/03/55/68/1134035568.db2.gz AKBPNDWAXXQHEX-CYBMUJFWSA-N 1 1 330.384 3.810 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774834091 1134035573 /nfs/dbraw/zinc/03/55/73/1134035573.db2.gz AKBPNDWAXXQHEX-CYBMUJFWSA-N 1 1 330.384 3.810 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000774910132 1134117689 /nfs/dbraw/zinc/11/76/89/1134117689.db2.gz UCGBOTQRKPGKDL-UHFFFAOYSA-N 1 1 342.351 3.687 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774951221 1134146175 /nfs/dbraw/zinc/14/61/75/1134146175.db2.gz FBTCFCLNWFMIJA-MRXNPFEDSA-N 1 1 348.374 3.935 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000775008030 1134205451 /nfs/dbraw/zinc/20/54/51/1134205451.db2.gz RKUJGRKQFYFUFB-UHFFFAOYSA-N 1 1 348.374 3.516 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789517594 1134289914 /nfs/dbraw/zinc/28/99/14/1134289914.db2.gz WTNKIRKJNNBEKJ-ZWKOTPCHSA-N 1 1 333.472 3.842 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC=C(c3ccccc3)C2)cc1OC ZINC000789545272 1134294806 /nfs/dbraw/zinc/29/48/06/1134294806.db2.gz HPWVHEDLCLKVMV-UHFFFAOYSA-N 1 1 325.408 3.699 20 10 EHCDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000789568112 1134297210 /nfs/dbraw/zinc/29/72/10/1134297210.db2.gz WOXCVTNVYOOLNO-OAQYLSRUSA-N 1 1 341.451 3.708 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000790408005 1134412150 /nfs/dbraw/zinc/41/21/50/1134412150.db2.gz SIOCSAUBSGCEFJ-CKJXQJPGSA-N 1 1 347.499 3.766 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)cc1C(C)C ZINC000790403085 1134416619 /nfs/dbraw/zinc/41/66/19/1134416619.db2.gz MNBJHZJGTUQNOL-FTRWYGJKSA-N 1 1 333.472 3.592 20 10 EHCDMO CN1CC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)[C@H]1c1ccccc1 ZINC000790981869 1134495624 /nfs/dbraw/zinc/49/56/24/1134495624.db2.gz ZILLDKGROVUEOS-CRAIPNDOSA-N 1 1 334.822 3.720 20 10 EHCDMO C[C@H](NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000775410119 1134747806 /nfs/dbraw/zinc/74/78/06/1134747806.db2.gz JUIBZEYOJRCYMO-FUHWJXTLSA-N 1 1 343.515 3.584 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c(C(F)(F)F)c1 ZINC000792780830 1134792657 /nfs/dbraw/zinc/79/26/57/1134792657.db2.gz SQKVKMGTHYMCDP-CYBMUJFWSA-N 1 1 342.405 3.772 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000793218628 1134875761 /nfs/dbraw/zinc/87/57/61/1134875761.db2.gz TXUWHMRHFIUTSU-LJQANCHMSA-N 1 1 347.459 3.586 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2C[C@@H](C)O[C@@]3(CCOC3)C2)cc1 ZINC000793363395 1134910181 /nfs/dbraw/zinc/91/01/81/1134910181.db2.gz UDECBDHATUBOMM-NQIIRXRSSA-N 1 1 346.515 3.693 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c(O)c1 ZINC000793611811 1134971177 /nfs/dbraw/zinc/97/11/77/1134971177.db2.gz HFKOTLQIYRUUNK-LSDHHAIUSA-N 1 1 330.255 3.807 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000793609639 1134971463 /nfs/dbraw/zinc/97/14/63/1134971463.db2.gz QLHZEYRFZWHZKU-HUUCEWRRSA-N 1 1 340.261 3.607 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000793609639 1134971467 /nfs/dbraw/zinc/97/14/67/1134971467.db2.gz QLHZEYRFZWHZKU-HUUCEWRRSA-N 1 1 340.261 3.607 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)Cc1cccc(Cl)c1 ZINC000805742590 1135324028 /nfs/dbraw/zinc/32/40/28/1135324028.db2.gz OAGZFUYWNNMUIH-GOSISDBHSA-N 1 1 333.859 3.861 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775642133 1135381462 /nfs/dbraw/zinc/38/14/62/1135381462.db2.gz GUIJKONXTYQRSZ-UHFFFAOYSA-N 1 1 343.902 3.724 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)Cc3ccc(Cl)cc3)cc2)CC1 ZINC000775642133 1135381464 /nfs/dbraw/zinc/38/14/64/1135381464.db2.gz GUIJKONXTYQRSZ-UHFFFAOYSA-N 1 1 343.902 3.724 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)Cc3ccc(Cl)cc3)cc2)CC1 ZINC000775642133 1135381468 /nfs/dbraw/zinc/38/14/68/1135381468.db2.gz GUIJKONXTYQRSZ-UHFFFAOYSA-N 1 1 343.902 3.724 20 10 EHCDMO COc1cccc([C@H]2C[N@H+](Cc3cc(Cl)cc(C)c3O)CCO2)c1 ZINC000775675807 1135493851 /nfs/dbraw/zinc/49/38/51/1135493851.db2.gz DPXUSGRKOSTQLI-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cccc([C@H]2C[N@@H+](Cc3cc(Cl)cc(C)c3O)CCO2)c1 ZINC000775675807 1135493854 /nfs/dbraw/zinc/49/38/54/1135493854.db2.gz DPXUSGRKOSTQLI-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO COC(=O)CCC[N@@H+](Cc1ccccc1)Cc1cccc(C)c1O ZINC000775739026 1135597082 /nfs/dbraw/zinc/59/70/82/1135597082.db2.gz BJCXNZOPQRNNOD-UHFFFAOYSA-N 1 1 327.424 3.656 20 10 EHCDMO COc1cc(O)c(C[N@H+]2Cc3ccccc3OC(C)(C)C2)cc1OC ZINC000808237020 1135639309 /nfs/dbraw/zinc/63/93/09/1135639309.db2.gz YZYZWFLCMZPVOG-UHFFFAOYSA-N 1 1 343.423 3.583 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c(C)o1 ZINC000747532983 1135749016 /nfs/dbraw/zinc/74/90/16/1135749016.db2.gz DLMSSUMLGAYSHG-UHFFFAOYSA-N 1 1 342.439 3.605 20 10 EHCDMO Cc1cc(-c2nnc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)o2)c(C)o1 ZINC000775833516 1135789616 /nfs/dbraw/zinc/78/96/16/1135789616.db2.gz KJJBHMZWAPMIAE-CYBMUJFWSA-N 1 1 340.427 3.863 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCOC[C@H]2[C@@H]2CCCO2)cc1 ZINC000809697970 1135868176 /nfs/dbraw/zinc/86/81/76/1135868176.db2.gz SOUBIUHDPMDSDV-SFTDATJTSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCOC[C@H]2[C@@H]2CCCO2)cc1 ZINC000809697970 1135868180 /nfs/dbraw/zinc/86/81/80/1135868180.db2.gz SOUBIUHDPMDSDV-SFTDATJTSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCOC[C@H]2[C@H]2CCCO2)cc1 ZINC000809697967 1135868240 /nfs/dbraw/zinc/86/82/40/1135868240.db2.gz SOUBIUHDPMDSDV-LEWJYISDSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCOC[C@H]2[C@H]2CCCO2)cc1 ZINC000809697967 1135868245 /nfs/dbraw/zinc/86/82/45/1135868245.db2.gz SOUBIUHDPMDSDV-LEWJYISDSA-N 1 1 346.515 3.693 20 10 EHCDMO C[NH+](C)CCN(Cc1cccc(Cl)c1O)Cc1ccccc1F ZINC000809733173 1135873953 /nfs/dbraw/zinc/87/39/53/1135873953.db2.gz XLDLPYBWMOHWKE-UHFFFAOYSA-N 1 1 336.838 3.749 20 10 EHCDMO C[C@H]1C[C@H](N2CCCC2)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703665 1135874108 /nfs/dbraw/zinc/87/41/08/1135874108.db2.gz OENPVWDOMSXYAS-RXVVDRJESA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@H]1C[C@H](N2CCCC2)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703665 1135874111 /nfs/dbraw/zinc/87/41/11/1135874111.db2.gz OENPVWDOMSXYAS-RXVVDRJESA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703664 1135874147 /nfs/dbraw/zinc/87/41/47/1135874147.db2.gz OENPVWDOMSXYAS-NQIIRXRSSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1C[C@H](N2CCCC2)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703664 1135874150 /nfs/dbraw/zinc/87/41/50/1135874150.db2.gz OENPVWDOMSXYAS-NQIIRXRSSA-N 1 1 327.516 3.736 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2CCC(=O)NC)cc1F ZINC000809712962 1135876603 /nfs/dbraw/zinc/87/66/03/1135876603.db2.gz BCUZKSVPZNBWIU-QGZVFWFLSA-N 1 1 349.494 3.553 20 10 EHCDMO C[C@@H]1[C@H](N2CCCC2)CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724153 1135878921 /nfs/dbraw/zinc/87/89/21/1135878921.db2.gz FKQKDCNZLWWENT-WIYYLYMNSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809724153 1135878924 /nfs/dbraw/zinc/87/89/24/1135878924.db2.gz FKQKDCNZLWWENT-WIYYLYMNSA-N 1 1 327.516 3.736 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCn1ccnc1)Cc1cccc(Cl)c1 ZINC000809753678 1135886065 /nfs/dbraw/zinc/88/60/65/1135886065.db2.gz XIINZQOUAOFZBH-UHFFFAOYSA-N 1 1 341.842 3.945 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@@]2(C)CCCO)c1O ZINC000809757494 1135886943 /nfs/dbraw/zinc/88/69/43/1135886943.db2.gz OHHBPRULFSZXSJ-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1O ZINC000810211077 1135943399 /nfs/dbraw/zinc/94/33/99/1135943399.db2.gz LNUYZAFSEBHCPJ-DOMZBBRYSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211077 1135943401 /nfs/dbraw/zinc/94/34/01/1135943401.db2.gz LNUYZAFSEBHCPJ-DOMZBBRYSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211077 1135943404 /nfs/dbraw/zinc/94/34/04/1135943404.db2.gz LNUYZAFSEBHCPJ-DOMZBBRYSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1cc(F)cc(F)c1O ZINC000810253248 1135949166 /nfs/dbraw/zinc/94/91/66/1135949166.db2.gz PSQZQFWDRHQISG-BTDLBPIBSA-N 1 1 339.407 3.871 20 10 EHCDMO CCCCC[N@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001201726567 1136056012 /nfs/dbraw/zinc/05/60/12/1136056012.db2.gz HAFJZYAQRIVXIU-OAQYLSRUSA-N 1 1 346.515 3.804 20 10 EHCDMO CS[C@@H]1CCCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000770348744 1136081370 /nfs/dbraw/zinc/08/13/70/1136081370.db2.gz LCCDKEQCPYFXQS-GFCCVEGCSA-N 1 1 330.291 3.872 20 10 EHCDMO CS[C@@H]1CCCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000770348744 1136081373 /nfs/dbraw/zinc/08/13/73/1136081373.db2.gz LCCDKEQCPYFXQS-GFCCVEGCSA-N 1 1 330.291 3.872 20 10 EHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(OC)c(C)cc1O)C2 ZINC000811794852 1136137603 /nfs/dbraw/zinc/13/76/03/1136137603.db2.gz ZNLFSOJLIANGQY-UHFFFAOYSA-N 1 1 339.435 3.765 20 10 EHCDMO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)n3ncnc32)c(C)n1-c1cccc(C)c1 ZINC000850352260 1136239385 /nfs/dbraw/zinc/23/93/85/1136239385.db2.gz QCOAYXZADDTTBH-DNVCBOLYSA-N 1 1 335.455 3.790 20 10 EHCDMO Cc1cc(Cl)cc(CNc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)c1O ZINC000812778221 1136245952 /nfs/dbraw/zinc/24/59/52/1136245952.db2.gz HZFNHGGQOAXERG-GOSISDBHSA-N 1 1 346.858 3.533 20 10 EHCDMO Cc1cc(F)c(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)c(F)c1 ZINC000850406869 1136251153 /nfs/dbraw/zinc/25/11/53/1136251153.db2.gz XEZWAOXPHYFITC-UHFFFAOYSA-N 1 1 346.421 3.524 20 10 EHCDMO CC(C)c1cnc(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)s1 ZINC000850406358 1136251373 /nfs/dbraw/zinc/25/13/73/1136251373.db2.gz CWLDBFXLBSPAKV-UHFFFAOYSA-N 1 1 345.512 3.517 20 10 EHCDMO O=C(CCCC[NH+]1CCCC1)NCc1cc(Cl)cc(Cl)c1O ZINC000813684267 1136356160 /nfs/dbraw/zinc/35/61/60/1136356160.db2.gz GGPHNIUVNFQEPO-UHFFFAOYSA-N 1 1 345.270 3.581 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000851793070 1136407565 /nfs/dbraw/zinc/40/75/65/1136407565.db2.gz WCBNENKCEATWTB-KRWDZBQOSA-N 1 1 346.515 3.889 20 10 EHCDMO C[C@]12CC[N@H+](Cc3cccc(Br)c3O)C[C@H]1C2(F)F ZINC000814169275 1136414760 /nfs/dbraw/zinc/41/47/60/1136414760.db2.gz FXRAGLWXDKLTAF-YPMHNXCESA-N 1 1 332.188 3.632 20 10 EHCDMO C[C@]12CC[N@@H+](Cc3cccc(Br)c3O)C[C@H]1C2(F)F ZINC000814169275 1136414763 /nfs/dbraw/zinc/41/47/63/1136414763.db2.gz FXRAGLWXDKLTAF-YPMHNXCESA-N 1 1 332.188 3.632 20 10 EHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCC(=O)O1 ZINC000851879302 1136415747 /nfs/dbraw/zinc/41/57/47/1136415747.db2.gz HYMVJSAEMXDCDH-CRAIPNDOSA-N 1 1 325.408 3.661 20 10 EHCDMO CCCC[N@H+](Cc1nc(C(=O)OCC)cs1)Cc1ccccc1O ZINC000814635486 1136483101 /nfs/dbraw/zinc/48/31/01/1136483101.db2.gz CIOHLUUGXRHCJN-UHFFFAOYSA-N 1 1 348.468 3.828 20 10 EHCDMO CCCC[N@@H+](Cc1nc(C(=O)OCC)cs1)Cc1ccccc1O ZINC000814635486 1136483103 /nfs/dbraw/zinc/48/31/03/1136483103.db2.gz CIOHLUUGXRHCJN-UHFFFAOYSA-N 1 1 348.468 3.828 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+]Cc3ccsc3C)cc2F)CC1 ZINC000815124406 1136554135 /nfs/dbraw/zinc/55/41/35/1136554135.db2.gz WNCIFBMQNMKYGT-UHFFFAOYSA-N 1 1 347.503 3.627 20 10 EHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H](O)Cc1ccc(F)cc1 ZINC000815111974 1136557373 /nfs/dbraw/zinc/55/73/73/1136557373.db2.gz IPFMBSNUNAIZLX-LJQANCHMSA-N 1 1 331.431 3.737 20 10 EHCDMO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H](C)c2ccccc2O)cc1 ZINC000854223290 1136599148 /nfs/dbraw/zinc/59/91/48/1136599148.db2.gz SCCYBTPNXHAKOG-YSSFQJQWSA-N 1 1 340.467 3.587 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815554393 1136609679 /nfs/dbraw/zinc/60/96/79/1136609679.db2.gz YQDVMLZPIKLGCE-NHYWBVRUSA-N 1 1 325.330 3.795 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815580122 1136614239 /nfs/dbraw/zinc/61/42/39/1136614239.db2.gz CNTHTBLQDGQGBK-JSGCOSHPSA-N 1 1 339.357 3.665 20 10 EHCDMO CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000815633467 1136621843 /nfs/dbraw/zinc/62/18/43/1136621843.db2.gz OQBREGDNZZWRAT-GHMZBOCLSA-N 1 1 347.286 3.902 20 10 EHCDMO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(F)cc1O ZINC000815646050 1136625767 /nfs/dbraw/zinc/62/57/67/1136625767.db2.gz YBYQQUUEVSNTLT-JTQLQIEISA-N 1 1 328.309 3.838 20 10 EHCDMO COc1cc2c(cc1F)C[N@@H+](Cc1c(O)ccc3ccncc31)CC2 ZINC000776778227 1136664287 /nfs/dbraw/zinc/66/42/87/1136664287.db2.gz VFIZPECBYUQJJV-UHFFFAOYSA-N 1 1 338.382 3.646 20 10 EHCDMO C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1ccc2ccccc2c1O ZINC000816482060 1136722790 /nfs/dbraw/zinc/72/27/90/1136722790.db2.gz SURDROOVYQFIHF-UHFFFAOYSA-N 1 1 335.403 3.949 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)c(OC)c1 ZINC000816482200 1136723796 /nfs/dbraw/zinc/72/37/96/1136723796.db2.gz XYFOAPHWIYCBSK-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)c(OC)c1 ZINC000816482200 1136723798 /nfs/dbraw/zinc/72/37/98/1136723798.db2.gz XYFOAPHWIYCBSK-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO Oc1c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521255 1136726845 /nfs/dbraw/zinc/72/68/45/1136726845.db2.gz KRMPHLQOUIKEAU-UTKZUKDTSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521255 1136726848 /nfs/dbraw/zinc/72/68/48/1136726848.db2.gz KRMPHLQOUIKEAU-UTKZUKDTSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1c(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)ccc2ccccc12 ZINC000816615819 1136741458 /nfs/dbraw/zinc/74/14/58/1136741458.db2.gz GWHNLJOPJHANBR-INIZCTEOSA-N 1 1 327.815 3.842 20 10 EHCDMO C[C@]1(C[NH2+]Cc2cc(Cl)c(F)cc2O)OCCc2sccc21 ZINC000816615331 1136741573 /nfs/dbraw/zinc/74/15/73/1136741573.db2.gz TVPJVSLVIZLSFX-MRXNPFEDSA-N 1 1 341.835 3.824 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1 ZINC000816642627 1136743580 /nfs/dbraw/zinc/74/35/80/1136743580.db2.gz FYIZRFGENRUBFV-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1 ZINC000816642627 1136743581 /nfs/dbraw/zinc/74/35/81/1136743581.db2.gz FYIZRFGENRUBFV-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO CCC[N@H+]1CCCC[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 ZINC001136025711 1136841449 /nfs/dbraw/zinc/84/14/49/1136841449.db2.gz VXBLERBJTSSTKB-FQEVSTJZSA-N 1 1 343.515 3.510 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000817943535 1136848951 /nfs/dbraw/zinc/84/89/51/1136848951.db2.gz VEGANQWJEVKXPV-MSOLQXFVSA-N 1 1 327.472 3.649 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000817943536 1136849405 /nfs/dbraw/zinc/84/94/05/1136849405.db2.gz VEGANQWJEVKXPV-QZTJIDSGSA-N 1 1 327.472 3.649 20 10 EHCDMO COc1cc(C)c([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817944030 1136850006 /nfs/dbraw/zinc/85/00/06/1136850006.db2.gz WUGPAYDAMHZDML-UZLBHIALSA-N 1 1 341.499 3.729 20 10 EHCDMO CCn1nc(C)c(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)n1 ZINC000818344119 1136873387 /nfs/dbraw/zinc/87/33/87/1136873387.db2.gz JIRBXPFQCIXLIK-INIZCTEOSA-N 1 1 341.503 3.838 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccc(OCC3CC3)nc2)cc1F ZINC000858117671 1136941370 /nfs/dbraw/zinc/94/13/70/1136941370.db2.gz WNHRRXGUYQIVGX-UHFFFAOYSA-N 1 1 347.409 3.504 20 10 EHCDMO COc1ccc([C@@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C2CC2)cn1 ZINC000858605836 1136982454 /nfs/dbraw/zinc/98/24/54/1136982454.db2.gz ZTGPVYZFPNBLHH-BTDLBPIBSA-N 1 1 334.366 3.876 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2ccc(F)cc2)cc1 ZINC000822166019 1137051173 /nfs/dbraw/zinc/05/11/73/1137051173.db2.gz DWDSKFVOHOPJOI-FQEVSTJZSA-N 1 1 330.447 3.837 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCN(C(C)(C)C)C1=O ZINC000822570580 1137065377 /nfs/dbraw/zinc/06/53/77/1137065377.db2.gz NMDDHDHXRHOMBE-IBGZPJMESA-N 1 1 343.515 3.508 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@@H](CCO)C2)cc1 ZINC000823436657 1137099635 /nfs/dbraw/zinc/09/96/35/1137099635.db2.gz BMRIQNMQARAUMX-KRWDZBQOSA-N 1 1 344.524 3.979 20 10 EHCDMO COCC[C@H]1CCCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862332247 1137138252 /nfs/dbraw/zinc/13/82/52/1137138252.db2.gz ILVJQYPAYCXJQW-CYBMUJFWSA-N 1 1 342.277 3.793 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000862403526 1137143072 /nfs/dbraw/zinc/14/30/72/1137143072.db2.gz RHMLKRLGVYOVRS-CYBMUJFWSA-N 1 1 332.188 3.776 20 10 EHCDMO CC(C)[N@@H+](Cc1c(C2CC2)cnn1C)Cc1ccc(N(C)C)cc1 ZINC000824567445 1137143133 /nfs/dbraw/zinc/14/31/33/1137143133.db2.gz SXTWVWKDKVRNAM-UHFFFAOYSA-N 1 1 326.488 3.774 20 10 EHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(Br)cc2O)on1 ZINC000824597233 1137144527 /nfs/dbraw/zinc/14/45/27/1137144527.db2.gz OICLNOAGLRNQQL-CYBMUJFWSA-N 1 1 337.217 3.788 20 10 EHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(Br)cc2O)on1 ZINC000824597233 1137144529 /nfs/dbraw/zinc/14/45/29/1137144529.db2.gz OICLNOAGLRNQQL-CYBMUJFWSA-N 1 1 337.217 3.788 20 10 EHCDMO CC(C)(C[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1)C(N)=O ZINC000824608684 1137144905 /nfs/dbraw/zinc/14/49/05/1137144905.db2.gz MGCRLIRYDVKFKH-HNNXBMFYSA-N 1 1 340.467 3.659 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215792 1137169013 /nfs/dbraw/zinc/16/90/13/1137169013.db2.gz WIWGFSZPFFDNQZ-HNNXBMFYSA-N 1 1 342.302 3.874 20 10 EHCDMO C[NH+](C)Cc1ccc(NCc2ccc(F)c(F)c2O)cc1Cl ZINC000864011595 1137211488 /nfs/dbraw/zinc/21/14/88/1137211488.db2.gz KYSIYQRDNJOYQN-UHFFFAOYSA-N 1 1 326.774 3.998 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2ccc(N3CCC(OC)CC3)cc2)[C@@H](CC)CO1 ZINC000844384167 1137215906 /nfs/dbraw/zinc/21/59/06/1137215906.db2.gz CCYLIQUWUCGFLN-ICSRJNTNSA-N 1 1 346.515 3.691 20 10 EHCDMO CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000844926425 1137263425 /nfs/dbraw/zinc/26/34/25/1137263425.db2.gz UDIGECPBKKTGKE-HNNXBMFYSA-N 1 1 341.293 3.585 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001144299249 1137268646 /nfs/dbraw/zinc/26/86/46/1137268646.db2.gz TVWRKHZVHBHZEE-GHMZBOCLSA-N 1 1 328.225 3.916 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ccncc2Br)cc1 ZINC000865418084 1137281616 /nfs/dbraw/zinc/28/16/16/1137281616.db2.gz HQBXCCMZMFGPHO-UHFFFAOYSA-N 1 1 348.288 3.980 20 10 EHCDMO CC[N@@H+](CCCNC(=O)N(C)Cc1ccccc1O)C1CCCCC1 ZINC000845365369 1137288474 /nfs/dbraw/zinc/28/84/74/1137288474.db2.gz RHVRNBZJPXXWLD-UHFFFAOYSA-N 1 1 347.503 3.578 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H](CCc3ccccc3)C2)c(O)c1 ZINC001144516173 1137304652 /nfs/dbraw/zinc/30/46/52/1137304652.db2.gz RSDFOWZQMBUYPN-INIZCTEOSA-N 1 1 327.424 3.648 20 10 EHCDMO COc1cc(F)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1OC ZINC000845903838 1137319240 /nfs/dbraw/zinc/31/92/40/1137319240.db2.gz TZNLGFGIVHUEHY-UHFFFAOYSA-N 1 1 332.419 3.541 20 10 EHCDMO COc1cc(F)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1OC ZINC000845903838 1137319242 /nfs/dbraw/zinc/31/92/42/1137319242.db2.gz TZNLGFGIVHUEHY-UHFFFAOYSA-N 1 1 332.419 3.541 20 10 EHCDMO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1ccccc1F ZINC000846182900 1137340316 /nfs/dbraw/zinc/34/03/16/1137340316.db2.gz LGEBBSCVXAKHAU-XQJJYNOISA-N 1 1 325.330 3.582 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)o1 ZINC000866477918 1137357872 /nfs/dbraw/zinc/35/78/72/1137357872.db2.gz FYGMSAJJVZYBSI-AWEZNQCLSA-N 1 1 334.847 3.929 20 10 EHCDMO CC(C)C[C@@H](C[NH+]1CCCC1)NC/C=C/c1ccc(N(C)C)cc1 ZINC001202521997 1137373964 /nfs/dbraw/zinc/37/39/64/1137373964.db2.gz YMTYGDSRHPHOOD-DUIUGDAFSA-N 1 1 329.532 3.866 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2cc(C(F)(F)F)co2)cc1 ZINC001171729034 1137506595 /nfs/dbraw/zinc/50/65/95/1137506595.db2.gz FHYGVXQYGJFDMC-UHFFFAOYSA-N 1 1 342.361 3.875 20 10 EHCDMO CC[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000873234315 1137594674 /nfs/dbraw/zinc/59/46/74/1137594674.db2.gz BDAWOMYEQNYDJL-SFHVURJKSA-N 1 1 330.859 3.932 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000873270092 1137595888 /nfs/dbraw/zinc/59/58/88/1137595888.db2.gz WYTGIXHTEKLPIA-IAQYHMDHSA-N 1 1 341.293 3.584 20 10 EHCDMO COc1cc(CN2CCC[C@H]([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000825699289 1137607426 /nfs/dbraw/zinc/60/74/26/1137607426.db2.gz SZTXSKWMWQQJSM-INIZCTEOSA-N 1 1 334.504 3.614 20 10 EHCDMO Cc1ccc(C[N@@H+](C)CC(=O)Nc2c(C)cc(C)cc2C)c(O)c1 ZINC000876591186 1137656547 /nfs/dbraw/zinc/65/65/47/1137656547.db2.gz ITVYFOMJXLJXIF-UHFFFAOYSA-N 1 1 326.440 3.696 20 10 EHCDMO Cc1nnc([C@H]2Cc3ccccc3C[N@@H+]2Cc2c(C)cccc2O)o1 ZINC000876629842 1137657557 /nfs/dbraw/zinc/65/75/57/1137657557.db2.gz WNJQDYVDVCGSKE-GOSISDBHSA-N 1 1 335.407 3.692 20 10 EHCDMO Cc1nnc([C@H]2Cc3ccccc3C[N@H+]2Cc2c(C)cccc2O)o1 ZINC000876629842 1137657558 /nfs/dbraw/zinc/65/75/58/1137657558.db2.gz WNJQDYVDVCGSKE-GOSISDBHSA-N 1 1 335.407 3.692 20 10 EHCDMO CCC[C@@]1(CO)CC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000825943543 1137671934 /nfs/dbraw/zinc/67/19/34/1137671934.db2.gz GYYWHWQNQSXTIM-HXUWFJFHSA-N 1 1 335.488 3.683 20 10 EHCDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc(N3CCOC3=O)c2)c(O)c1 ZINC000877485587 1137678011 /nfs/dbraw/zinc/67/80/11/1137678011.db2.gz ZYIBKVKYNWRSGM-HNNXBMFYSA-N 1 1 340.423 3.850 20 10 EHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC12CCC2 ZINC000877544963 1137680818 /nfs/dbraw/zinc/68/08/18/1137680818.db2.gz CBQRFHYOMDHXIJ-HXUWFJFHSA-N 1 1 328.500 3.658 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccc2cc[nH]c2c1 ZINC000877769296 1137688977 /nfs/dbraw/zinc/68/89/77/1137688977.db2.gz DVMAXLVNOQNFIV-UHFFFAOYSA-N 1 1 349.478 3.761 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1cc(C)ccc1OC)Cc1ccccc1O ZINC000130726134 1137841546 /nfs/dbraw/zinc/84/15/46/1137841546.db2.gz CQBAYCSKTBIEJT-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000883088230 1137844333 /nfs/dbraw/zinc/84/43/33/1137844333.db2.gz XLEMYWKYZQYQSG-NVXWUHKLSA-N 1 1 337.341 3.819 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000883136124 1137846056 /nfs/dbraw/zinc/84/60/56/1137846056.db2.gz VNMWWEDJISILAY-GFCCVEGCSA-N 1 1 329.268 3.865 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(OC)c1OC ZINC000883197253 1137848109 /nfs/dbraw/zinc/84/81/09/1137848109.db2.gz HLSINQSDWRXELB-HNNXBMFYSA-N 1 1 337.366 3.929 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1C)Cc1ccc(N(C)C)cc1 ZINC000007362131 1137891275 /nfs/dbraw/zinc/89/12/75/1137891275.db2.gz FXEAESDGQVECDG-UHFFFAOYSA-N 1 1 339.483 3.830 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000109770908 1137897334 /nfs/dbraw/zinc/89/73/34/1137897334.db2.gz HONOXQTVQCLGNO-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000109770908 1137897335 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Oc1ccccc1C[N@H+]1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000179584348 1139766431 /nfs/dbraw/zinc/76/64/31/1139766431.db2.gz SZAFVIGOPOXOPR-QGZVFWFLSA-N 1 1 335.350 3.567 20 10 EHCDMO CC(C)OC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179643773 1139771942 /nfs/dbraw/zinc/77/19/42/1139771942.db2.gz OWWVENUKCORARE-PXNSSMCTSA-N 1 1 343.467 3.741 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)c1O ZINC000180503520 1139840713 /nfs/dbraw/zinc/84/07/13/1139840713.db2.gz UHFBTWORYCAXBC-JOCHJYFZSA-N 1 1 337.872 3.723 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1O ZINC000184679606 1140114539 /nfs/dbraw/zinc/11/45/39/1140114539.db2.gz JDDGFTFAWIZWSW-UHFFFAOYSA-N 1 1 336.775 3.594 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1O ZINC000184679606 1140114541 /nfs/dbraw/zinc/11/45/41/1140114541.db2.gz JDDGFTFAWIZWSW-UHFFFAOYSA-N 1 1 336.775 3.594 20 10 EHCDMO COc1ccc(O)c([C@H](C)N[C@@H](C[NH+]2CCCC2)c2ccccc2)c1 ZINC000184919656 1140125666 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/nfs/dbraw/zinc/87/58/25/1135875825.db2.gz SNWNWKWZQDWUNV-UHFFFAOYSA-N 1 1 340.261 3.546 20 10 EHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1cccc(Br)c1O)C2 ZINC000809707929 1135875828 /nfs/dbraw/zinc/87/58/28/1135875828.db2.gz SNWNWKWZQDWUNV-UHFFFAOYSA-N 1 1 340.261 3.546 20 10 EHCDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000809767385 1135879541 /nfs/dbraw/zinc/87/95/41/1135879541.db2.gz JQQSMZPROFLMJX-IBGZPJMESA-N 1 1 343.467 3.810 20 10 EHCDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000809770656 1135880656 /nfs/dbraw/zinc/88/06/56/1135880656.db2.gz DHGLGSITHRFRPT-FZMZJTMJSA-N 1 1 340.851 3.533 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(N2CCOCC2)cc1 ZINC000809972101 1135907050 /nfs/dbraw/zinc/90/70/50/1135907050.db2.gz RAPMZFKLSUXGNX-HNNXBMFYSA-N 1 1 343.471 3.660 20 10 EHCDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC/C=C/c1ccc(N(C)C)cc1 ZINC001199677954 1135919456 /nfs/dbraw/zinc/91/94/56/1135919456.db2.gz IEAPQEMXVBCCPS-OJUCNMNVSA-N 1 1 329.532 3.722 20 10 EHCDMO C[C@@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001199677954 1135919460 /nfs/dbraw/zinc/91/94/60/1135919460.db2.gz IEAPQEMXVBCCPS-OJUCNMNVSA-N 1 1 329.532 3.722 20 10 EHCDMO CCCN(CC)C[C@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000810180703 1135935255 /nfs/dbraw/zinc/93/52/55/1135935255.db2.gz HYAWFBPLXUWUAT-ZDUSSCGKSA-N 1 1 343.309 3.673 20 10 EHCDMO Cc1cc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)cc(N2CCCC2)n1 ZINC000810249988 1135947936 /nfs/dbraw/zinc/94/79/36/1135947936.db2.gz CLARGBLKUZTYNH-ZDUSSCGKSA-N 1 1 347.409 3.825 20 10 EHCDMO CCCCC[N@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001201726565 1136055943 /nfs/dbraw/zinc/05/59/43/1136055943.db2.gz HAFJZYAQRIVXIU-NRFANRHFSA-N 1 1 346.515 3.804 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)cc1 ZINC000811521104 1136098317 /nfs/dbraw/zinc/09/83/17/1136098317.db2.gz ZLOSSFJOTMSFCV-SFHVURJKSA-N 1 1 332.879 3.830 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@H]1[C@H]1CCCO1)CCCC2 ZINC000811791229 1136140914 /nfs/dbraw/zinc/14/09/14/1136140914.db2.gz RTDIVCZDSVZYOF-WOJBJXKFSA-N 1 1 327.468 3.805 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC000776293810 1136144886 /nfs/dbraw/zinc/14/48/86/1136144886.db2.gz OASFSYWRZXCMGB-LJQANCHMSA-N 1 1 333.431 3.989 20 10 EHCDMO Cc1c[nH]c(C[NH2+]Cc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n1 ZINC000850284951 1136231371 /nfs/dbraw/zinc/23/13/71/1136231371.db2.gz NOMMVYURGHKNDG-ZDUSSCGKSA-N 1 1 332.879 3.898 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H]2C[C@@H](C)n3ncnc32)cc1 ZINC000850351706 1136239516 /nfs/dbraw/zinc/23/95/16/1136239516.db2.gz GVEGKLYBWHTZRV-QAPCUYQASA-N 1 1 327.476 3.700 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@]2(C)CC2(F)F)c1 ZINC000850380833 1136245916 /nfs/dbraw/zinc/24/59/16/1136245916.db2.gz NRHDBPGLIWRUSF-CYBMUJFWSA-N 1 1 334.204 3.988 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(Br)c(F)cc1O ZINC000850482929 1136267382 /nfs/dbraw/zinc/26/73/82/1136267382.db2.gz SLFKGTGFHFVIKB-BDAKNGLRSA-N 1 1 332.213 3.512 20 10 EHCDMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109772885 1136339571 /nfs/dbraw/zinc/33/95/71/1136339571.db2.gz YCSAPTWTXFVVRC-ZDUSSCGKSA-N 1 1 332.831 3.813 20 10 EHCDMO CSc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109770218 1136339838 /nfs/dbraw/zinc/33/98/38/1136339838.db2.gz LNYHEFUWWFEBAP-CYBMUJFWSA-N 1 1 330.453 3.573 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOCc1ccccc1)C[C@H]1CCCO1 ZINC000851841697 1136413142 /nfs/dbraw/zinc/41/31/42/1136413142.db2.gz WRUXQMQGXGRMCY-HXUWFJFHSA-N 1 1 341.451 3.590 20 10 EHCDMO CCc1ccc([C@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000111235234 1136524439 /nfs/dbraw/zinc/52/44/39/1136524439.db2.gz HRNDOUQSYQVTNV-JKSUJKDBSA-N 1 1 340.467 3.652 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cnn(C)c3Cl)cc2)CC1 ZINC000815123578 1136554013 /nfs/dbraw/zinc/55/40/13/1136554013.db2.gz DOUVMVBXUTYWIA-UHFFFAOYSA-N 1 1 332.879 3.600 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815564673 1136611678 /nfs/dbraw/zinc/61/16/78/1136611678.db2.gz PIPRCTGGEBMHGV-HPEXNQPKSA-N 1 1 337.341 3.720 20 10 EHCDMO CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815625808 1136620866 /nfs/dbraw/zinc/62/08/66/1136620866.db2.gz MTELROXVOAGRGB-STQMWFEESA-N 1 1 330.394 3.936 20 10 EHCDMO Oc1cccc([C@H]2C[N@@H+](Cc3ccc4ccccc4c3O)CCO2)c1 ZINC000816513625 1136729569 /nfs/dbraw/zinc/72/95/69/1136729569.db2.gz WYHNALPSRCANHB-HXUWFJFHSA-N 1 1 335.403 3.825 20 10 EHCDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1ccc2ccccc2c1O ZINC000816514378 1136729606 /nfs/dbraw/zinc/72/96/06/1136729606.db2.gz VRLXCOBTVVXZQU-UHFFFAOYSA-N 1 1 344.455 3.892 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1nc2c(s1)CCCC2 ZINC000816549917 1136733111 /nfs/dbraw/zinc/73/31/11/1136733111.db2.gz CKXUMNGTMDMIOM-UHFFFAOYSA-N 1 1 340.851 3.852 20 10 EHCDMO COc1ccc(O[C@@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816554799 1136735850 /nfs/dbraw/zinc/73/58/50/1136735850.db2.gz JGQIYAWFLFJXKM-NSHDSACASA-N 1 1 339.794 3.750 20 10 EHCDMO CC1([C@@H]2CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)OCCO1 ZINC000816568236 1136738257 /nfs/dbraw/zinc/73/82/57/1136738257.db2.gz AZWBSJGUGKYTHC-QGZVFWFLSA-N 1 1 327.424 3.520 20 10 EHCDMO COc1ccc2c(c1)OCC[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816600875 1136739921 /nfs/dbraw/zinc/73/99/21/1136739921.db2.gz JWCMWHXLGLOOLW-UHFFFAOYSA-N 1 1 335.403 3.949 20 10 EHCDMO CN1CCC[C@@]2(CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642401 1136743454 /nfs/dbraw/zinc/74/34/54/1136743454.db2.gz YMDRXAOOFMICBZ-OAQYLSRUSA-N 1 1 327.516 3.595 20 10 EHCDMO CN1CCC[C@@]2(CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642401 1136743457 /nfs/dbraw/zinc/74/34/57/1136743457.db2.gz YMDRXAOOFMICBZ-OAQYLSRUSA-N 1 1 327.516 3.595 20 10 EHCDMO C[N@@H+]1CCC[C@@]2(CCN(Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642401 1136743458 /nfs/dbraw/zinc/74/34/58/1136743458.db2.gz YMDRXAOOFMICBZ-OAQYLSRUSA-N 1 1 327.516 3.595 20 10 EHCDMO C[N@H+]1CCC[C@@]2(CCN(Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642401 1136743461 /nfs/dbraw/zinc/74/34/61/1136743461.db2.gz YMDRXAOOFMICBZ-OAQYLSRUSA-N 1 1 327.516 3.595 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000816666317 1136747299 /nfs/dbraw/zinc/74/72/99/1136747299.db2.gz KGFAZMIHUHQQMS-LEWJYISDSA-N 1 1 326.484 3.820 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc2c(s1)CCC2 ZINC000817939554 1136847412 /nfs/dbraw/zinc/84/74/12/1136847412.db2.gz CMNKAGCHOCYMMN-CXAGYDPISA-N 1 1 329.513 3.653 20 10 EHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC)c1 ZINC000817940335 1136848557 /nfs/dbraw/zinc/84/85/57/1136848557.db2.gz GBMQCRLKTKPFTK-UXHICEINSA-N 1 1 327.472 3.502 20 10 EHCDMO CSc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1F ZINC000817943821 1136849516 /nfs/dbraw/zinc/84/95/16/1136849516.db2.gz VSWYRORWTHRJAO-UGSOOPFHSA-N 1 1 347.503 3.964 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947143 1136850271 /nfs/dbraw/zinc/85/02/71/1136850271.db2.gz LFQCSCJGHXGQFZ-ZOWXZIJZSA-N 1 1 330.394 3.840 20 10 EHCDMO C[C@@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(Cl)c1[O-])CC[NH2+]CC2 ZINC000818431015 1136874299 /nfs/dbraw/zinc/87/42/99/1136874299.db2.gz CTRUCLCRVKEQAF-LLVKDONJSA-N 1 1 329.271 3.663 20 10 EHCDMO CC1(C)C[C@H](c2ccccc2)[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000819901201 1136965790 /nfs/dbraw/zinc/96/57/90/1136965790.db2.gz VDHKWDOPKQEJSL-MJGOQNOKSA-N 1 1 339.435 3.791 20 10 EHCDMO C[C@H]([NH2+][C@H]1CO[C@@H](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000858548253 1136977845 /nfs/dbraw/zinc/97/78/45/1136977845.db2.gz RTUZCCYNKJYYGB-SVIKCVJRSA-N 1 1 344.224 3.512 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc2cccnc2o1)C[C@@H]1CCCO1 ZINC000823386745 1137097518 /nfs/dbraw/zinc/09/75/18/1137097518.db2.gz LMMTVRPACDYPND-KRWDZBQOSA-N 1 1 338.407 3.715 20 10 EHCDMO COc1cc(F)cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000823386715 1137097630 /nfs/dbraw/zinc/09/76/30/1137097630.db2.gz KSDVHNDLHDQRJE-SFHVURJKSA-N 1 1 345.414 3.721 20 10 EHCDMO C[C@@H]1C[C@H](C[N@@H+](C)Cc2ccccc2O)CCN1C(=O)OC(C)(C)C ZINC000823409138 1137098921 /nfs/dbraw/zinc/09/89/21/1137098921.db2.gz VMCZVMVFONNZHT-HZPDHXFCSA-N 1 1 348.487 3.860 20 10 EHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(OC(C)(C)C)CC2)cc1F ZINC000862232544 1137133696 /nfs/dbraw/zinc/13/36/96/1137133696.db2.gz BMHWSNAOGHLGDC-UHFFFAOYSA-N 1 1 326.431 3.810 20 10 EHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(O)cccc1Br ZINC000862351392 1137139616 /nfs/dbraw/zinc/13/96/16/1137139616.db2.gz OKHWLBDFRVOBGL-WCBMZHEXSA-N 1 1 338.167 3.927 20 10 EHCDMO CCCC[N@@H+](Cc1cccc(C(=O)OCC)n1)Cc1ccccc1O ZINC000862355546 1137139745 /nfs/dbraw/zinc/13/97/45/1137139745.db2.gz KPUJHIHCRVOKGF-UHFFFAOYSA-N 1 1 342.439 3.766 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[NH2+][C@H]2CCn3ccnc32)cc1 ZINC000824533896 1137141760 /nfs/dbraw/zinc/14/17/60/1137141760.db2.gz RXBYCFZBQILYKV-SFHVURJKSA-N 1 1 338.480 3.816 20 10 EHCDMO CC1(CC(F)(F)F)C[NH+](Cc2c(O)cccc2Br)C1 ZINC000862390979 1137142163 /nfs/dbraw/zinc/14/21/63/1137142163.db2.gz DGBJDZJXSLUKHB-UHFFFAOYSA-N 1 1 338.167 3.929 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)c1 ZINC000862485147 1137146631 /nfs/dbraw/zinc/14/66/31/1137146631.db2.gz HXGADADCMIDJSX-YOEHRIQHSA-N 1 1 349.471 3.591 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1O ZINC000862484774 1137146780 /nfs/dbraw/zinc/14/67/80/1137146780.db2.gz AXHFVMLEBRMZJK-GOEBONIOSA-N 1 1 349.471 3.591 20 10 EHCDMO COc1ccc([C@@H](CO)[N@@H+](C)Cc2cc(Cl)c(C)cc2O)cc1 ZINC000824813995 1137153635 /nfs/dbraw/zinc/15/36/35/1137153635.db2.gz KXAZLZNOIVNAHK-QGZVFWFLSA-N 1 1 335.831 3.528 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1OC ZINC000825104130 1137163471 /nfs/dbraw/zinc/16/34/71/1137163471.db2.gz OHYTVUHPUXSQAF-GOSISDBHSA-N 1 1 329.396 3.730 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1OC ZINC000825104130 1137163473 /nfs/dbraw/zinc/16/34/73/1137163473.db2.gz OHYTVUHPUXSQAF-GOSISDBHSA-N 1 1 329.396 3.730 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1O ZINC000844758653 1137250275 /nfs/dbraw/zinc/25/02/75/1137250275.db2.gz XAKYUDYORSDXGJ-GOSISDBHSA-N 1 1 347.361 3.563 20 10 EHCDMO [O-]c1cc(F)c(Br)cc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC001144306999 1137270781 /nfs/dbraw/zinc/27/07/81/1137270781.db2.gz ZVQPOARTIJINFC-LBPRGKRZSA-N 1 1 336.151 3.525 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)o1 ZINC000866477919 1137357668 /nfs/dbraw/zinc/35/76/68/1137357668.db2.gz FYGMSAJJVZYBSI-CQSZACIVSA-N 1 1 334.847 3.929 20 10 EHCDMO C[C@H]([NH2+]Cc1ncc(Br)s1)c1ccc(N(C)C)cc1 ZINC000714949061 1137474484 /nfs/dbraw/zinc/47/44/84/1137474484.db2.gz CERFCFVLOUGKDD-JTQLQIEISA-N 1 1 340.290 3.822 20 10 EHCDMO C[C@@H]([NH2+]Cc1ncc(Br)s1)c1ccc(N(C)C)cc1 ZINC000714949066 1137474643 /nfs/dbraw/zinc/47/46/43/1137474643.db2.gz CERFCFVLOUGKDD-SNVBAGLBSA-N 1 1 340.290 3.822 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](Cc1nc2ccccc2c(=O)[nH]1)C(C)C ZINC000876592892 1137656576 /nfs/dbraw/zinc/65/65/76/1137656576.db2.gz VDKZRKLIAMPDAJ-UHFFFAOYSA-N 1 1 337.423 3.760 20 10 EHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876697027 1137659316 /nfs/dbraw/zinc/65/93/16/1137659316.db2.gz OGUZCIIVQYUUSP-KRWDZBQOSA-N 1 1 336.479 3.767 20 10 EHCDMO CC[N@@H+](Cc1ccns1)Cc1cc(Br)ccc1O ZINC000876793440 1137661534 /nfs/dbraw/zinc/66/15/34/1137661534.db2.gz DNSRQEYMOCDGCL-UHFFFAOYSA-N 1 1 327.247 3.633 20 10 EHCDMO COc1cccc(O)c1C[N@@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000877783701 1137689627 /nfs/dbraw/zinc/68/96/27/1137689627.db2.gz DHZOYZTZMPYBCW-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000877783701 1137689628 /nfs/dbraw/zinc/68/96/28/1137689628.db2.gz DHZOYZTZMPYBCW-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)c1O ZINC000877814012 1137691100 /nfs/dbraw/zinc/69/11/00/1137691100.db2.gz MNUCUJJLVORQNS-NSHDSACASA-N 1 1 338.860 3.809 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@@H]1CC(C)(C)OC1(C)C ZINC000877923105 1137695789 /nfs/dbraw/zinc/69/57/89/1137695789.db2.gz JCWYOYUDZTTZKA-SFHVURJKSA-N 1 1 346.515 3.549 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](O)C23CCCC3)c(O)c(C(C)(C)C)c1 ZINC000826012610 1137699905 /nfs/dbraw/zinc/69/99/05/1137699905.db2.gz PFBWSCBUSKBBHQ-QGZVFWFLSA-N 1 1 333.472 3.578 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccnc(OC2CCCC2)c1 ZINC000882888384 1137836863 /nfs/dbraw/zinc/83/68/63/1137836863.db2.gz XVRMXPZHPVRUMY-UHFFFAOYSA-N 1 1 334.366 3.677 20 10 EHCDMO CCOc1cccc(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000130643499 1137840402 /nfs/dbraw/zinc/84/04/02/1137840402.db2.gz JCAWWHBAXURWTP-HNAYVOBHSA-N 1 1 327.424 3.753 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000884483259 1137960987 /nfs/dbraw/zinc/96/09/87/1137960987.db2.gz QLQHNYHTVPBXHW-RDTXWAMCSA-N 1 1 333.472 3.699 20 10 EHCDMO c1coc([C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)c2ccccc2)c1 ZINC000066236387 1138074307 /nfs/dbraw/zinc/07/43/07/1138074307.db2.gz FUSDTOOBLGEAFR-QFIPXVFZSA-N 1 1 348.446 3.995 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1c(O)cccc1F ZINC000886539437 1138092926 /nfs/dbraw/zinc/09/29/26/1138092926.db2.gz ZLSNGGDEGPJRMG-NEPJUHHUSA-N 1 1 335.810 3.509 20 10 EHCDMO C[C@H](CCCNC(=O)OC(C)(C)C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886615985 1138102605 /nfs/dbraw/zinc/10/26/05/1138102605.db2.gz SBBYHGMCKYBLMK-CHWSQXEVSA-N 1 1 340.439 3.875 20 10 EHCDMO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000076900827 1138135520 /nfs/dbraw/zinc/13/55/20/1138135520.db2.gz WXTWNDXGFNFQCY-OAHLLOKOSA-N 1 1 345.512 3.954 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@@H]2C)O1)c1ccc(F)cc1O ZINC000886768666 1138136701 /nfs/dbraw/zinc/13/67/01/1138136701.db2.gz FYPYAHMUSWZFKR-KMUPADOHSA-N 1 1 337.435 3.545 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000122259762 1138256249 /nfs/dbraw/zinc/25/62/49/1138256249.db2.gz WWJSXRCRFGDMCE-LQWHRVPQSA-N 1 1 347.547 3.540 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@H](C)c1ccc(F)cc1O)O[C@@H](C)C2 ZINC000184975099 1140129171 /nfs/dbraw/zinc/12/91/71/1140129171.db2.gz IDZZXMDOOMABPC-NWDGAFQWSA-N 1 1 331.387 3.714 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1cccc(N2CCOC2=O)c1 ZINC000185157665 1140138329 /nfs/dbraw/zinc/13/83/29/1140138329.db2.gz YFAKCYMIGOYASO-CHWSQXEVSA-N 1 1 344.386 3.900 20 10 EHCDMO COc1ccccc1N1CCC([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000185244522 1140141215 /nfs/dbraw/zinc/14/12/15/1140141215.db2.gz SJMMYNPCGWSRDM-AWEZNQCLSA-N 1 1 344.430 3.860 20 10 EHCDMO CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000185671137 1140161968 /nfs/dbraw/zinc/16/19/68/1140161968.db2.gz WJNBCQTXNNTETG-NVXWUHKLSA-N 1 1 330.472 3.553 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1O ZINC000186196452 1140191666 /nfs/dbraw/zinc/19/16/66/1140191666.db2.gz GRTRWGGRPDDBSV-XXFAHNHDSA-N 1 1 327.758 3.708 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(F)c(F)c1 ZINC000186225662 1140192963 /nfs/dbraw/zinc/19/29/63/1140192963.db2.gz KIQUUDFLWHQIKJ-QFYYESIMSA-N 1 1 325.330 3.848 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cc1 ZINC000187517998 1140259480 /nfs/dbraw/zinc/25/94/80/1140259480.db2.gz KDHPSSCZUXBSII-FQEVSTJZSA-N 1 1 338.430 3.504 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cn(C(C)(C)C)nn3)cc2)CC1 ZINC000190986722 1140429093 /nfs/dbraw/zinc/42/90/93/1140429093.db2.gz MJGDSWRSDQFLSA-UHFFFAOYSA-N 1 1 341.503 3.559 20 10 EHCDMO C[C@H]([NH2+]CCCc1cnn(C)c1)c1cc(Cl)c(Cl)cc1O ZINC000192805989 1140551522 /nfs/dbraw/zinc/55/15/22/1140551522.db2.gz BGGYDUYKRJVTKV-JTQLQIEISA-N 1 1 328.243 3.716 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644084 522855570 /nfs/dbraw/zinc/85/55/70/522855570.db2.gz RHZLUOHKCQRDTP-SWLSCSKDSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644084 522855577 /nfs/dbraw/zinc/85/55/77/522855577.db2.gz RHZLUOHKCQRDTP-SWLSCSKDSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[N@@H+](Cc1cncc(F)c1)Cc1cc(Br)ccc1O ZINC000275096984 1015988470 /nfs/dbraw/zinc/98/84/70/1015988470.db2.gz AZUDGUHWEOGJEA-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO COCCOC[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000093754634 1032902521 /nfs/dbraw/zinc/90/25/21/1032902521.db2.gz LJWTYEKXPLDQCE-KRWDZBQOSA-N 1 1 341.451 3.544 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c(C(F)(F)F)c1 ZINC000280656468 1020549583 /nfs/dbraw/zinc/54/95/83/1020549583.db2.gz SPGJDPKGUNBSKG-CTYIDZIISA-N 1 1 330.394 3.507 20 10 EHCDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000050900066 1020664626 /nfs/dbraw/zinc/66/46/26/1020664626.db2.gz RJMVFYSIKUTMHK-INIZCTEOSA-N 1 1 332.488 3.562 20 10 EHCDMO COc1cc(C[N@@H+](Cc2cc(C)cc(OC)c2O)C2CC2)ccc1O ZINC000894490471 1022398369 /nfs/dbraw/zinc/39/83/69/1022398369.db2.gz DNICTJHDAWBSQW-UHFFFAOYSA-N 1 1 343.423 3.588 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1O ZINC000895056897 1022870999 /nfs/dbraw/zinc/87/09/99/1022870999.db2.gz FWPNBCJOZRUUGF-SJLPKXTDSA-N 1 1 347.842 3.671 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)[nH]1 ZINC000894774881 1022874066 /nfs/dbraw/zinc/87/40/66/1022874066.db2.gz YXFYFGHBTWHABD-HNNXBMFYSA-N 1 1 347.466 3.527 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(-n2cncn2)cc1)C1CCCC1 ZINC000093319324 1023473205 /nfs/dbraw/zinc/47/32/05/1023473205.db2.gz GOTTYAGJHFUJDC-UHFFFAOYSA-N 1 1 348.450 3.918 20 10 EHCDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000176169229 1023777955 /nfs/dbraw/zinc/77/79/55/1023777955.db2.gz YBQSRIUQUFAXFG-OAHLLOKOSA-N 1 1 327.424 3.709 20 10 EHCDMO Cn1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1C1CC1 ZINC000892011964 1024330107 /nfs/dbraw/zinc/33/01/07/1024330107.db2.gz JATOOBWCXVQCGD-UHFFFAOYSA-N 1 1 325.456 3.948 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(c2nc(C3CCC3)no2)CC1 ZINC000895462539 1024531825 /nfs/dbraw/zinc/53/18/25/1024531825.db2.gz YGPARJFBEOHXGZ-UHFFFAOYSA-N 1 1 349.381 3.701 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC[S@@](=O)c2ccccc2)C2CC2)cc1 ZINC000729542311 1024547315 /nfs/dbraw/zinc/54/73/15/1024547315.db2.gz DIJDLOOYFDYSQR-XMMPIXPASA-N 1 1 342.508 3.525 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3cc(Cl)ccc3O)[C@H]2C(C)C)C1 ZINC000895996938 1025051086 /nfs/dbraw/zinc/05/10/86/1025051086.db2.gz VRXICYLPOHKGOZ-INIZCTEOSA-N 1 1 339.863 3.655 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cn(C)cn2)cc1 ZINC000898045273 1033284978 /nfs/dbraw/zinc/28/49/78/1033284978.db2.gz LBBHZODTNCLKLK-UHFFFAOYSA-N 1 1 334.467 3.736 20 10 EHCDMO CC(C)CNC(=O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176677851 1026452369 /nfs/dbraw/zinc/45/23/69/1026452369.db2.gz XLHSXCQTLGEGMP-QGZVFWFLSA-N 1 1 340.467 3.728 20 10 EHCDMO [O-]c1c(Cl)cccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192935223 1026645401 /nfs/dbraw/zinc/64/54/01/1026645401.db2.gz HIFPWTDNPMIFRW-INIZCTEOSA-N 1 1 330.859 3.657 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccc(F)cc1[O-] ZINC000359872331 1027861912 /nfs/dbraw/zinc/86/19/12/1027861912.db2.gz OSMCEVXXPSLTOJ-NBQZKYEYSA-N 1 1 328.431 3.875 20 10 EHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(OC)c(OC)cc2O)cc1 ZINC000159491586 1030234091 /nfs/dbraw/zinc/23/40/91/1030234091.db2.gz XFINXRXTTCFEFE-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO CC(C)(C)n1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cn1 ZINC000160207852 1030599235 /nfs/dbraw/zinc/59/92/35/1030599235.db2.gz VHYIVXMQAKJONW-GOSISDBHSA-N 1 1 343.471 3.525 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000278494574 1031104774 /nfs/dbraw/zinc/10/47/74/1031104774.db2.gz MAFILSGFHCRGNG-SJCJKPOMSA-N 1 1 342.395 3.722 20 10 EHCDMO C[C@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278654454 1031842670 /nfs/dbraw/zinc/84/26/70/1031842670.db2.gz IGWDLMXJNCROJK-UPONEAKYSA-N 1 1 332.149 3.663 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc(=O)[nH]2)c(C(F)(F)F)c1 ZINC000897392337 1032030653 /nfs/dbraw/zinc/03/06/53/1032030653.db2.gz XWXGODFBLGHYSX-UHFFFAOYSA-N 1 1 339.361 3.504 20 10 EHCDMO CCC[N@H+](Cc1cc(Cl)cc(OC)c1O)C[C@@H]1CCCCO1 ZINC000761193977 1034379473 /nfs/dbraw/zinc/37/94/73/1034379473.db2.gz NTNULQULLJGKQS-HNNXBMFYSA-N 1 1 327.852 3.835 20 10 EHCDMO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000186652732 1035678826 /nfs/dbraw/zinc/67/88/26/1035678826.db2.gz DQUVSJOJWCLNBF-CWTRNNRKSA-N 1 1 343.377 3.844 20 10 EHCDMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3cc(C)cc(C(C)(C)C)c3O)[C@H]2C1 ZINC000165224817 1036338699 /nfs/dbraw/zinc/33/86/99/1036338699.db2.gz ALIFKBKJRXDJOI-NEWSRXKRSA-N 1 1 347.499 3.766 20 10 EHCDMO CC(C)c1cnc(C[NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)s1 ZINC000898450102 1039046528 /nfs/dbraw/zinc/04/65/28/1039046528.db2.gz NJPJTKLVHFQAPU-KRWDZBQOSA-N 1 1 346.544 3.725 20 10 EHCDMO Cc1nc([C@H](C)[NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)c(C)s1 ZINC000898450431 1039048756 /nfs/dbraw/zinc/04/87/56/1039048756.db2.gz RIPSGSYACHRNAM-SCLBCKFNSA-N 1 1 346.544 3.779 20 10 EHCDMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)n1 ZINC000162420693 1039883997 /nfs/dbraw/zinc/88/39/97/1039883997.db2.gz ARUXBEJQRJBWTD-UONOGXRCSA-N 1 1 349.475 3.839 20 10 EHCDMO Cc1ccc(C[NH+]2CCOCC2)cc1NCc1ccc(N(C)C)cc1 ZINC000151154990 1040628822 /nfs/dbraw/zinc/62/88/22/1040628822.db2.gz UIAQMYMYNHUJEM-UHFFFAOYSA-N 1 1 339.483 3.505 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc(F)c1F ZINC001143607667 1040997757 /nfs/dbraw/zinc/99/77/57/1040997757.db2.gz UYZSPGTXUPQJAB-UHFFFAOYSA-N 1 1 346.421 3.742 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)c1O ZINC000164204734 1041219785 /nfs/dbraw/zinc/21/97/85/1041219785.db2.gz MPZZYCSCLLERPF-BEFAXECRSA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1O ZINC000164191783 1041222784 /nfs/dbraw/zinc/22/27/84/1041222784.db2.gz DQWMNWFCXZYJRA-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC000164191913 1041222877 /nfs/dbraw/zinc/22/28/77/1041222877.db2.gz DQWMNWFCXZYJRA-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO C[C@@H]([NH2+]CCCC(=O)N1CCc2ccccc21)c1ccc(F)cc1O ZINC000186021079 1127235538 /nfs/dbraw/zinc/23/55/38/1127235538.db2.gz FJFWZERLNWNIOE-CQSZACIVSA-N 1 1 342.414 3.551 20 10 EHCDMO C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963296 1127559721 /nfs/dbraw/zinc/55/97/21/1127559721.db2.gz CKABODVOHMHAIL-IOMROCGXSA-N 1 1 327.516 3.954 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963296 1127559724 /nfs/dbraw/zinc/55/97/24/1127559724.db2.gz CKABODVOHMHAIL-IOMROCGXSA-N 1 1 327.516 3.954 20 10 EHCDMO COc1ccc([C@@H]2C[C@@H]([N@@H+](C)Cc3ccccc3O)CCO2)cc1 ZINC001168665126 1128744960 /nfs/dbraw/zinc/74/49/60/1128744960.db2.gz MJIBROKVSDWKHQ-PXNSSMCTSA-N 1 1 327.424 3.753 20 10 EHCDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000763381420 1122222670 /nfs/dbraw/zinc/22/26/70/1122222670.db2.gz QGSDVDHTLLJRKY-UHFFFAOYSA-N 1 1 342.458 3.911 20 10 EHCDMO Cc1cccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)[nH+]1 ZINC000916840129 1122364417 /nfs/dbraw/zinc/36/44/17/1122364417.db2.gz NKCYXWSCMIVZIA-UHFFFAOYSA-N 1 1 326.400 3.901 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(F)cc1F ZINC000917013975 1122438992 /nfs/dbraw/zinc/43/89/92/1122438992.db2.gz KKGAHENMONKSJS-HXUWFJFHSA-N 1 1 348.437 3.975 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2COc3ccccc3O2)C2CC2)cc1 ZINC000917073954 1122470818 /nfs/dbraw/zinc/47/08/18/1122470818.db2.gz JVHAXJIFXOATPC-IBGZPJMESA-N 1 1 338.451 3.557 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1 ZINC000917075469 1122473205 /nfs/dbraw/zinc/47/32/05/1122473205.db2.gz WQEZOIJTFUFQRX-UHFFFAOYSA-N 1 1 340.467 3.950 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCO[C@@H]3CCCC[C@@H]3C)CC2)cc1 ZINC000917088186 1122485391 /nfs/dbraw/zinc/48/53/91/1122485391.db2.gz RORKHKDQUNTYLY-GHTZIAJQSA-N 1 1 346.515 3.803 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc(OC)c1 ZINC000919956297 1123245886 /nfs/dbraw/zinc/24/58/86/1123245886.db2.gz IQWPBARKHGIYGD-UHFFFAOYSA-N 1 1 338.407 3.590 20 10 EHCDMO 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COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H](C)N(C)Cc2ccccc2)c1 ZINC000379636044 1132177955 /nfs/dbraw/zinc/17/79/55/1132177955.db2.gz WXMJZNCBOXBMBP-IAGOWNOFSA-N 1 1 342.483 3.962 20 10 EHCDMO CC[N@H+](CCCO)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000746488181 1133052082 /nfs/dbraw/zinc/05/20/82/1133052082.db2.gz BHRAQLRUJAEEOY-UHFFFAOYSA-N 1 1 340.427 3.745 20 10 EHCDMO CC[N@@H+](CCCO)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000746488181 1133052087 /nfs/dbraw/zinc/05/20/87/1133052087.db2.gz BHRAQLRUJAEEOY-UHFFFAOYSA-N 1 1 340.427 3.745 20 10 EHCDMO CCOc1cccc(C[N@H+](C)CC(=O)Nc2ccccc2Cl)c1O ZINC000768170909 1133104219 /nfs/dbraw/zinc/10/42/19/1133104219.db2.gz YEQZEWIWYFWEFZ-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)c1O ZINC000768170909 1133104222 /nfs/dbraw/zinc/10/42/22/1133104222.db2.gz YEQZEWIWYFWEFZ-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000768209290 1133108623 /nfs/dbraw/zinc/10/86/23/1133108623.db2.gz 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CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc2c(cc1O)OCO2 ZINC000768357957 1133129600 /nfs/dbraw/zinc/12/96/00/1133129600.db2.gz RUXKUJFNUCQXRR-UHFFFAOYSA-N 1 1 342.439 3.598 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CN1Cc1ccccc1 ZINC001178109940 1133132393 /nfs/dbraw/zinc/13/23/93/1133132393.db2.gz YVGZEMHJUSXZJB-UKRRQHHQSA-N 1 1 348.849 3.937 20 10 EHCDMO CN(CC[N@@H+](C)Cc1c(O)ccc2ccccc21)C(=O)OC(C)(C)C ZINC000768460741 1133144102 /nfs/dbraw/zinc/14/41/02/1133144102.db2.gz ONYZGMXTDABMFT-UHFFFAOYSA-N 1 1 344.455 3.844 20 10 EHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc(OC)cc2OC)c1O ZINC000768491631 1133148943 /nfs/dbraw/zinc/14/89/43/1133148943.db2.gz CWKBRCLEEWFTTM-UHFFFAOYSA-N 1 1 345.439 3.830 20 10 EHCDMO CCOc1cccc(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1O ZINC000768914359 1133202256 /nfs/dbraw/zinc/20/22/56/1133202256.db2.gz WUFOYAHZADKASF-SOLBZPMBSA-N 1 1 332.488 3.628 20 10 EHCDMO C[N@@H+](Cc1cccc(C(N)=O)c1)Cc1cc(-c2ccccc2)ccc1O ZINC000768926826 1133204996 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CN(Cc1cccs1)c1ccc(CN2CC[C@@H]3C[N@H+](C)C[C@H]32)cc1 ZINC001181956340 1133556049 /nfs/dbraw/zinc/55/60/49/1133556049.db2.gz ICFFIORWVGWPLF-YLJYHZDGSA-N 1 1 341.524 3.520 20 10 EHCDMO CN(Cc1cccs1)c1ccc(CN2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1 ZINC001181956340 1133556053 /nfs/dbraw/zinc/55/60/53/1133556053.db2.gz ICFFIORWVGWPLF-YLJYHZDGSA-N 1 1 341.524 3.520 20 10 EHCDMO CCC[N@H+](CCN1CCCCCC1)Cc1cc(C)cc(OC)c1O ZINC001182138649 1133577361 /nfs/dbraw/zinc/57/73/61/1133577361.db2.gz JOENYUSPBGPFKL-UHFFFAOYSA-N 1 1 334.504 3.797 20 10 EHCDMO CCC[N@@H+](CCN1CCCCCC1)Cc1cc(C)cc(OC)c1O ZINC001182138649 1133577364 /nfs/dbraw/zinc/57/73/64/1133577364.db2.gz JOENYUSPBGPFKL-UHFFFAOYSA-N 1 1 334.504 3.797 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1 ZINC001182160357 1133580705 /nfs/dbraw/zinc/58/07/05/1133580705.db2.gz ITYZOORUZNOJPF-YXSMGJEKSA-N 1 1 347.506 3.903 20 10 EHCDMO Cc1cccc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[nH+]1 ZINC000771755985 1133592287 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CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)O[C@H]2C=CCC2)C1 ZINC000774187121 1133628933 /nfs/dbraw/zinc/62/89/33/1133628933.db2.gz NWILVBGZYZCTSM-INIZCTEOSA-N 1 1 338.451 3.670 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774220374 1133641027 /nfs/dbraw/zinc/64/10/27/1133641027.db2.gz XTZYJKYWAJTUAF-GARJFASQSA-N 1 1 329.271 3.975 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001182909370 1133748600 /nfs/dbraw/zinc/74/86/00/1133748600.db2.gz GMZPCVJFKZPGMP-SFHVURJKSA-N 1 1 335.806 3.668 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001182909370 1133748605 /nfs/dbraw/zinc/74/86/05/1133748605.db2.gz GMZPCVJFKZPGMP-SFHVURJKSA-N 1 1 335.806 3.668 20 10 EHCDMO CCOC(=O)c1sc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nc1C ZINC000785804178 1133753705 /nfs/dbraw/zinc/75/37/05/1133753705.db2.gz HNCFQWANHDQUMW-ZDUSSCGKSA-N 1 1 347.484 3.545 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)cc1F ZINC001183801579 1133860067 /nfs/dbraw/zinc/86/00/67/1133860067.db2.gz SOWQUAPBFBXUFO-UZLBHIALSA-N 1 1 328.406 3.804 20 10 EHCDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC001183918715 1133879016 /nfs/dbraw/zinc/87/90/16/1133879016.db2.gz BWJSPFWOUMBYFF-SUMWQHHRSA-N 1 1 344.386 3.941 20 10 EHCDMO CN(C)c1ccc([C@H](CNCc2ccc(Cl)cc2F)[NH+](C)C)cc1 ZINC001184218907 1133910222 /nfs/dbraw/zinc/91/02/22/1133910222.db2.gz QKIAAIXIPUWOBE-IBGZPJMESA-N 1 1 349.881 3.938 20 10 EHCDMO COC1CC[NH+](CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 ZINC000788458632 1134127133 /nfs/dbraw/zinc/12/71/33/1134127133.db2.gz BSSYLDUUGOSUKZ-UHFFFAOYSA-N 1 1 344.430 3.527 20 10 EHCDMO C[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1cccc(C(F)(F)F)c1O ZINC000788594680 1134148944 /nfs/dbraw/zinc/14/89/44/1134148944.db2.gz XKMQESHZPDAMHK-SECBINFHSA-N 1 1 344.299 3.556 20 10 EHCDMO C[C@H]([NH2+]CCN(C)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788595794 1134149512 /nfs/dbraw/zinc/14/95/12/1134149512.db2.gz VVBBMHKPGUEAQM-LBPRGKRZSA-N 1 1 330.394 3.936 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CCCCCO)c(C)n1-c1cccc(C)c1 ZINC000789343227 1134259542 /nfs/dbraw/zinc/25/95/42/1134259542.db2.gz WPZLUETUSKFFHI-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CCCCCO)c(C)n1-c1cccc(C)c1 ZINC000789343227 1134259547 /nfs/dbraw/zinc/25/95/47/1134259547.db2.gz WPZLUETUSKFFHI-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H]3[C@@H]3CCCO3)c2c1 ZINC000789504272 1134287207 /nfs/dbraw/zinc/28/72/07/1134287207.db2.gz JAVLNDDLESOWJB-QUCCMNQESA-N 1 1 327.424 3.697 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000775117788 1134331640 /nfs/dbraw/zinc/33/16/40/1134331640.db2.gz HESOMIGOKAHDNN-VIFPVBQESA-N 1 1 336.310 3.520 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc(F)cc1O ZINC000796694220 1134343296 /nfs/dbraw/zinc/34/32/96/1134343296.db2.gz LADFSZCCQBOZKU-SFHVURJKSA-N 1 1 325.387 3.958 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)OC3(CCOCC3)C2)cc1C(C)C ZINC000790398856 1134415888 /nfs/dbraw/zinc/41/58/88/1134415888.db2.gz XYMDHRLXJJWYRU-INIZCTEOSA-N 1 1 333.472 3.594 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCOc1ccc(F)c(F)c1 ZINC000790960054 1134485247 /nfs/dbraw/zinc/48/52/47/1134485247.db2.gz SGCMYTLQJKDDLU-UHFFFAOYSA-N 1 1 331.721 3.632 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)cc1 ZINC000775189233 1134497857 /nfs/dbraw/zinc/49/78/57/1134497857.db2.gz FYTOCFGMPJGLLA-GOSISDBHSA-N 1 1 326.488 3.646 20 10 EHCDMO Oc1ccc(Cl)c(F)c1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000792167460 1134661217 /nfs/dbraw/zinc/66/12/17/1134661217.db2.gz UAWANCCJPSGNRA-ZDUSSCGKSA-N 1 1 326.843 3.635 20 10 EHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@@H]1OCCc2ccccc21 ZINC000792167380 1134661456 /nfs/dbraw/zinc/66/14/56/1134661456.db2.gz RGRXSVCDFCHTHV-KRWDZBQOSA-N 1 1 335.806 3.931 20 10 EHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@@H]1OCCc2ccccc21 ZINC000792167380 1134661460 /nfs/dbraw/zinc/66/14/60/1134661460.db2.gz RGRXSVCDFCHTHV-KRWDZBQOSA-N 1 1 335.806 3.931 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)Nc1ccc(OC)cc1 ZINC000772798222 1134692636 /nfs/dbraw/zinc/69/26/36/1134692636.db2.gz QNJFJIUESJGRAX-HNNXBMFYSA-N 1 1 342.439 3.640 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792825694 1134796991 /nfs/dbraw/zinc/79/69/91/1134796991.db2.gz YSTGQUZMTGIIMI-CYBMUJFWSA-N 1 1 330.394 3.630 20 10 EHCDMO Cc1cnc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)s1 ZINC000792987698 1134834536 /nfs/dbraw/zinc/83/45/36/1134834536.db2.gz SILLVDJADGEJHV-UHFFFAOYSA-N 1 1 329.391 3.826 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1O ZINC000793605822 1134969054 /nfs/dbraw/zinc/96/90/54/1134969054.db2.gz RREGYSAKPUOFMG-FQEVSTJZSA-N 1 1 346.471 3.534 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1 ZINC001129679266 1135134751 /nfs/dbraw/zinc/13/47/51/1135134751.db2.gz LOMNWDIVWRMXLJ-HXUWFJFHSA-N 1 1 339.483 3.649 20 10 EHCDMO CC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc(Cl)c1[O-] ZINC000806138095 1135390090 /nfs/dbraw/zinc/39/00/90/1135390090.db2.gz VQZFAAPFCPIHEB-KRWDZBQOSA-N 1 1 340.895 3.587 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](CO)c1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000806178530 1135411747 /nfs/dbraw/zinc/41/17/47/1135411747.db2.gz HHMDRQZKFLKROK-JQWIXIFHSA-N 1 1 341.238 3.521 20 10 EHCDMO COC(=O)[C@H](C)C[N@@H+](Cc1ccccc1)Cc1cccc(C)c1O ZINC000775651979 1135421554 /nfs/dbraw/zinc/42/15/54/1135421554.db2.gz UHQZMXGJQHWRQZ-MRXNPFEDSA-N 1 1 327.424 3.512 20 10 EHCDMO CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775657469 1135423632 /nfs/dbraw/zinc/42/36/32/1135423632.db2.gz BASDNBKCSGLFAY-UHFFFAOYSA-N 1 1 328.859 3.737 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccc(C)c2O)C[C@@H]2CCCO2)c1 ZINC000775662688 1135441666 /nfs/dbraw/zinc/44/16/66/1135441666.db2.gz GXFATWGZUVDKFG-FQEVSTJZSA-N 1 1 341.451 3.890 20 10 EHCDMO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775680471 1135504297 /nfs/dbraw/zinc/50/42/97/1135504297.db2.gz FUCMHWGPQVDXGV-SFHVURJKSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775680471 1135504300 /nfs/dbraw/zinc/50/43/00/1135504300.db2.gz FUCMHWGPQVDXGV-SFHVURJKSA-N 1 1 335.495 3.558 20 10 EHCDMO COC1CCC([N@@H+](C)Cc2cc(Br)cc(C)c2O)CC1 ZINC000775699312 1135532221 /nfs/dbraw/zinc/53/22/21/1135532221.db2.gz CVAYNIBIMMDHLF-UHFFFAOYSA-N 1 1 342.277 3.853 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@@H]2C)c1 ZINC000775720951 1135570953 /nfs/dbraw/zinc/57/09/53/1135570953.db2.gz QQNGAMJQNMOMBK-KKSFZXQISA-N 1 1 341.451 3.980 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1O ZINC000775725982 1135577803 /nfs/dbraw/zinc/57/78/03/1135577803.db2.gz VQQQFVREURKYKM-LBPRGKRZSA-N 1 1 325.836 3.518 20 10 EHCDMO Cc1cc(F)ccc1[C@@H](O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000747523973 1135715575 /nfs/dbraw/zinc/71/55/75/1135715575.db2.gz BUCSMOGFVWLTOS-NRFANRHFSA-N 1 1 342.458 3.898 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc(C)c1O ZINC000809538878 1135849066 /nfs/dbraw/zinc/84/90/66/1135849066.db2.gz UUOQSTHGVVMNLF-IBGZPJMESA-N 1 1 341.451 3.896 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cnc([C@@H](C)O)s2)cc1 ZINC000809540805 1135849259 /nfs/dbraw/zinc/84/92/59/1135849259.db2.gz IUDKCRLNEDVWQO-CQSZACIVSA-N 1 1 333.501 3.675 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnc([C@@H](C)O)s2)cc1 ZINC000809540805 1135849263 /nfs/dbraw/zinc/84/92/63/1135849263.db2.gz IUDKCRLNEDVWQO-CQSZACIVSA-N 1 1 333.501 3.675 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CC=C(c3ccnn3C)CC2)cc1F ZINC000809690134 1135867503 /nfs/dbraw/zinc/86/75/03/1135867503.db2.gz IJEPJEZHPMLDHQ-UHFFFAOYSA-N 1 1 342.462 3.695 20 10 EHCDMO C[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703666 1135874544 /nfs/dbraw/zinc/87/45/44/1135874544.db2.gz OENPVWDOMSXYAS-WIYYLYMNSA-N 1 1 327.516 3.736 20 10 EHCDMO C[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809703666 1135874546 /nfs/dbraw/zinc/87/45/46/1135874546.db2.gz OENPVWDOMSXYAS-WIYYLYMNSA-N 1 1 327.516 3.736 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2COC(=O)NC2CCCCC2)c1 ZINC000809719283 1135877261 /nfs/dbraw/zinc/87/72/61/1135877261.db2.gz DOYFFSUKXIQYFZ-SFHVURJKSA-N 1 1 346.471 3.724 20 10 EHCDMO CCOc1cccc(C[N@@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)c1O ZINC000809774329 1135881187 /nfs/dbraw/zinc/88/11/87/1135881187.db2.gz KLAMAHRSGJDDBJ-IRXDYDNUSA-N 1 1 343.467 3.777 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000809751660 1135885647 /nfs/dbraw/zinc/88/56/47/1135885647.db2.gz HIUOQCSDQPYYCB-KRWDZBQOSA-N 1 1 340.471 3.938 20 10 EHCDMO Oc1ccccc1C[N@@H+]1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000809751660 1135885651 /nfs/dbraw/zinc/88/56/51/1135885651.db2.gz HIUOQCSDQPYYCB-KRWDZBQOSA-N 1 1 340.471 3.938 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000809751660 1135885653 /nfs/dbraw/zinc/88/56/53/1135885653.db2.gz HIUOQCSDQPYYCB-KRWDZBQOSA-N 1 1 340.471 3.938 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCCC[C@H](C)C2)c1O ZINC000776000918 1135916601 /nfs/dbraw/zinc/91/66/01/1135916601.db2.gz ZXKJYOQYHPMVOZ-NSHDSACASA-N 1 1 328.250 3.785 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1F ZINC000776013357 1135917858 /nfs/dbraw/zinc/91/78/58/1135917858.db2.gz FZNCKGPQNDGXGZ-OAQYLSRUSA-N 1 1 340.442 3.913 20 10 EHCDMO Cc1c2ccccc2n(C)c1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC001201433590 1136023976 /nfs/dbraw/zinc/02/39/76/1136023976.db2.gz OWLVHJUVDZHMIC-UHFFFAOYSA-N 1 1 328.485 3.926 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](n3cc(C)cn3)C2)cc1F ZINC000811518145 1136098144 /nfs/dbraw/zinc/09/81/44/1136098144.db2.gz HWHIWIPPHQRTTD-QGZVFWFLSA-N 1 1 330.451 3.624 20 10 EHCDMO CCOc1cccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1O ZINC000811508332 1136101635 /nfs/dbraw/zinc/10/16/35/1136101635.db2.gz MHQNRTNGSRQFNW-GOSISDBHSA-N 1 1 338.451 3.776 20 10 EHCDMO COc1cc(C[NH2+][C@H](C)c2nnc(C)s2)c(O)c(C(C)(C)C)c1 ZINC000850246211 1136226328 /nfs/dbraw/zinc/22/63/28/1136226328.db2.gz IHOOJHYYNZHZMN-SNVBAGLBSA-N 1 1 335.473 3.709 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cccnc1N1CCCC1)c1ccc(F)cc1O ZINC000850502580 1136272599 /nfs/dbraw/zinc/27/25/99/1136272599.db2.gz XFYMSAKYXJIQHH-QGZVFWFLSA-N 1 1 329.419 3.767 20 10 EHCDMO CCn1cc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)nn1 ZINC000850522538 1136276493 /nfs/dbraw/zinc/27/64/93/1136276493.db2.gz UCCFEQUWFCHERN-MRXNPFEDSA-N 1 1 327.476 3.529 20 10 EHCDMO CNC(=O)CC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CCCCC1 ZINC000850555342 1136284956 /nfs/dbraw/zinc/28/49/56/1136284956.db2.gz KYYIATPHVZFBKH-CYBMUJFWSA-N 1 1 338.879 3.783 20 10 EHCDMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCN(C)CC3)cc1)CCC2 ZINC000813790119 1136363062 /nfs/dbraw/zinc/36/30/62/1136363062.db2.gz GYNZVDMVXRVYNC-HSZRJFAPSA-N 1 1 349.522 3.914 20 10 EHCDMO COc1cc2c(cc1OC)C[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC2 ZINC000815013896 1136537658 /nfs/dbraw/zinc/53/76/58/1136537658.db2.gz YYNFFLHUAHCJJA-UHFFFAOYSA-N 1 1 340.467 3.637 20 10 EHCDMO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H](C)c2cc(C)ccc2O)cc1 ZINC000854223355 1136598815 /nfs/dbraw/zinc/59/88/15/1136598815.db2.gz DILZGXMICWJFBK-BPAFIMBUSA-N 1 1 340.467 3.506 20 10 EHCDMO Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000815575828 1136613216 /nfs/dbraw/zinc/61/32/16/1136613216.db2.gz BJQGUZRUUKKTIT-RYUDHWBXSA-N 1 1 341.377 3.903 20 10 EHCDMO Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)[nH]n1 ZINC000815597049 1136616936 /nfs/dbraw/zinc/61/69/36/1136616936.db2.gz LJFLUYZPNSMSDG-GXSJLCMTSA-N 1 1 327.350 3.724 20 10 EHCDMO CCOC(=O)CCC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816517498 1136730284 /nfs/dbraw/zinc/73/02/84/1136730284.db2.gz SCWYRZGMAJJIED-UHFFFAOYSA-N 1 1 343.826 3.740 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12 ZINC000816560004 1136736657 /nfs/dbraw/zinc/73/66/57/1136736657.db2.gz BNKSMFSPLSMIAM-MRVWCRGKSA-N 1 1 333.881 3.654 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000816558735 1136736698 /nfs/dbraw/zinc/73/66/98/1136736698.db2.gz JYSFAWFJVULQNN-IUIKQTSFSA-N 1 1 325.811 3.622 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1OC ZINC000817366566 1136803808 /nfs/dbraw/zinc/80/38/08/1136803808.db2.gz YNJDVLXPIOWRLV-NSHDSACASA-N 1 1 333.350 3.574 20 10 EHCDMO FC(F)(F)C[C@@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000817413049 1136805979 /nfs/dbraw/zinc/80/59/79/1136805979.db2.gz RRCHTENJYQHFMF-INIZCTEOSA-N 1 1 342.405 3.688 20 10 EHCDMO CCCN1C[C@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CC1=O ZINC000817588977 1136827131 /nfs/dbraw/zinc/82/71/31/1136827131.db2.gz KMDPMGJMVOYHPX-MNOVXSKESA-N 1 1 345.270 3.608 20 10 EHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000817940750 1136848256 /nfs/dbraw/zinc/84/82/56/1136848256.db2.gz HREVHNLLKKWHOZ-UXHICEINSA-N 1 1 341.499 3.810 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCCc3cc(F)ccc32)cc1 ZINC000817940690 1136848652 /nfs/dbraw/zinc/84/86/52/1136848652.db2.gz GVMVPRNBVYHFES-PMACEKPBSA-N 1 1 327.447 3.559 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000817943527 1136849442 /nfs/dbraw/zinc/84/94/42/1136849442.db2.gz UXCYUKXFKOEYMA-GUYCJALGSA-N 1 1 340.496 3.713 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817987765 1136855307 /nfs/dbraw/zinc/85/53/07/1136855307.db2.gz WTCSEUWAUPKMLY-NCZKRNLISA-N 1 1 342.405 3.840 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)c1ncc(C(=O)OC)s1)c1ccc(N(C)C)cc1 ZINC000818357641 1136875600 /nfs/dbraw/zinc/87/56/00/1136875600.db2.gz DCBMGBNFFCDQSA-IUODEOHRSA-N 1 1 347.484 3.798 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000818358292 1136875864 /nfs/dbraw/zinc/87/58/64/1136875864.db2.gz SXOQBPUUFOLNGH-NEPJUHHUSA-N 1 1 334.441 3.664 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](n3ccnn3)C1)oc1ccccc12 ZINC000819898328 1136965579 /nfs/dbraw/zinc/96/55/79/1136965579.db2.gz WWVUPOZZYMBOOC-HNNXBMFYSA-N 1 1 348.406 3.720 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859613144 1137022947 /nfs/dbraw/zinc/02/29/47/1137022947.db2.gz YPGUPTOWOUTEFT-MAUKXSAKSA-N 1 1 332.488 3.552 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)cc1 ZINC000824237072 1137127769 /nfs/dbraw/zinc/12/77/69/1137127769.db2.gz OPJBNBKGLVAFTM-IBGZPJMESA-N 1 1 344.524 3.977 20 10 EHCDMO CC(C)COC1CC[NH+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862230686 1137133581 /nfs/dbraw/zinc/13/35/81/1137133581.db2.gz GBRNSOUKAQMAGW-UHFFFAOYSA-N 1 1 326.431 3.668 20 10 EHCDMO Cc1cnc(CC[N@H+](C)Cc2c(O)cccc2Br)s1 ZINC000862249788 1137135065 /nfs/dbraw/zinc/13/50/65/1137135065.db2.gz COROLKVIYGZZTD-UHFFFAOYSA-N 1 1 341.274 3.594 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1F ZINC000862370458 1137140941 /nfs/dbraw/zinc/14/09/41/1137140941.db2.gz MDQQOWGWLBWGNX-ROUUACIJSA-N 1 1 336.426 3.564 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1F ZINC000862370458 1137140942 /nfs/dbraw/zinc/14/09/42/1137140942.db2.gz MDQQOWGWLBWGNX-ROUUACIJSA-N 1 1 336.426 3.564 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1F ZINC000862370456 1137140945 /nfs/dbraw/zinc/14/09/45/1137140945.db2.gz MDQQOWGWLBWGNX-MSOLQXFVSA-N 1 1 336.426 3.564 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1F ZINC000862370456 1137140946 /nfs/dbraw/zinc/14/09/46/1137140946.db2.gz MDQQOWGWLBWGNX-MSOLQXFVSA-N 1 1 336.426 3.564 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)c1 ZINC000862485146 1137146744 /nfs/dbraw/zinc/14/67/44/1137146744.db2.gz HXGADADCMIDJSX-WMLDXEAASA-N 1 1 349.471 3.591 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCCN(c3nccs3)CC2)cc1Cl ZINC000824621620 1137146824 /nfs/dbraw/zinc/14/68/24/1137146824.db2.gz UOHKJLREDYIFRG-UHFFFAOYSA-N 1 1 337.876 3.523 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CC(Cc2cccs2)C1 ZINC000862538932 1137149007 /nfs/dbraw/zinc/14/90/07/1137149007.db2.gz WFJQOOGEYQBUAF-UHFFFAOYSA-N 1 1 338.270 3.891 20 10 EHCDMO COc1cc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000824863441 1137155242 /nfs/dbraw/zinc/15/52/42/1137155242.db2.gz QPVKFEQHFZSSOC-GOEBONIOSA-N 1 1 334.504 3.613 20 10 EHCDMO c1coc([C@@H]2[N@@H+](Cc3ccc(N4CCOCC4)cc3)CC23CCC3)c1 ZINC000825104373 1137163539 /nfs/dbraw/zinc/16/35/39/1137163539.db2.gz VJTBMPCMWLMLTI-FQEVSTJZSA-N 1 1 338.451 3.843 20 10 EHCDMO CCc1ncc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)o1 ZINC000825079241 1137164812 /nfs/dbraw/zinc/16/48/12/1137164812.db2.gz OTYCEJYNTJXXFO-UHFFFAOYSA-N 1 1 327.350 3.612 20 10 EHCDMO CCOc1ccc(N(C)Cc2ccc(C[NH+]3CCOCC3)cc2)cc1 ZINC000864012265 1137211704 /nfs/dbraw/zinc/21/17/04/1137211704.db2.gz AWJIBNVKTBRLLB-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO CC[N@@H+](Cc1[nH]nc2ccc(F)cc21)Cc1ccc(N(C)C)cc1 ZINC001144200934 1137250512 /nfs/dbraw/zinc/25/05/12/1137250512.db2.gz RBGADUBCDVXGSS-UHFFFAOYSA-N 1 1 326.419 3.790 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1O ZINC000846164221 1137337529 /nfs/dbraw/zinc/33/75/29/1137337529.db2.gz NEIRWZDBBCNQEA-GFCCVEGCSA-N 1 1 334.416 3.555 20 10 EHCDMO C[C@H]1C[C@H](N(C)Cc2ccc(N(C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC001171767754 1137509372 /nfs/dbraw/zinc/50/93/72/1137509372.db2.gz PMIDPONTCDTZBP-AVRDEDQJSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767754 1137509373 /nfs/dbraw/zinc/50/93/73/1137509373.db2.gz PMIDPONTCDTZBP-AVRDEDQJSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767754 1137509374 /nfs/dbraw/zinc/50/93/74/1137509374.db2.gz PMIDPONTCDTZBP-AVRDEDQJSA-N 1 1 337.511 3.847 20 10 EHCDMO CO[C@@H](C[N@@H+](Cc1ccccc1O)C1CCCC1)C1CCOCC1 ZINC000876722582 1137659700 /nfs/dbraw/zinc/65/97/00/1137659700.db2.gz ZFYQRAWZCCAYOL-FQEVSTJZSA-N 1 1 333.472 3.578 20 10 EHCDMO CCc1nc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)cs1 ZINC000877045431 1137668587 /nfs/dbraw/zinc/66/85/87/1137668587.db2.gz CMVGWWAICACDQS-CQSZACIVSA-N 1 1 345.512 3.517 20 10 EHCDMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)c(O)c1 ZINC000877523729 1137679483 /nfs/dbraw/zinc/67/94/83/1137679483.db2.gz MRZZLJHXWRTOSK-NVXWUHKLSA-N 1 1 343.427 3.662 20 10 EHCDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)c(O)c1 ZINC000877523729 1137679484 /nfs/dbraw/zinc/67/94/84/1137679484.db2.gz MRZZLJHXWRTOSK-NVXWUHKLSA-N 1 1 343.427 3.662 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+](C)CC(=O)Nc2cccc(Cl)c2)c1 ZINC000134043527 1137936036 /nfs/dbraw/zinc/93/60/36/1137936036.db2.gz RCNJFZZYMQGXFW-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)CC(=O)Nc2cccc(Cl)c2)c1 ZINC000134043527 1137936037 /nfs/dbraw/zinc/93/60/37/1137936037.db2.gz RCNJFZZYMQGXFW-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(O[C@@H]2CCOC2)c1 ZINC000886538150 1138093100 /nfs/dbraw/zinc/09/31/00/1138093100.db2.gz CHCGOHRGBXAWQV-GOEBONIOSA-N 1 1 345.414 3.858 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886558068 1138096629 /nfs/dbraw/zinc/09/66/29/1138096629.db2.gz ASHJTKPZNUEEJB-IINYFYTJSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1c(O)cccc1F ZINC000886603722 1138100896 /nfs/dbraw/zinc/10/08/96/1138100896.db2.gz UUYZBVWPOZIOLM-BJOHPYRUSA-N 1 1 327.758 3.708 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886644842 1138105718 /nfs/dbraw/zinc/10/57/18/1138105718.db2.gz LXPCUEAMNWKEGO-HZMBPMFUSA-N 1 1 343.320 3.934 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774202 1138138261 /nfs/dbraw/zinc/13/82/61/1138138261.db2.gz JTAXCANGDMVUBG-KUHUBIRLSA-N 1 1 347.455 3.569 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnc(Cl)s1)C[C@@H]1CCCO1 ZINC000079321392 1138155045 /nfs/dbraw/zinc/15/50/45/1138155045.db2.gz ARGDAOPPAKOJLV-ZDUSSCGKSA-N 1 1 338.860 3.683 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnc(Cl)s1)C[C@@H]1CCCO1 ZINC000079321392 1138155046 /nfs/dbraw/zinc/15/50/46/1138155046.db2.gz ARGDAOPPAKOJLV-ZDUSSCGKSA-N 1 1 338.860 3.683 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)c1O ZINC000092968750 1138233081 /nfs/dbraw/zinc/23/30/81/1138233081.db2.gz KHRVCQHYNJBXJK-MRXNPFEDSA-N 1 1 341.407 3.509 20 10 EHCDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(C(C)=O)c2O)o1 ZINC000130884886 1138482789 /nfs/dbraw/zinc/48/27/89/1138482789.db2.gz IZAKWHWVPYWCJX-KRWDZBQOSA-N 1 1 347.386 3.810 20 10 EHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)cc(C(C)=O)c2O)o1 ZINC000130884886 1138482792 /nfs/dbraw/zinc/48/27/92/1138482792.db2.gz IZAKWHWVPYWCJX-KRWDZBQOSA-N 1 1 347.386 3.810 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncc(Br)s1 ZINC000179194814 1139741094 /nfs/dbraw/zinc/74/10/94/1139741094.db2.gz QWNVDXQNAHCPIC-JTQLQIEISA-N 1 1 340.290 3.822 20 10 EHCDMO C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179575530 1139766406 /nfs/dbraw/zinc/76/64/06/1139766406.db2.gz DMLWOFYAPIJWCQ-GJZGRUSLSA-N 1 1 334.460 3.517 20 10 EHCDMO COc1cc(O)c(C[NH+](Cc2ccco2)Cc2ccco2)cc1OC ZINC000179589883 1139767307 /nfs/dbraw/zinc/76/73/07/1139767307.db2.gz XKRRULWGIKITIC-UHFFFAOYSA-N 1 1 343.379 3.798 20 10 EHCDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(OC)ccc1O)CCC2 ZINC000180544627 1139844434 /nfs/dbraw/zinc/84/44/34/1139844434.db2.gz LUIHSZNFBBHRPG-OAHLLOKOSA-N 1 1 332.469 3.929 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)C[C@H](C)c2nccs2)c1O ZINC000183994369 1140072531 /nfs/dbraw/zinc/07/25/31/1140072531.db2.gz HGFNHGDQELPTDZ-JTQLQIEISA-N 1 1 338.860 3.940 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@H](C)c2nccs2)c1O ZINC000183994369 1140072534 /nfs/dbraw/zinc/07/25/34/1140072534.db2.gz HGFNHGDQELPTDZ-JTQLQIEISA-N 1 1 338.860 3.940 20 10 EHCDMO CCCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185048366 1140133385 /nfs/dbraw/zinc/13/33/85/1140133385.db2.gz BIQNHLIMEYEJQV-ZDUSSCGKSA-N 1 1 330.403 3.522 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOC2=O)cc1)c1ccc(F)cc1O ZINC000185160342 1140138358 /nfs/dbraw/zinc/13/83/58/1140138358.db2.gz DBGBCAZWHLAUAA-QWHCGFSZSA-N 1 1 344.386 3.900 20 10 EHCDMO COc1ccccc1N1CCC([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000185244537 1140141420 /nfs/dbraw/zinc/14/14/20/1140141420.db2.gz SJMMYNPCGWSRDM-CQSZACIVSA-N 1 1 344.430 3.860 20 10 EHCDMO C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1[O-] ZINC000185356759 1140146395 /nfs/dbraw/zinc/14/63/95/1140146395.db2.gz VLVPQJQEJNDIOD-GFCCVEGCSA-N 1 1 341.293 3.537 20 10 EHCDMO COc1ccc(O)c([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000185634453 1140159935 /nfs/dbraw/zinc/15/99/35/1140159935.db2.gz AQLJGWWUWFZYRA-OAHLLOKOSA-N 1 1 332.488 3.849 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CC2(CCC2)C(=O)O1 ZINC000191895420 1140491668 /nfs/dbraw/zinc/49/16/68/1140491668.db2.gz QUNHHNGYGCKMNY-IBGZPJMESA-N 1 1 342.483 3.595 20 10 EHCDMO C[C@H]([NH2+]CCCO[C@@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000192951886 1140556575 /nfs/dbraw/zinc/55/65/75/1140556575.db2.gz NEVAKFYQEGKKMF-WDEREUQCSA-N 1 1 334.243 3.545 20 10 EHCDMO COCCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000270986618 1141290203 /nfs/dbraw/zinc/29/02/03/1141290203.db2.gz GLLGIGWOJGMXAP-UHFFFAOYSA-N 1 1 343.471 3.570 20 10 EHCDMO CC(=O)Nc1ccccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000271059632 1141302509 /nfs/dbraw/zinc/30/25/09/1141302509.db2.gz WBWFOFZNFQXOAW-UHFFFAOYSA-N 1 1 337.467 3.876 20 10 EHCDMO CC[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(N(C)C)cc1 ZINC000271452189 1141370545 /nfs/dbraw/zinc/37/05/45/1141370545.db2.gz IIOLMYPMLLKJQZ-ROUUACIJSA-N 1 1 334.410 3.805 20 10 EHCDMO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)[nH]1 ZINC000271543414 1141393634 /nfs/dbraw/zinc/39/36/34/1141393634.db2.gz RDANAQPIIGXKDR-KBPBESRZSA-N 1 1 345.466 3.908 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Br)ccc2O)s1 ZINC000274285398 1141493618 /nfs/dbraw/zinc/49/36/18/1141493618.db2.gz ZEQGBBGGJMXSMM-SFYZADRCSA-N 1 1 342.262 3.726 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(F)cc1F ZINC000051017125 214074284 /nfs/dbraw/zinc/07/42/84/214074284.db2.gz DQHWNQPMIRGGGA-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO CC(C)[N@@H+](Cc1cn(C)nc1C(F)F)Cc1ccc(N(C)C)cc1 ZINC000274518491 1014171670 /nfs/dbraw/zinc/17/16/70/1014171670.db2.gz XKTHCWLBMDUZLP-UHFFFAOYSA-N 1 1 336.430 3.834 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001235068403 1121287931 /nfs/dbraw/zinc/28/79/31/1121287931.db2.gz GMGHHTCESTYWOM-CYBMUJFWSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001235068403 1121287934 /nfs/dbraw/zinc/28/79/34/1121287934.db2.gz GMGHHTCESTYWOM-CYBMUJFWSA-N 1 1 346.240 3.683 20 10 EHCDMO COc1cccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1O ZINC000155249182 1016356546 /nfs/dbraw/zinc/35/65/46/1016356546.db2.gz UWJBKWOAUUOKHO-KRWDZBQOSA-N 1 1 333.815 3.628 20 10 EHCDMO COc1cccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1O ZINC000155249182 1016356556 /nfs/dbraw/zinc/35/65/56/1016356556.db2.gz UWJBKWOAUUOKHO-KRWDZBQOSA-N 1 1 333.815 3.628 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000377683765 1018185472 /nfs/dbraw/zinc/18/54/72/1018185472.db2.gz TULRPQXJLXEVAN-QGZVFWFLSA-N 1 1 334.423 3.557 20 10 EHCDMO CC(C)CCO[C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707141366 1021258065 /nfs/dbraw/zinc/25/80/65/1021258065.db2.gz DDXGZMPNUPUOEQ-CYBMUJFWSA-N 1 1 342.277 3.792 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@H+](Cc3cc(F)cc(F)c3O)CC2)nn1 ZINC000894895004 1021894112 /nfs/dbraw/zinc/89/41/12/1021894112.db2.gz MRYGKGKIHDOXAK-UHFFFAOYSA-N 1 1 348.397 3.522 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3cc(F)cc(F)c3O)CC2)nn1 ZINC000894895004 1021894124 /nfs/dbraw/zinc/89/41/24/1021894124.db2.gz MRYGKGKIHDOXAK-UHFFFAOYSA-N 1 1 348.397 3.522 20 10 EHCDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCc1ccc(N(CC)CC)cc1 ZINC000843769442 1022401353 /nfs/dbraw/zinc/40/13/53/1022401353.db2.gz GMRSPELHYNUHCP-INIZCTEOSA-N 1 1 342.487 3.559 20 10 EHCDMO CO[C@]1(C)CCC[N@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894621728 1022634310 /nfs/dbraw/zinc/63/43/10/1022634310.db2.gz JCTFXCPFXZEACB-OAHLLOKOSA-N 1 1 346.240 3.685 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894621728 1022634316 /nfs/dbraw/zinc/63/43/16/1022634316.db2.gz 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CC(C)c1noc([C@@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001142527149 1033272936 /nfs/dbraw/zinc/27/29/36/1033272936.db2.gz MGBHTSYFCQUFTP-LLVKDONJSA-N 1 1 337.370 3.556 20 10 EHCDMO CC(C)c1noc([C@@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001142527149 1033272942 /nfs/dbraw/zinc/27/29/42/1033272942.db2.gz MGBHTSYFCQUFTP-LLVKDONJSA-N 1 1 337.370 3.556 20 10 EHCDMO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3nccn3C)cc2Cl)C1 ZINC000282092152 1033280302 /nfs/dbraw/zinc/28/03/02/1033280302.db2.gz RZKLTZDTNCWMHN-AWEZNQCLSA-N 1 1 332.879 3.600 20 10 EHCDMO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3ccn(C)n3)cc2Cl)C1 ZINC000281899183 1025670311 /nfs/dbraw/zinc/67/03/11/1025670311.db2.gz FMSBVFBOGFXMJD-AWEZNQCLSA-N 1 1 332.879 3.600 20 10 EHCDMO C[N@@H+](CCCCC1CCOCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000281983321 1025846787 /nfs/dbraw/zinc/84/67/87/1025846787.db2.gz MCWVDQOWLHXTIE-UHFFFAOYSA-N 1 1 346.515 3.552 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(-c2noc([C@H]3CCC[N@H+](C)C3)n2)cc1 ZINC001211877132 1025884262 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CCN1CCN(c2ccc(C[NH2+][C@H](C)c3ccccc3)cc2F)CC1 ZINC000173400537 1033303329 /nfs/dbraw/zinc/30/33/29/1033303329.db2.gz AHZYITNMRPONAT-QGZVFWFLSA-N 1 1 341.474 3.818 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1OC ZINC000179439641 1034306978 /nfs/dbraw/zinc/30/69/78/1034306978.db2.gz VOCJTOORPKNBTB-MRXNPFEDSA-N 1 1 331.387 3.886 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@]3(CCc4ccccc4O3)C2)c1O ZINC000529661870 1034382123 /nfs/dbraw/zinc/38/21/23/1034382123.db2.gz CVESUNJBFJWEJQ-OAQYLSRUSA-N 1 1 339.435 3.761 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)c1O ZINC000761213485 1034537227 /nfs/dbraw/zinc/53/72/27/1034537227.db2.gz AEDYLAIJBGOTEA-LBPRGKRZSA-N 1 1 333.815 3.837 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)c1O ZINC000761213485 1034537233 /nfs/dbraw/zinc/53/72/33/1034537233.db2.gz AEDYLAIJBGOTEA-LBPRGKRZSA-N 1 1 333.815 3.837 20 10 EHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000761225278 1034810100 /nfs/dbraw/zinc/81/01/00/1034810100.db2.gz 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C[N@@H+](Cc1c(Cl)nc2cc(Cl)ccn21)Cc1ccccc1O ZINC000809549738 1135855037 /nfs/dbraw/zinc/85/50/37/1135855037.db2.gz TXWBASLXTQNQAC-UHFFFAOYSA-N 1 1 336.222 3.979 20 10 EHCDMO C[NH+](C)CCN(Cc1ccc(F)cc1)Cc1cccc(Cl)c1O ZINC000809736333 1135878935 /nfs/dbraw/zinc/87/89/35/1135878935.db2.gz PEPRJCCBDOYZPC-UHFFFAOYSA-N 1 1 336.838 3.749 20 10 EHCDMO C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766799 1135879840 /nfs/dbraw/zinc/87/98/40/1135879840.db2.gz AYDWBIJOZOEAIV-NHYWBVRUSA-N 1 1 329.271 3.615 20 10 EHCDMO C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766799 1135879843 /nfs/dbraw/zinc/87/98/43/1135879843.db2.gz AYDWBIJOZOEAIV-NHYWBVRUSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766799 1135879847 /nfs/dbraw/zinc/87/98/47/1135879847.db2.gz AYDWBIJOZOEAIV-NHYWBVRUSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766799 1135879849 /nfs/dbraw/zinc/87/98/49/1135879849.db2.gz AYDWBIJOZOEAIV-NHYWBVRUSA-N 1 1 329.271 3.615 20 10 EHCDMO CCOc1cccc(C[N@@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)c1O ZINC000809774330 1135881432 /nfs/dbraw/zinc/88/14/32/1135881432.db2.gz KLAMAHRSGJDDBJ-SJORKVTESA-N 1 1 343.467 3.777 20 10 EHCDMO CC[N@H+](CCCN(C)C)Cc1ccc(OCc2ccccc2)cc1O ZINC000809750442 1135885265 /nfs/dbraw/zinc/88/52/65/1135885265.db2.gz WLHJMUIDBNEXFW-UHFFFAOYSA-N 1 1 342.483 3.745 20 10 EHCDMO CC[N@@H+](CCCN(C)C)Cc1ccc(OCc2ccccc2)cc1O ZINC000809750442 1135885269 /nfs/dbraw/zinc/88/52/69/1135885269.db2.gz WLHJMUIDBNEXFW-UHFFFAOYSA-N 1 1 342.483 3.745 20 10 EHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000809756517 1135886777 /nfs/dbraw/zinc/88/67/77/1135886777.db2.gz RZWIASMOAVRISH-UHFFFAOYSA-N 1 1 332.467 3.563 20 10 EHCDMO C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000809765396 1135888391 /nfs/dbraw/zinc/88/83/91/1135888391.db2.gz NHERAFWQBXMSTO-CXAGYDPISA-N 1 1 343.437 3.543 20 10 EHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000809766387 1135888893 /nfs/dbraw/zinc/88/88/93/1135888893.db2.gz XIHHGESIRJPBOR-LJQANCHMSA-N 1 1 343.446 3.640 20 10 EHCDMO C[C@@H]1C[C@H](C)C[N@@H+](CCCNCc2ccc(N3CCCC3)cc2)C1 ZINC001199329512 1135898039 /nfs/dbraw/zinc/89/80/39/1135898039.db2.gz USVZWFBYXHNNKS-KDURUIRLSA-N 1 1 329.532 3.744 20 10 EHCDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNCc2ccc(N3CCCC3)cc2)C1 ZINC001199329512 1135898043 /nfs/dbraw/zinc/89/80/43/1135898043.db2.gz USVZWFBYXHNNKS-KDURUIRLSA-N 1 1 329.532 3.744 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1 ZINC000776013882 1135920218 /nfs/dbraw/zinc/92/02/18/1135920218.db2.gz KECSGAHXLQDKNW-NRFANRHFSA-N 1 1 339.435 3.812 20 10 EHCDMO CCC[N@@H+](Cc1ccc(N(CC)CC)cc1)C1CCN(C(C)=O)CC1 ZINC001203943386 1135935775 /nfs/dbraw/zinc/93/57/75/1135935775.db2.gz YTHALAOYTZQIQL-UHFFFAOYSA-N 1 1 345.531 3.756 20 10 EHCDMO CC(C)Nc1ccc(Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC001201498244 1136028563 /nfs/dbraw/zinc/02/85/63/1136028563.db2.gz TVMTXYXQQPVVNW-UHFFFAOYSA-N 1 1 338.499 3.998 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000811513206 1136103357 /nfs/dbraw/zinc/10/33/57/1136103357.db2.gz REJDTERKVCJMRC-QGZVFWFLSA-N 1 1 328.843 3.683 20 10 EHCDMO CC[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@@H]1CCOC1 ZINC000812780536 1136246525 /nfs/dbraw/zinc/24/65/25/1136246525.db2.gz HUJJNTLFHQUJFY-GOSISDBHSA-N 1 1 327.424 3.582 20 10 EHCDMO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(Br)c1O)CC2 ZINC000850385976 1136247189 /nfs/dbraw/zinc/24/71/89/1136247189.db2.gz DNWSSGOCJKQDFW-HNNXBMFYSA-N 1 1 334.213 3.637 20 10 EHCDMO COc1cccc(C[NH2+]Cc2cccc(Br)c2O)c1C ZINC000850416663 1136253862 /nfs/dbraw/zinc/25/38/62/1136253862.db2.gz NQXLPSUBBWAVEY-UHFFFAOYSA-N 1 1 336.229 3.762 20 10 EHCDMO C[C@H]([NH2+]CCO[C@H]1CC1(F)F)c1cc(Cl)c(Cl)cc1O ZINC000850521166 1136276339 /nfs/dbraw/zinc/27/63/39/1136276339.db2.gz OJSNRSICMNVIPC-MADCSZMMSA-N 1 1 326.170 3.774 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813884417 1136372958 /nfs/dbraw/zinc/37/29/58/1136372958.db2.gz VZXPWZPNYZXHOB-PBHICJAKSA-N 1 1 332.394 3.990 20 10 EHCDMO CO[C@@H](C[N@@H+](Cc1ccccc1O)C1CCCCC1)[C@H]1CCOC1 ZINC000851769644 1136406391 /nfs/dbraw/zinc/40/63/91/1136406391.db2.gz KIPLFIZAFLRTMX-PXNSSMCTSA-N 1 1 333.472 3.578 20 10 EHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCC(=O)O1 ZINC000851879309 1136415657 /nfs/dbraw/zinc/41/56/57/1136415657.db2.gz HYMVJSAEMXDCDH-YJBOKZPZSA-N 1 1 325.408 3.661 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1 ZINC000853240465 1136521748 /nfs/dbraw/zinc/52/17/48/1136521748.db2.gz JCAUYSSJDLYROV-JTQLQIEISA-N 1 1 333.350 3.808 20 10 EHCDMO COc1cccc([C@H]2C[N@H+](Cc3ccc(N(C)C)c(C)c3)CCO2)c1 ZINC000815062253 1136545641 /nfs/dbraw/zinc/54/56/41/1136545641.db2.gz QPNWVDNTXDKGGN-OAQYLSRUSA-N 1 1 340.467 3.643 20 10 EHCDMO COc1cccc([C@H]2C[N@@H+](Cc3ccc(N(C)C)c(C)c3)CCO2)c1 ZINC000815062253 1136545646 /nfs/dbraw/zinc/54/56/46/1136545646.db2.gz QPNWVDNTXDKGGN-OAQYLSRUSA-N 1 1 340.467 3.643 20 10 EHCDMO Cc1cc(C[N@@H+]2CCC[C@@H](c3nncn3C(C)C)C2)ccc1N(C)C ZINC000815074865 1136547295 /nfs/dbraw/zinc/54/72/95/1136547295.db2.gz HLMQREZXRGZASK-GOSISDBHSA-N 1 1 341.503 3.613 20 10 EHCDMO CN(C)c1ccc(C[N@H+](CCN2CCCCCC2)C2CCC2)cc1 ZINC001170785213 1136594679 /nfs/dbraw/zinc/59/46/79/1136594679.db2.gz YZZKSROXQDTBLQ-UHFFFAOYSA-N 1 1 329.532 3.983 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCN2CCCCCC2)C2CCC2)cc1 ZINC001170785213 1136594683 /nfs/dbraw/zinc/59/46/83/1136594683.db2.gz YZZKSROXQDTBLQ-UHFFFAOYSA-N 1 1 329.532 3.983 20 10 EHCDMO C[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)N1CCCCC1 ZINC000815562480 1136610777 /nfs/dbraw/zinc/61/07/77/1136610777.db2.gz GPCYWSYENROBII-CHWSQXEVSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815586586 1136614956 /nfs/dbraw/zinc/61/49/56/1136614956.db2.gz MOOYHIPQBCSUGL-JSGCOSHPSA-N 1 1 339.357 3.838 20 10 EHCDMO CSC1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000815595466 1136616479 /nfs/dbraw/zinc/61/64/79/1136616479.db2.gz SDDPAQBZDPPWAZ-LLVKDONJSA-N 1 1 349.418 3.974 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000815632047 1136622000 /nfs/dbraw/zinc/62/20/00/1136622000.db2.gz BOXKUSQUEPPAIS-NUTKFTJISA-N 1 1 343.398 3.915 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1 ZINC000816659237 1136745864 /nfs/dbraw/zinc/74/58/64/1136745864.db2.gz GFESCVOQOHRUNR-QGZVFWFLSA-N 1 1 333.815 3.708 20 10 EHCDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000817412849 1136806263 /nfs/dbraw/zinc/80/62/63/1136806263.db2.gz POADQZDDWWIXIB-SJLPKXTDSA-N 1 1 344.524 3.835 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]C(C)(C)c2cn(C(C)C)nn2)cc1F ZINC000817420550 1136807319 /nfs/dbraw/zinc/80/73/19/1136807319.db2.gz VICLBCCTJKGCRL-UHFFFAOYSA-N 1 1 347.482 3.869 20 10 EHCDMO CCC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938356 1136847516 /nfs/dbraw/zinc/84/75/16/1136847516.db2.gz JHOZNJQFZXRXDY-SFTDATJTSA-N 1 1 341.499 3.892 20 10 EHCDMO COc1cc(C)c([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817943929 1136849661 /nfs/dbraw/zinc/84/96/61/1136849661.db2.gz WUGPAYDAMHZDML-JXFKEZNVSA-N 1 1 341.499 3.729 20 10 EHCDMO CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817964387 1136852287 /nfs/dbraw/zinc/85/22/87/1136852287.db2.gz ARIZNWHZKMFMID-AWEZNQCLSA-N 1 1 330.394 3.841 20 10 EHCDMO CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000817965034 1136853034 /nfs/dbraw/zinc/85/30/34/1136853034.db2.gz NUHXRVQMYLKPLH-CQSZACIVSA-N 1 1 341.293 3.585 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1[O-] ZINC000817976558 1136854223 /nfs/dbraw/zinc/85/42/23/1136854223.db2.gz NLTHIVNZVGRFKU-DZGCQCFKSA-N 1 1 328.378 3.594 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)c1ncc(C(=O)OC)s1)c1ccc(N(C)C)cc1 ZINC000818357643 1136875964 /nfs/dbraw/zinc/87/59/64/1136875964.db2.gz DCBMGBNFFCDQSA-WFASDCNBSA-N 1 1 347.484 3.798 20 10 EHCDMO Cc1ccc(O[C@H]2CC[N@H+](C/C=C/c3ccc(N(C)C)cc3)C2)nc1 ZINC000858013390 1136931115 /nfs/dbraw/zinc/93/11/15/1136931115.db2.gz ICNDTNUMRBIZOI-SGSXCFNPSA-N 1 1 337.467 3.623 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)cc1F ZINC000858157120 1136944729 /nfs/dbraw/zinc/94/47/29/1136944729.db2.gz DAZPPGMNLVJQLE-UHFFFAOYSA-N 1 1 349.425 3.893 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000858484722 1136972111 /nfs/dbraw/zinc/97/21/11/1136972111.db2.gz ZMYMNDNRVUOSBK-BFUOFWGJSA-N 1 1 340.423 3.766 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2ccc(C)cn2)c1 ZINC000858488580 1136972422 /nfs/dbraw/zinc/97/24/22/1136972422.db2.gz WACMKQTYKQCGLR-AWEZNQCLSA-N 1 1 342.439 3.511 20 10 EHCDMO Oc1ccccc1C[N@@H+](CC[C@@H]1CC1(Cl)Cl)C[C@H]1CCCO1 ZINC000822739728 1137072571 /nfs/dbraw/zinc/07/25/71/1137072571.db2.gz HFJMZTGZJCRSRF-HUUCEWRRSA-N 1 1 344.282 3.957 20 10 EHCDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000824120195 1137125062 /nfs/dbraw/zinc/12/50/62/1137125062.db2.gz UYICZAXGVYXTES-AEFFLSMTSA-N 1 1 344.524 3.977 20 10 EHCDMO CC(C)(C[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1)C(N)=O ZINC000824608685 1137144810 /nfs/dbraw/zinc/14/48/10/1137144810.db2.gz MGCRLIRYDVKFKH-OAHLLOKOSA-N 1 1 340.467 3.659 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1O ZINC000824636871 1137145654 /nfs/dbraw/zinc/14/56/54/1137145654.db2.gz UPDFFXOXVKBYMV-PKOBYXMFSA-N 1 1 349.833 3.654 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000862484773 1137146738 /nfs/dbraw/zinc/14/67/38/1137146738.db2.gz AXHFVMLEBRMZJK-GDBMZVCRSA-N 1 1 349.471 3.591 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000824820671 1137153885 /nfs/dbraw/zinc/15/38/85/1137153885.db2.gz KEJUQMQRNOXBPM-HNNXBMFYSA-N 1 1 342.395 3.689 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1F ZINC000824892877 1137155851 /nfs/dbraw/zinc/15/58/51/1137155851.db2.gz DKSFYNKPXKYUHB-AEFFLSMTSA-N 1 1 332.463 3.673 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215576 1137168991 /nfs/dbraw/zinc/16/89/91/1137168991.db2.gz RCDHCABHQPANCG-HNNXBMFYSA-N 1 1 342.302 3.874 20 10 EHCDMO CC(C)OCCOC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000825208129 1137168860 /nfs/dbraw/zinc/16/88/60/1137168860.db2.gz RSRYGZNGDKLJTF-UHFFFAOYSA-N 1 1 345.842 3.591 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215576 1137168992 /nfs/dbraw/zinc/16/89/92/1137168992.db2.gz RCDHCABHQPANCG-HNNXBMFYSA-N 1 1 342.302 3.874 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2cc(OC)c(OC)cc2C)c1 ZINC000120106456 1137233974 /nfs/dbraw/zinc/23/39/74/1137233974.db2.gz XPYMNAZMIQDOSJ-UHFFFAOYSA-N 1 1 345.439 3.749 20 10 EHCDMO [O-]c1cc(F)c(Br)cc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001144306998 1137270793 /nfs/dbraw/zinc/27/07/93/1137270793.db2.gz ZVQPOARTIJINFC-GFCCVEGCSA-N 1 1 336.151 3.525 20 10 EHCDMO C[C@H]([NH2+]Cc1cccnc1F)c1ccc(N2CCOCC2)cc1Cl ZINC000794836508 1137276356 /nfs/dbraw/zinc/27/63/56/1137276356.db2.gz QDRRAJDTZLVMGQ-ZDUSSCGKSA-N 1 1 349.837 3.562 20 10 EHCDMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1c(O)cc(O)cc1O ZINC001144516131 1137304450 /nfs/dbraw/zinc/30/44/50/1137304450.db2.gz QWVLRFPWEJCCKP-UHFFFAOYSA-N 1 1 341.329 3.844 20 10 EHCDMO CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144515079 1137304475 /nfs/dbraw/zinc/30/44/75/1137304475.db2.gz DQTFOILFEYZKPG-HNNXBMFYSA-N 1 1 331.437 3.862 20 10 EHCDMO CC(C)([NH2+]Cc1cccc(Br)c1O)[C@@H]1CCCCO1 ZINC000865746883 1137308280 /nfs/dbraw/zinc/30/82/80/1137308280.db2.gz QLRHIEIIFNLBOW-ZDUSSCGKSA-N 1 1 328.250 3.592 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000845971540 1137322285 /nfs/dbraw/zinc/32/22/85/1137322285.db2.gz LDGFEUJGZLHKCD-SECBINFHSA-N 1 1 325.767 3.750 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000124248312 1137584454 /nfs/dbraw/zinc/58/44/54/1137584454.db2.gz MVUSTUKVDUUKKL-UHFFFAOYSA-N 1 1 338.480 3.903 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000124248312 1137584455 /nfs/dbraw/zinc/58/44/55/1137584455.db2.gz MVUSTUKVDUUKKL-UHFFFAOYSA-N 1 1 338.480 3.903 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCO[C@@H](C(F)(F)F)CC2)c1 ZINC000872814232 1137584897 /nfs/dbraw/zinc/58/48/97/1137584897.db2.gz QIVGZJHMBBNOBP-CQSZACIVSA-N 1 1 347.377 3.549 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2ncnn2-c2ccccc2)cc1C ZINC000873115969 1137590445 /nfs/dbraw/zinc/59/04/45/1137590445.db2.gz XQSWJSMKXGHPSQ-UHFFFAOYSA-N 1 1 336.439 3.654 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000876557965 1137655412 /nfs/dbraw/zinc/65/54/12/1137655412.db2.gz NCSXZBQDWPDQFE-JOCHJYFZSA-N 1 1 336.479 3.985 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)n1 ZINC000877473003 1137677365 /nfs/dbraw/zinc/67/73/65/1137677365.db2.gz CVFBPKATVYUCKF-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@H+]2Cc2ccc(C)cc2O)n1 ZINC000877473003 1137677366 /nfs/dbraw/zinc/67/73/66/1137677366.db2.gz CVFBPKATVYUCKF-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO C[NH+](C)[C@H]1CCOc2c(NCc3ccc(F)c(F)c3O)cccc21 ZINC000877488510 1137678234 /nfs/dbraw/zinc/67/82/34/1137678234.db2.gz HLRCXSJFKIIWNX-HNNXBMFYSA-N 1 1 334.366 3.668 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](C)C1CCN(CCC(F)(F)F)CC1 ZINC000877577403 1137681954 /nfs/dbraw/zinc/68/19/54/1137681954.db2.gz WMEXDRSTTNMTBZ-UHFFFAOYSA-N 1 1 330.394 3.549 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000877583472 1137682137 /nfs/dbraw/zinc/68/21/37/1137682137.db2.gz IEEFZZKYNQEGSW-INIZCTEOSA-N 1 1 343.389 3.882 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1Cl ZINC000826043401 1137717135 /nfs/dbraw/zinc/71/71/35/1137717135.db2.gz IVSVZACLJLIBLQ-QFBILLFUSA-N 1 1 349.833 3.654 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000127755479 1137747734 /nfs/dbraw/zinc/74/77/34/1137747734.db2.gz YUAILSQYTPJKLK-HZPDHXFCSA-N 1 1 345.512 3.710 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCOc2c(Cl)cccc21 ZINC000882918396 1137838501 /nfs/dbraw/zinc/83/85/01/1137838501.db2.gz JRFYAEULQRDRIP-CQSZACIVSA-N 1 1 325.742 3.937 20 10 EHCDMO COC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(Cl)c1 ZINC000883121222 1137845251 /nfs/dbraw/zinc/84/52/51/1137845251.db2.gz BHSXWHDLDJKUMS-HNNXBMFYSA-N 1 1 327.758 3.801 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000883289560 1137852853 /nfs/dbraw/zinc/85/28/53/1137852853.db2.gz SJWQVDDTGSITHW-HNNXBMFYSA-N 1 1 345.437 3.567 20 10 EHCDMO Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000105442795 1137881054 /nfs/dbraw/zinc/88/10/54/1137881054.db2.gz LUFXRKVSYLGQKN-SNVBAGLBSA-N 1 1 328.243 3.630 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2cc(C3CC3)no2)c1 ZINC000886270808 1138063176 /nfs/dbraw/zinc/06/31/76/1138063176.db2.gz NKIJNBMDKUYICN-UHFFFAOYSA-N 1 1 337.217 3.618 20 10 EHCDMO COc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccc1OC(F)F ZINC000886493697 1138083262 /nfs/dbraw/zinc/08/32/62/1138083262.db2.gz XMAAPLZESDLGDN-JTQLQIEISA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@H]([NH2+]Cc1ccnc(OCC(F)(F)F)c1)c1c(O)cccc1F ZINC000886502997 1138085105 /nfs/dbraw/zinc/08/51/05/1138085105.db2.gz XJDCNFQDJVMIQS-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1c(O)cccc1F ZINC000886522297 1138089478 /nfs/dbraw/zinc/08/94/78/1138089478.db2.gz GTRLGADMHXGUBN-LBPRGKRZSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)c1c(O)cccc1F ZINC000886536158 1138092400 /nfs/dbraw/zinc/09/24/00/1138092400.db2.gz BSQAHPXBMDFHLR-GFCCVEGCSA-N 1 1 348.384 3.846 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1c(O)cccc1F ZINC000886539438 1138093153 /nfs/dbraw/zinc/09/31/53/1138093153.db2.gz ZLSNGGDEGPJRMG-NWDGAFQWSA-N 1 1 335.810 3.509 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(F)c(F)c1 ZINC000886562112 1138097610 /nfs/dbraw/zinc/09/76/10/1138097610.db2.gz QQYGOAWRVAXDKC-BMIGLBTASA-N 1 1 325.330 3.848 20 10 EHCDMO C[C@@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1c(O)cccc1F ZINC000886623988 1138103219 /nfs/dbraw/zinc/10/32/19/1138103219.db2.gz VAYVDVVNRAHTJK-WKFLNTIRSA-N 1 1 337.416 3.517 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2ccccc2O)c(SC)cc1OC ZINC000091956499 1138223599 /nfs/dbraw/zinc/22/35/99/1138223599.db2.gz BAHLVBQQWUSEPJ-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c1O ZINC000093684076 1138239851 /nfs/dbraw/zinc/23/98/51/1138239851.db2.gz FZERJHZELLWYFA-SFHVURJKSA-N 1 1 341.451 3.830 20 10 EHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)c(O)c1 ZINC000093712912 1138240378 /nfs/dbraw/zinc/24/03/78/1138240378.db2.gz OOQCIXCNMCVYNW-XMMPIXPASA-N 1 1 347.480 3.550 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1cc(OC)ccc1O ZINC000179566957 1139765278 /nfs/dbraw/zinc/76/52/78/1139765278.db2.gz KRGRQWROGMYOTD-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO Cc1cccc(C[N@H+](C)C2CCN(C(=O)OC(C)(C)C)CC2)c1O ZINC000179766749 1139780524 /nfs/dbraw/zinc/78/05/24/1139780524.db2.gz FGRNEIXINXLYAH-UHFFFAOYSA-N 1 1 334.460 3.532 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184997915 1140130743 /nfs/dbraw/zinc/13/07/43/1140130743.db2.gz HISYGRXWWTZMRS-QWRGUYRKSA-N 1 1 329.271 3.834 20 10 EHCDMO CC(C)Oc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185470358 1140151061 /nfs/dbraw/zinc/15/10/61/1140151061.db2.gz JKFYMFBORDHRKX-ORAYPTAESA-N 1 1 333.403 3.703 20 10 EHCDMO Cc1cc(O)c(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc1C ZINC000160180655 1014202334 /nfs/dbraw/zinc/20/23/34/1014202334.db2.gz HUJJXUCHFBYSEW-LJQANCHMSA-N 1 1 341.451 3.896 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1c(F)cccc1F)C[C@H]1CCCO1 ZINC000160205186 1014356181 /nfs/dbraw/zinc/35/61/81/1014356181.db2.gz MZBINJAGWKTEIN-OAHLLOKOSA-N 1 1 333.378 3.852 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1c(F)cccc1F)C[C@H]1CCCO1 ZINC000160205186 1014356194 /nfs/dbraw/zinc/35/61/94/1014356194.db2.gz MZBINJAGWKTEIN-OAHLLOKOSA-N 1 1 333.378 3.852 20 10 EHCDMO Cc1cc(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)on1 ZINC000375623119 1017765406 /nfs/dbraw/zinc/76/54/06/1017765406.db2.gz IGNWXKLNWOXCFM-UHFFFAOYSA-N 1 1 333.435 3.836 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H](O)c2ccc(F)cc2)C2CC2)cc1 ZINC000134066294 1018070703 /nfs/dbraw/zinc/07/07/03/1018070703.db2.gz RODXWYMMLNZGKA-HXUWFJFHSA-N 1 1 328.431 3.590 20 10 EHCDMO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 ZINC000729282380 1019263616 /nfs/dbraw/zinc/26/36/16/1019263616.db2.gz URQBFOBSCXYCKB-HXUWFJFHSA-N 1 1 343.515 3.510 20 10 EHCDMO CC[N@H+](CC(=O)Nc1cccc(OC)c1)Cc1cc(Cl)ccc1O ZINC000160647385 1020045326 /nfs/dbraw/zinc/04/53/26/1020045326.db2.gz OUXYHGNDHLIAPS-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1cccc(OC)c1)Cc1cc(Cl)ccc1O ZINC000160647385 1020045337 /nfs/dbraw/zinc/04/53/37/1020045337.db2.gz OUXYHGNDHLIAPS-UHFFFAOYSA-N 1 1 348.830 3.515 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857829 1020076967 /nfs/dbraw/zinc/07/69/67/1020076967.db2.gz JHERGUYJBIHTRT-UHOSZYNNSA-N 1 1 334.504 3.570 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(Br)cc2)c1O ZINC000160801032 1020504780 /nfs/dbraw/zinc/50/47/80/1020504780.db2.gz BZCXPMAXVORCKT-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cnc(CC(F)(F)F)s2)cc1 ZINC000891398910 1020911055 /nfs/dbraw/zinc/91/10/55/1020911055.db2.gz GQPNXPBVVSJSIB-UHFFFAOYSA-N 1 1 343.418 3.946 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(CC(F)(F)F)s2)cc1 ZINC000891398910 1020911062 /nfs/dbraw/zinc/91/10/62/1020911062.db2.gz GQPNXPBVVSJSIB-UHFFFAOYSA-N 1 1 343.418 3.946 20 10 EHCDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000176163995 1023438180 /nfs/dbraw/zinc/43/81/80/1023438180.db2.gz FLBIJVZKXFNSCO-ZDUSSCGKSA-N 1 1 349.471 3.559 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)c(O)c1OC ZINC000891991630 1024237652 /nfs/dbraw/zinc/23/76/52/1024237652.db2.gz FMUWKQIVFCVEDZ-LLVKDONJSA-N 1 1 336.457 3.676 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3cc(Cl)ccc3O)[C@@H]2C(C)C)C1 ZINC000895996939 1025051471 /nfs/dbraw/zinc/05/14/71/1025051471.db2.gz VRXICYLPOHKGOZ-MRXNPFEDSA-N 1 1 339.863 3.655 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)c(O)c1OC ZINC000892161879 1025119923 /nfs/dbraw/zinc/11/99/23/1025119923.db2.gz RMZZDMKXNVPKLZ-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2c(O)cccc2F)s1 ZINC000896640090 1025794950 /nfs/dbraw/zinc/79/49/50/1025794950.db2.gz GGWPRKBBAAHQSO-UHFFFAOYSA-N 1 1 337.416 3.838 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1=O)c1ccc(F)cc1O ZINC000840881222 1027090544 /nfs/dbraw/zinc/09/05/44/1027090544.db2.gz GHQXAYCXYYIGCT-IAGOWNOFSA-N 1 1 346.377 3.517 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c1 ZINC000273417041 1027416523 /nfs/dbraw/zinc/41/65/23/1027416523.db2.gz RAKPZZSOACXVRW-MNOVXSKESA-N 1 1 335.350 3.869 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1nnc2n1CCCCC2 ZINC000273617291 1027521366 /nfs/dbraw/zinc/52/13/66/1027521366.db2.gz XSNRKVRQXNJJNX-IUODEOHRSA-N 1 1 332.423 3.651 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCc2ccc(F)cc21 ZINC000179196642 1029107687 /nfs/dbraw/zinc/10/76/87/1029107687.db2.gz ORSOPCXOOSHBNL-OAQYLSRUSA-N 1 1 340.442 3.782 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)NC(C)(C)C)Cc1ccccc1O ZINC000176677157 1029656869 /nfs/dbraw/zinc/65/68/69/1029656869.db2.gz VWJKMSCIZTWHBR-INIZCTEOSA-N 1 1 340.467 3.870 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cn(-c2ccccc2)nn1 ZINC000090450116 1030115440 /nfs/dbraw/zinc/11/54/40/1030115440.db2.gz VTVKSFPNPJDWAX-HOTGVXAUSA-N 1 1 335.455 3.745 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(Cl)s2)cc1OC ZINC000159494153 1030234656 /nfs/dbraw/zinc/23/46/56/1030234656.db2.gz FERDVCKUMPCXOZ-UHFFFAOYSA-N 1 1 327.833 3.756 20 10 EHCDMO C[N@@H+](Cc1c[nH]nc1-c1c(F)cccc1F)Cc1ccccc1O ZINC000091956620 1030345996 /nfs/dbraw/zinc/34/59/96/1030345996.db2.gz GOOAHWNGNWHMFT-UHFFFAOYSA-N 1 1 329.350 3.693 20 10 EHCDMO C[C@@H]([NH2+]Cc1csc(N)n1)c1ccc(N2CCCCCC2)cc1 ZINC000902488222 1030941851 /nfs/dbraw/zinc/94/18/51/1030941851.db2.gz LIIKDKVSJZXZJA-CQSZACIVSA-N 1 1 330.501 3.957 20 10 EHCDMO COc1c(O)c(C[NH+]2CCC(c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000278477441 1031029552 /nfs/dbraw/zinc/02/95/52/1031029552.db2.gz IQKGAIMIJNPWEJ-UHFFFAOYSA-N 1 1 348.424 3.750 20 10 EHCDMO Cc1noc(CCC[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)n1 ZINC000278668027 1031912582 /nfs/dbraw/zinc/91/25/82/1031912582.db2.gz JBIRAEZGNYNMAA-QMMMGPOBSA-N 1 1 330.215 3.674 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)c1O ZINC000761213457 1034536307 /nfs/dbraw/zinc/53/63/07/1034536307.db2.gz AEDYLAIJBGOTEA-GFCCVEGCSA-N 1 1 333.815 3.837 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2Cc3ccccc3OC[C@H]2C)c1O ZINC000761213457 1034536315 /nfs/dbraw/zinc/53/63/15/1034536315.db2.gz AEDYLAIJBGOTEA-GFCCVEGCSA-N 1 1 333.815 3.837 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1C ZINC000761226798 1034819674 /nfs/dbraw/zinc/81/96/74/1034819674.db2.gz VFWYAENWDZLHGQ-FQEVSTJZSA-N 1 1 325.452 3.782 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c1O ZINC000164291789 1035514373 /nfs/dbraw/zinc/51/43/73/1035514373.db2.gz SNTRJFKWFHDKEG-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c1O ZINC000164291789 1035514390 /nfs/dbraw/zinc/51/43/90/1035514390.db2.gz SNTRJFKWFHDKEG-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO Cc1cccc(C[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)c1O ZINC000191529653 1036408638 /nfs/dbraw/zinc/40/86/38/1036408638.db2.gz PXJLWWQFRKADCC-LBPRGKRZSA-N 1 1 327.359 3.741 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1cc(F)cc(F)c1O ZINC000756372057 1038128219 /nfs/dbraw/zinc/12/82/19/1038128219.db2.gz NVGSKKMEJPQVRV-QMTHXVAHSA-N 1 1 326.412 3.685 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@H]3COCC[C@H]32)ccc1N1CCCCC1 ZINC000828035731 1040204205 /nfs/dbraw/zinc/20/42/05/1040204205.db2.gz AGCGSFJGEAJATF-PZJWPPBQSA-N 1 1 328.500 3.986 20 10 EHCDMO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)c(C)c1 ZINC000111235736 1040667586 /nfs/dbraw/zinc/66/75/86/1040667586.db2.gz IMMZNEWAMIZTPB-MRXNPFEDSA-N 1 1 326.440 3.776 20 10 EHCDMO CCCN(Cc1ccccc1O)C(=O)C[C@@H](C)n1cc[nH+]c1CC ZINC000843819351 1041141398 /nfs/dbraw/zinc/14/13/98/1041141398.db2.gz AJVGVGHBDXIMJL-OAHLLOKOSA-N 1 1 329.444 3.541 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCCO1 ZINC000278910644 1042918792 /nfs/dbraw/zinc/91/87/92/1042918792.db2.gz VSHFQTKLEYYTMG-DYQSUWPFSA-N 1 1 334.243 3.544 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000278965322 1043097322 /nfs/dbraw/zinc/09/73/22/1043097322.db2.gz MWPFLANELYDNOX-GHMZBOCLSA-N 1 1 340.254 3.809 20 10 EHCDMO Cc1cc(C[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)n[nH]1 ZINC000279784377 1044661989 /nfs/dbraw/zinc/66/19/89/1044661989.db2.gz BEWJALCWYNENGQ-NSHDSACASA-N 1 1 340.393 3.524 20 10 EHCDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCN(CCc3ccccc3)C2)c1 ZINC000185337352 1126868774 /nfs/dbraw/zinc/86/87/74/1126868774.db2.gz QIZNJOYUBUFALP-UYAOXDASSA-N 1 1 338.495 3.916 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1O ZINC000185455705 1126903563 /nfs/dbraw/zinc/90/35/63/1126903563.db2.gz GCCKAYKUKZZRLI-GXTWGEPZSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(F)cc1O ZINC000186183574 1127981621 /nfs/dbraw/zinc/98/16/21/1127981621.db2.gz UJMRKIPEOJOOHD-QWHCGFSZSA-N 1 1 326.375 3.524 20 10 EHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000762076314 1121092664 /nfs/dbraw/zinc/09/26/64/1121092664.db2.gz MWVGYBOPAHQRDJ-UHFFFAOYSA-N 1 1 338.455 3.612 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N1[C@@H](C)CCC[C@@H]1C)Cc1ccc(N(C)C)cc1 ZINC000917074908 1122471965 /nfs/dbraw/zinc/47/19/65/1122471965.db2.gz KTWRXBIWBRQKAB-ROUUACIJSA-N 1 1 345.531 3.753 20 10 EHCDMO c1cn(Cc2ccccc2)nc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922117141 1129120452 /nfs/dbraw/zinc/12/04/52/1129120452.db2.gz YUSFTSFVKSTHJK-UHFFFAOYSA-N 1 1 333.435 3.546 20 10 EHCDMO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C12CCC2 ZINC000763452833 1123571650 /nfs/dbraw/zinc/57/16/50/1123571650.db2.gz NAIFQLXSFWBCDW-SJORKVTESA-N 1 1 335.419 3.513 20 10 EHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C12CCC2 ZINC000763452833 1123571652 /nfs/dbraw/zinc/57/16/52/1123571652.db2.gz NAIFQLXSFWBCDW-SJORKVTESA-N 1 1 335.419 3.513 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000179589507 1123799916 /nfs/dbraw/zinc/79/99/16/1123799916.db2.gz LIKJYCYQAQDEPF-QGZVFWFLSA-N 1 1 341.407 3.509 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000180388582 1123999277 /nfs/dbraw/zinc/99/92/77/1123999277.db2.gz AEZDKOPKIRHMCE-QRWLVFNGSA-N 1 1 327.424 3.671 20 10 EHCDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)nnn1-c1ccccc1 ZINC000766030622 1129849406 /nfs/dbraw/zinc/84/94/06/1129849406.db2.gz VBZJEOMEWDXYRK-MRXNPFEDSA-N 1 1 349.482 3.801 20 10 EHCDMO CC(C)Cc1noc(C[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000731848095 1130850006 /nfs/dbraw/zinc/85/00/06/1130850006.db2.gz RHQKZYXDYDVXMI-UHFFFAOYSA-N 1 1 329.444 3.919 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1)OCO2 ZINC000732980076 1130978307 /nfs/dbraw/zinc/97/83/07/1130978307.db2.gz GUTPKGMIFGZNNY-HNNXBMFYSA-N 1 1 333.334 3.736 20 10 EHCDMO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2cc3c(cc2O)OCO3)cc1 ZINC000738245928 1131466393 /nfs/dbraw/zinc/46/63/93/1131466393.db2.gz OYPJJWOIHYQOTC-INIZCTEOSA-N 1 1 343.448 3.719 20 10 EHCDMO C[C@@H](NCC[N@@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766275594 1131634674 /nfs/dbraw/zinc/63/46/74/1131634674.db2.gz XMLBZTQBZOOZNK-DLBZAZTESA-N 1 1 333.495 3.951 20 10 EHCDMO C[C@@H](NCC[N@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766275594 1131634677 /nfs/dbraw/zinc/63/46/77/1131634677.db2.gz XMLBZTQBZOOZNK-DLBZAZTESA-N 1 1 333.495 3.951 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C)cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000741721723 1131636489 /nfs/dbraw/zinc/63/64/89/1131636489.db2.gz BDYPDQTVLOCALW-ZWKOTPCHSA-N 1 1 339.483 3.615 20 10 EHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@@H+]([C@@H](C)CCOCC(C)C)C1 ZINC001172476790 1131736372 /nfs/dbraw/zinc/73/63/72/1131736372.db2.gz STFFAHBMZKRINJ-INIZCTEOSA-N 1 1 344.499 3.996 20 10 EHCDMO CC1CC[NH+](CC[C@H]2CCCN2Cc2ccc(N(C)C)cc2)CC1 ZINC001175351446 1132645888 /nfs/dbraw/zinc/64/58/88/1132645888.db2.gz MGGORKWXQPDXGW-OAQYLSRUSA-N 1 1 329.532 3.839 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2Cc3ccccc32)c1 ZINC001177724726 1133093526 /nfs/dbraw/zinc/09/35/26/1133093526.db2.gz JSTTVHHYYKJCDK-ZDUSSCGKSA-N 1 1 332.241 3.893 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc1C ZINC000768162572 1133103573 /nfs/dbraw/zinc/10/35/73/1133103573.db2.gz QPNIGSNUACEPDA-LJQANCHMSA-N 1 1 341.451 3.890 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1OC ZINC000768257522 1133118298 /nfs/dbraw/zinc/11/82/98/1133118298.db2.gz KMSRZJFHNLICCX-UHFFFAOYSA-N 1 1 340.467 3.934 20 10 EHCDMO CC[N@@H+]1CC=C(c2cnc(NCc3ccc(O)c(O)c3)c(C)c2)CC1 ZINC001169991046 1133124990 /nfs/dbraw/zinc/12/49/90/1133124990.db2.gz WYXKHTKNJMLODP-UHFFFAOYSA-N 1 1 339.439 3.522 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000768353812 1133128720 /nfs/dbraw/zinc/12/87/20/1133128720.db2.gz ABAPCTLUSCDIOQ-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO COc1cc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c(O)cc1C ZINC000768452173 1133140645 /nfs/dbraw/zinc/14/06/45/1133140645.db2.gz PSKAFOAFOWADMW-HXUWFJFHSA-N 1 1 327.424 3.673 20 10 EHCDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768465518 1133144739 /nfs/dbraw/zinc/14/47/39/1133144739.db2.gz ILMUYLLNJOVJFF-LWLIDHTLSA-N 1 1 343.398 3.540 20 10 EHCDMO CC[N@@H+](CCc1cccs1)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000768757553 1133178181 /nfs/dbraw/zinc/17/81/81/1133178181.db2.gz HXGCUCZNTXKTJD-UHFFFAOYSA-N 1 1 348.487 3.788 20 10 EHCDMO CCCCCC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768910872 1133201550 /nfs/dbraw/zinc/20/15/50/1133201550.db2.gz AUAMBZJOJNFNOC-INIZCTEOSA-N 1 1 338.879 3.707 20 10 EHCDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c1 ZINC000768938119 1133206888 /nfs/dbraw/zinc/20/68/88/1133206888.db2.gz ZVCAOUUQXJOBEE-QGZVFWFLSA-N 1 1 327.424 3.617 20 10 EHCDMO CN(C)c1cc(F)c(CNC[C@H]2CC[N@H+]2C2CCCCC2)cc1F ZINC001179173031 1133234482 /nfs/dbraw/zinc/23/44/82/1133234482.db2.gz GJAFPKKUIFWZEV-MRXNPFEDSA-N 1 1 337.458 3.527 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]C[C@H]2CCN2C2CCCCC2)cc1F ZINC001179173031 1133234485 /nfs/dbraw/zinc/23/44/85/1133234485.db2.gz GJAFPKKUIFWZEV-MRXNPFEDSA-N 1 1 337.458 3.527 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c(O)c1 ZINC000769242896 1133249990 /nfs/dbraw/zinc/24/99/90/1133249990.db2.gz LYXRHKWGNPSCLW-TZIWHRDSSA-N 1 1 341.451 3.879 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315648 1133260184 /nfs/dbraw/zinc/26/01/84/1133260184.db2.gz KIUJIRUMMVDGPV-GOSISDBHSA-N 1 1 346.515 3.879 20 10 EHCDMO CCOc1ccc(O)c(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315648 1133260190 /nfs/dbraw/zinc/26/01/90/1133260190.db2.gz KIUJIRUMMVDGPV-GOSISDBHSA-N 1 1 346.515 3.879 20 10 EHCDMO OCC[N@@H+](Cc1cc(Cl)ccc1O)[C@H]1CCCc2ccccc21 ZINC000769422361 1133281801 /nfs/dbraw/zinc/28/18/01/1133281801.db2.gz ATVPRARCBCFQSS-SFHVURJKSA-N 1 1 331.843 3.918 20 10 EHCDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(N(C)C)c(F)c2)CCO1 ZINC000769447497 1133293065 /nfs/dbraw/zinc/29/30/65/1133293065.db2.gz VUMAWTATFUVCMU-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(N(C)C)c(F)c2)CCO1 ZINC000769447497 1133293067 /nfs/dbraw/zinc/29/30/67/1133293067.db2.gz VUMAWTATFUVCMU-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO COc1cccc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)c1O ZINC000769498257 1133301425 /nfs/dbraw/zinc/30/14/25/1133301425.db2.gz SPWOISSWFLWMLA-OXQOHEQNSA-N 1 1 341.451 3.980 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c(O)c1 ZINC000769498187 1133301790 /nfs/dbraw/zinc/30/17/90/1133301790.db2.gz HNTNDBOLGACYAU-SFHVURJKSA-N 1 1 341.451 3.830 20 10 EHCDMO COCCOCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000769533377 1133310182 /nfs/dbraw/zinc/31/01/82/1133310182.db2.gz NPEXRLKLCAXLIC-UHFFFAOYSA-N 1 1 349.858 3.711 20 10 EHCDMO CC(C)(C)CC[NH+]1CCN(Cc2c(O)ccc(Cl)c2F)CC1 ZINC001179966741 1133315567 /nfs/dbraw/zinc/31/55/67/1133315567.db2.gz QZGAULVMMKCCRA-UHFFFAOYSA-N 1 1 328.859 3.739 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC(C)(C)O1 ZINC001180039416 1133320312 /nfs/dbraw/zinc/32/03/12/1133320312.db2.gz WYJOAUXBEYXZQU-MRXNPFEDSA-N 1 1 341.451 3.971 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)Cc1ncccc1F ZINC001180141620 1133330073 /nfs/dbraw/zinc/33/00/73/1133330073.db2.gz HGQBHEQPOHUTLY-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)Cc1ncccc1F ZINC001180141620 1133330078 /nfs/dbraw/zinc/33/00/78/1133330078.db2.gz HGQBHEQPOHUTLY-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC001180177952 1133335397 /nfs/dbraw/zinc/33/53/97/1133335397.db2.gz JSIPLIUTYVVXEU-KRWDZBQOSA-N 1 1 333.378 3.852 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC001180177952 1133335403 /nfs/dbraw/zinc/33/54/03/1133335403.db2.gz JSIPLIUTYVVXEU-KRWDZBQOSA-N 1 1 333.378 3.852 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1c(C)cc(OC)cc1O ZINC001180479298 1133374435 /nfs/dbraw/zinc/37/44/35/1133374435.db2.gz KTHRHQBHJKLJTR-UHFFFAOYSA-N 1 1 328.456 3.797 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)cc1 ZINC000770324546 1133411361 /nfs/dbraw/zinc/41/13/61/1133411361.db2.gz HDBWHZBJNNLBBU-NHCUHLMSSA-N 1 1 342.458 3.980 20 10 EHCDMO Oc1ccccc1C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000770506217 1133436011 /nfs/dbraw/zinc/43/60/11/1133436011.db2.gz ZEZCULSJOMAONC-TZIWHRDSSA-N 1 1 336.479 3.879 20 10 EHCDMO Oc1ccccc1C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000770506217 1133436014 /nfs/dbraw/zinc/43/60/14/1133436014.db2.gz ZEZCULSJOMAONC-TZIWHRDSSA-N 1 1 336.479 3.879 20 10 EHCDMO C[C@@H]1[C@H](C)[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCN1C ZINC001181066042 1133445962 /nfs/dbraw/zinc/44/59/62/1133445962.db2.gz QGHROCQFDWUEBQ-SJORKVTESA-N 1 1 343.540 3.909 20 10 EHCDMO C[C@@H]1[C@H](C)N(Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@H+]1C ZINC001181066042 1133445965 /nfs/dbraw/zinc/44/59/65/1133445965.db2.gz QGHROCQFDWUEBQ-SJORKVTESA-N 1 1 343.540 3.909 20 10 EHCDMO C[C@@H]1[C@H](C)N(Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@@H+]1C ZINC001181066042 1133445967 /nfs/dbraw/zinc/44/59/67/1133445967.db2.gz QGHROCQFDWUEBQ-SJORKVTESA-N 1 1 343.540 3.909 20 10 EHCDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001181234581 1133472554 /nfs/dbraw/zinc/47/25/54/1133472554.db2.gz MEGPOGXPFAUNOR-QQUYBBDPSA-N 1 1 344.499 3.677 20 10 EHCDMO Cc1cc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c(C)n1-c1ccccc1 ZINC000774110694 1133611787 /nfs/dbraw/zinc/61/17/87/1133611787.db2.gz GOTGMZRPABNVAR-XDNSSPFJSA-N 1 1 337.511 3.851 20 10 EHCDMO C[C@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]Cc1cccc(F)c1O ZINC001182335198 1133641861 /nfs/dbraw/zinc/64/18/61/1133641861.db2.gz UKOCMQXVNPLKGA-GFCCVEGCSA-N 1 1 330.378 3.883 20 10 EHCDMO CCNC(=O)C1(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CCC1 ZINC000774382085 1133667882 /nfs/dbraw/zinc/66/78/82/1133667882.db2.gz QCZRKCIVPBHOGA-SNVBAGLBSA-N 1 1 345.270 3.656 20 10 EHCDMO CCO[C@H](C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O)c1ccccc1 ZINC000774495524 1133689847 /nfs/dbraw/zinc/68/98/47/1133689847.db2.gz JGRZROODFZKWTH-AUUYWEPGSA-N 1 1 343.423 3.607 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000774884266 1134092580 /nfs/dbraw/zinc/09/25/80/1134092580.db2.gz JMBWFJJOLKBGBI-SFHVURJKSA-N 1 1 332.400 3.631 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000774884266 1134092583 /nfs/dbraw/zinc/09/25/83/1134092583.db2.gz JMBWFJJOLKBGBI-SFHVURJKSA-N 1 1 332.400 3.631 20 10 EHCDMO CC[C@H]([NH2+]C1CCN(C(=O)C(C)(C)C)CC1)c1ccc(F)cc1O ZINC000796691798 1134098466 /nfs/dbraw/zinc/09/84/66/1134098466.db2.gz DEWLXCUQVFPQAX-INIZCTEOSA-N 1 1 336.451 3.609 20 10 EHCDMO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775006264 1134203965 /nfs/dbraw/zinc/20/39/65/1134203965.db2.gz ZMTGDRYWMSPWKH-INIZCTEOSA-N 1 1 344.411 3.810 20 10 EHCDMO COc1c(O)c(C[NH2+]CCCCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000775005885 1134204090 /nfs/dbraw/zinc/20/40/90/1134204090.db2.gz YCJBCMRLNXCLND-UHFFFAOYSA-N 1 1 344.411 3.812 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)CC1CCCC1 ZINC000789348782 1134253643 /nfs/dbraw/zinc/25/36/43/1134253643.db2.gz QVTZKOWEHYPGKT-GOSISDBHSA-N 1 1 329.440 3.929 20 10 EHCDMO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1cccc(Br)c1O ZINC000789593450 1134303598 /nfs/dbraw/zinc/30/35/98/1134303598.db2.gz QEXJAHOFXVQSEH-INIZCTEOSA-N 1 1 342.277 3.528 20 10 EHCDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cccc(Br)c1O ZINC000789593450 1134303602 /nfs/dbraw/zinc/30/36/02/1134303602.db2.gz QEXJAHOFXVQSEH-INIZCTEOSA-N 1 1 342.277 3.528 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCCOc1ccccc1F ZINC000790948143 1134484183 /nfs/dbraw/zinc/48/41/83/1134484183.db2.gz YGWSJQPCEIVFLO-UHFFFAOYSA-N 1 1 327.758 3.883 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000790970735 1134487708 /nfs/dbraw/zinc/48/77/08/1134487708.db2.gz DQIKFFXEBBPDJV-AWEZNQCLSA-N 1 1 330.186 3.661 20 10 EHCDMO COCC[N@H+](Cc1cccc(Br)c1O)[C@H]1CC[C@H](C)C1 ZINC000792192376 1134666602 /nfs/dbraw/zinc/66/66/02/1134666602.db2.gz JHLWXAOHYKBOEQ-JSGCOSHPSA-N 1 1 342.277 3.792 20 10 EHCDMO COCC[N@@H+](Cc1cccc(Br)c1O)[C@H]1CC[C@H](C)C1 ZINC000792192376 1134666606 /nfs/dbraw/zinc/66/66/06/1134666606.db2.gz JHLWXAOHYKBOEQ-JSGCOSHPSA-N 1 1 342.277 3.792 20 10 EHCDMO CCn1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2C(F)(F)F)cn1 ZINC000792827674 1134797543 /nfs/dbraw/zinc/79/75/43/1134797543.db2.gz PUORPRSBIDWVOC-UHFFFAOYSA-N 1 1 340.393 3.620 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c(C(F)(F)F)c1 ZINC000792843528 1134806734 /nfs/dbraw/zinc/80/67/34/1134806734.db2.gz ONOZGMWCJPSKEO-YOEHRIQHSA-N 1 1 342.405 3.772 20 10 EHCDMO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H](C)CC(C)C ZINC001191682742 1134898181 /nfs/dbraw/zinc/89/81/81/1134898181.db2.gz RPSMGNNBADGIOZ-CYBMUJFWSA-N 1 1 327.852 3.703 20 10 EHCDMO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@H](C)CC(C)C ZINC001191682742 1134898186 /nfs/dbraw/zinc/89/81/86/1134898186.db2.gz RPSMGNNBADGIOZ-CYBMUJFWSA-N 1 1 327.852 3.703 20 10 EHCDMO COC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCCCC2)c(C)c1 ZINC001191799628 1134925921 /nfs/dbraw/zinc/92/59/21/1134925921.db2.gz DPHDTHKWTCVPHK-LJQANCHMSA-N 1 1 330.472 3.513 20 10 EHCDMO COC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(N2CCCCC2)c(C)c1 ZINC001191799628 1134925929 /nfs/dbraw/zinc/92/59/29/1134925929.db2.gz DPHDTHKWTCVPHK-LJQANCHMSA-N 1 1 330.472 3.513 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCc3ccc(Br)cc3C2)c1 ZINC000793609411 1134971369 /nfs/dbraw/zinc/97/13/69/1134971369.db2.gz BACDEJAHEMTGBV-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCc3ccc(Br)cc3C2)c1 ZINC000793609411 1134971374 /nfs/dbraw/zinc/97/13/74/1134971374.db2.gz BACDEJAHEMTGBV-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000793619532 1134973429 /nfs/dbraw/zinc/97/34/29/1134973429.db2.gz GSRZQAKQKDRGIM-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO CC[N@@H+](Cc1cn(C)nc1C(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC000775637564 1135371809 /nfs/dbraw/zinc/37/18/09/1135371809.db2.gz ROXJRLCGHUWIPV-UHFFFAOYSA-N 1 1 328.504 3.806 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)oc1C ZINC000775644897 1135393898 /nfs/dbraw/zinc/39/38/98/1135393898.db2.gz SWZVRXXRDLYKHJ-UHFFFAOYSA-N 1 1 337.803 3.674 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)c1O ZINC000775668946 1135457658 /nfs/dbraw/zinc/45/76/58/1135457658.db2.gz NUTBSHWETGSQHI-INIZCTEOSA-N 1 1 334.460 3.532 20 10 EHCDMO CCC(CC)n1ccc(C[N@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC001195790068 1135469875 /nfs/dbraw/zinc/46/98/75/1135469875.db2.gz PNVCMHJTWQCXIA-UHFFFAOYSA-N 1 1 344.503 3.821 20 10 EHCDMO CCC(CC)n1ccc(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC001195790068 1135469878 /nfs/dbraw/zinc/46/98/78/1135469878.db2.gz PNVCMHJTWQCXIA-UHFFFAOYSA-N 1 1 344.503 3.821 20 10 EHCDMO CC[C@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1cccc(C)c1O ZINC000775731715 1135591145 /nfs/dbraw/zinc/59/11/45/1135591145.db2.gz KJMBHUINXHWRIB-GOSISDBHSA-N 1 1 327.424 3.827 20 10 EHCDMO CC[C@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1cccc(C)c1O ZINC000775731715 1135591150 /nfs/dbraw/zinc/59/11/50/1135591150.db2.gz KJMBHUINXHWRIB-GOSISDBHSA-N 1 1 327.424 3.827 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cn(-c3ccccc3C)nn2)cc1 ZINC000808379801 1135657067 /nfs/dbraw/zinc/65/70/67/1135657067.db2.gz AUIYLSZSPLXDJI-UHFFFAOYSA-N 1 1 349.482 3.712 20 10 EHCDMO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000808444581 1135668674 /nfs/dbraw/zinc/66/86/74/1135668674.db2.gz OLZDKBPONZSCMN-MEBBXXQBSA-N 1 1 334.213 3.767 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2COc3ccccc32)c1 ZINC000808451018 1135669731 /nfs/dbraw/zinc/66/97/31/1135669731.db2.gz FNAODLVCBQHYIB-ZDUSSCGKSA-N 1 1 348.240 3.729 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)no2)cc1 ZINC000809718767 1135878053 /nfs/dbraw/zinc/87/80/53/1135878053.db2.gz OJMFDOLWDSPXLT-SFHVURJKSA-N 1 1 328.460 3.951 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)no2)cc1 ZINC000809718767 1135878057 /nfs/dbraw/zinc/87/80/57/1135878057.db2.gz OJMFDOLWDSPXLT-SFHVURJKSA-N 1 1 328.460 3.951 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCC[C@H]2CCNC(=O)OC(C)(C)C)c1O ZINC000809723813 1135878749 /nfs/dbraw/zinc/87/87/49/1135878749.db2.gz PROCQNKFOXCXJC-KRWDZBQOSA-N 1 1 348.487 3.970 20 10 EHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000776003983 1135915705 /nfs/dbraw/zinc/91/57/05/1135915705.db2.gz YYQONYNALUAEFU-GWCFXTLKSA-N 1 1 328.250 3.784 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c(O)c1 ZINC000776015855 1135921394 /nfs/dbraw/zinc/92/13/94/1135921394.db2.gz YAOUIWHCPNNHBG-OAQYLSRUSA-N 1 1 339.435 3.812 20 10 EHCDMO CC[C@H]([NH2+]C[C@@]1(CO)C[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000810246136 1135947683 /nfs/dbraw/zinc/94/76/83/1135947683.db2.gz LLDQLMJLFGABMG-WSTZPKSXSA-N 1 1 329.415 3.738 20 10 EHCDMO CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)[C@@H]1[C@@H]1CCCO1 ZINC000811511096 1136102503 /nfs/dbraw/zinc/10/25/03/1136102503.db2.gz UWKWDVPXJOTGJY-LSDHHAIUSA-N 1 1 340.261 3.544 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000811512347 1136102895 /nfs/dbraw/zinc/10/28/95/1136102895.db2.gz AZJOUENEMHEWMR-HNNXBMFYSA-N 1 1 328.843 3.683 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@@H]1[C@H]1CCCO1)CCCC2 ZINC000811791227 1136140830 /nfs/dbraw/zinc/14/08/30/1136140830.db2.gz RTDIVCZDSVZYOF-UXHICEINSA-N 1 1 327.468 3.805 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@H]1[C@@H]1CCCO1)CCCC2 ZINC000811791228 1136140926 /nfs/dbraw/zinc/14/09/26/1136140926.db2.gz RTDIVCZDSVZYOF-VQTJNVASSA-N 1 1 327.468 3.805 20 10 EHCDMO COCCC[N@@H+](Cc1ccncc1)Cc1c(O)ccc2ccccc21 ZINC000106855955 1136154375 /nfs/dbraw/zinc/15/43/75/1136154375.db2.gz BGTLHCDGRCYOAU-UHFFFAOYSA-N 1 1 336.435 3.979 20 10 EHCDMO CCCN1CCC([NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850012728 1136199077 /nfs/dbraw/zinc/19/90/77/1136199077.db2.gz ODEUMTPCRDLFJI-UHFFFAOYSA-N 1 1 334.504 3.662 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H](n3cccn3)C2)cc1 ZINC000812780750 1136246410 /nfs/dbraw/zinc/24/64/10/1136246410.db2.gz QTXIMLBWROMEPR-HXUWFJFHSA-N 1 1 326.488 3.957 20 10 EHCDMO C[C@@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Br)c(F)cc1O ZINC000850482932 1136267762 /nfs/dbraw/zinc/26/77/62/1136267762.db2.gz SLFKGTGFHFVIKB-RKDXNWHRSA-N 1 1 332.213 3.512 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1cccc(C(F)(F)F)c1O ZINC000850494402 1136271060 /nfs/dbraw/zinc/27/10/60/1136271060.db2.gz OQEVCUCCNQPHMU-RYUDHWBXSA-N 1 1 330.394 3.934 20 10 EHCDMO C[C@@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000850522795 1136277105 /nfs/dbraw/zinc/27/71/05/1136277105.db2.gz MFCRWMNMYDXISI-QWRGUYRKSA-N 1 1 325.330 3.928 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cc(Br)c(F)cc1O ZINC000850524573 1136277580 /nfs/dbraw/zinc/27/75/80/1136277580.db2.gz HAVVEXJSBJCXMQ-ZJUUUORDSA-N 1 1 344.224 3.656 20 10 EHCDMO CSC[C@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000814179506 1136412053 /nfs/dbraw/zinc/41/20/53/1136412053.db2.gz TUSYZLGQZDOJBI-NSHDSACASA-N 1 1 330.291 3.730 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](c3ccccc3)C2)cc1OC ZINC000814225192 1136424913 /nfs/dbraw/zinc/42/49/13/1136424913.db2.gz FDYQOZRFHMDUTM-MRXNPFEDSA-N 1 1 327.424 3.789 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]C[C@@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000814298441 1136437896 /nfs/dbraw/zinc/43/78/96/1136437896.db2.gz SZKALGGBFBOXHA-QHCPKHFHSA-N 1 1 349.522 3.722 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)Cc1ccccc1 ZINC000111232782 1136524720 /nfs/dbraw/zinc/52/47/20/1136524720.db2.gz TZBMQJBQRYAFQQ-LJQANCHMSA-N 1 1 337.419 3.591 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1Cl)Cc1ccccc1O ZINC000111235947 1136524819 /nfs/dbraw/zinc/52/48/19/1136524819.db2.gz ONFVCPATXXAUOL-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1Cl)Cc1ccccc1O ZINC000111235947 1136524821 /nfs/dbraw/zinc/52/48/21/1136524821.db2.gz ONFVCPATXXAUOL-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)N[C@@H](c1cccs1)C(C)(C)C)Cc1ccccc1O ZINC000111236387 1136525144 /nfs/dbraw/zinc/52/51/44/1136525144.db2.gz WKHYCCSMVHJNBY-SFHVURJKSA-N 1 1 346.496 3.789 20 10 EHCDMO Cc1cc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC000815033202 1136542951 /nfs/dbraw/zinc/54/29/51/1136542951.db2.gz BZUOGFZWDFAACW-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC000815033202 1136542955 /nfs/dbraw/zinc/54/29/55/1136542955.db2.gz BZUOGFZWDFAACW-FQEVSTJZSA-N 1 1 328.431 3.774 20 10 EHCDMO C[C@H]([NH2+]CCOCC(F)(F)F)c1cccc(C(F)(F)F)c1O ZINC000815568110 1136611746 /nfs/dbraw/zinc/61/17/46/1136611746.db2.gz VLOPSUXRKNFESX-QMMMGPOBSA-N 1 1 331.256 3.641 20 10 EHCDMO COc1ccncc1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628753 1136621431 /nfs/dbraw/zinc/62/14/31/1136621431.db2.gz IOAKHJAFINMVMA-SNVBAGLBSA-N 1 1 326.318 3.665 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nc(-c2ccoc2)no1)C1CCCC1 ZINC000112601363 1136642612 /nfs/dbraw/zinc/64/26/12/1136642612.db2.gz DUVGVVOXVFDSPZ-UHFFFAOYSA-N 1 1 339.395 3.980 20 10 EHCDMO NC(=O)c1ccc(C[N@@H+](Cc2ccc3ccccc3c2O)C2CC2)cc1 ZINC000816488507 1136724142 /nfs/dbraw/zinc/72/41/42/1136724142.db2.gz WANQKRSYCUQYPG-UHFFFAOYSA-N 1 1 346.430 3.809 20 10 EHCDMO CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816493730 1136724855 /nfs/dbraw/zinc/72/48/55/1136724855.db2.gz LOLGAQJGASWDES-UHFFFAOYSA-N 1 1 328.859 3.737 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12 ZINC000816560002 1136736706 /nfs/dbraw/zinc/73/67/06/1136736706.db2.gz BNKSMFSPLSMIAM-BNOWGMLFSA-N 1 1 333.881 3.654 20 10 EHCDMO CN(CC[N@@H+](C)Cc1ccc2ccccc2c1O)C(=O)OC(C)(C)C ZINC000816565179 1136737474 /nfs/dbraw/zinc/73/74/74/1136737474.db2.gz FFUKMLZVFWQEDC-UHFFFAOYSA-N 1 1 344.455 3.844 20 10 EHCDMO OC[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816616706 1136742538 /nfs/dbraw/zinc/74/25/38/1136742538.db2.gz CUAUSRAZRIJSNX-QFIPXVFZSA-N 1 1 333.431 3.681 20 10 EHCDMO CCN(CC)c1ccc(CN2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1F ZINC000816642132 1136743618 /nfs/dbraw/zinc/74/36/18/1136743618.db2.gz QBSXXNLXFYDCAS-FQEVSTJZSA-N 1 1 333.495 3.590 20 10 EHCDMO COc1cccc(C[N@@H+]2CCc3cc(OC)c(Cl)cc3C2)c1O ZINC000816664872 1136746309 /nfs/dbraw/zinc/74/63/09/1136746309.db2.gz IVALKHOZIBDHLZ-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1cccc(C[N@H+]2CCc3cc(OC)c(Cl)cc3C2)c1O ZINC000816664872 1136746312 /nfs/dbraw/zinc/74/63/12/1136746312.db2.gz IVALKHOZIBDHLZ-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000816666318 1136747249 /nfs/dbraw/zinc/74/72/49/1136747249.db2.gz KGFAZMIHUHQQMS-NHCUHLMSSA-N 1 1 326.484 3.820 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000816675432 1136747630 /nfs/dbraw/zinc/74/76/30/1136747630.db2.gz AMCRPFOKMKGMQM-OAHLLOKOSA-N 1 1 342.277 3.710 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000816675432 1136747632 /nfs/dbraw/zinc/74/76/32/1136747632.db2.gz AMCRPFOKMKGMQM-OAHLLOKOSA-N 1 1 342.277 3.710 20 10 EHCDMO CC[C@@H]1C[C@@H]([NH2+]Cc2cc(C)cc(Br)c2O)CCO1 ZINC000817415808 1136806472 /nfs/dbraw/zinc/80/64/72/1136806472.db2.gz ZNQZIRWAKRIBNG-QWHCGFSZSA-N 1 1 328.250 3.510 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000817938912 1136847656 /nfs/dbraw/zinc/84/76/56/1136847656.db2.gz VJYBFJWAEVOYQV-QZTJIDSGSA-N 1 1 345.487 3.718 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCCc3ccc(F)cc32)cc1 ZINC000817940353 1136848210 /nfs/dbraw/zinc/84/82/10/1136848210.db2.gz GCTMBFOAMTWTQD-PMACEKPBSA-N 1 1 327.447 3.559 20 10 EHCDMO CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000817957447 1136851761 /nfs/dbraw/zinc/85/17/61/1136851761.db2.gz CIBQRCJHSQVBKL-ONGXEEELSA-N 1 1 349.700 3.832 20 10 EHCDMO CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966462 1136853044 /nfs/dbraw/zinc/85/30/44/1136853044.db2.gz OJPBQIHOUUUDBW-GDBMZVCRSA-N 1 1 330.394 3.841 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Br)cc1[O-] ZINC000817976238 1136854493 /nfs/dbraw/zinc/85/44/93/1136854493.db2.gz WMURYONPCGRBDM-AVGNSLFASA-N 1 1 341.293 3.570 20 10 EHCDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3cc(Cl)c(F)cc3O)C2)nc1 ZINC000858012035 1136930405 /nfs/dbraw/zinc/93/04/05/1136930405.db2.gz BNZDJSDOCXTRGD-ZDUSSCGKSA-N 1 1 336.794 3.541 20 10 EHCDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C2)nc1 ZINC000858012035 1136930408 /nfs/dbraw/zinc/93/04/08/1136930408.db2.gz BNZDJSDOCXTRGD-ZDUSSCGKSA-N 1 1 336.794 3.541 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)cc1C ZINC000858015899 1136931776 /nfs/dbraw/zinc/93/17/76/1136931776.db2.gz FBBVCWUBHIROAO-IBGZPJMESA-N 1 1 338.451 3.935 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000858171165 1136946293 /nfs/dbraw/zinc/94/62/93/1136946293.db2.gz VVFNLKJZYJHODP-NSHDSACASA-N 1 1 335.354 3.790 20 10 EHCDMO CCn1ncc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)n1 ZINC000858443332 1136967800 /nfs/dbraw/zinc/96/78/00/1136967800.db2.gz JICPLADLYVJYKT-MRXNPFEDSA-N 1 1 327.476 3.529 20 10 EHCDMO COc1ccc([C@@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C2CC2)cn1 ZINC000858605841 1136982294 /nfs/dbraw/zinc/98/22/94/1136982294.db2.gz ZTGPVYZFPNBLHH-QGHHPUGFSA-N 1 1 334.366 3.876 20 10 EHCDMO Cc1nsc(C)c1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821390360 1137024937 /nfs/dbraw/zinc/02/49/37/1137024937.db2.gz AHQIEKQUNZTZLI-INIZCTEOSA-N 1 1 332.469 3.647 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822529951 1137062601 /nfs/dbraw/zinc/06/26/01/1137062601.db2.gz LNSWPSOJPZKSDR-QGZVFWFLSA-N 1 1 339.838 3.966 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822529951 1137062603 /nfs/dbraw/zinc/06/26/03/1137062603.db2.gz LNSWPSOJPZKSDR-QGZVFWFLSA-N 1 1 339.838 3.966 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)Cn1cc[nH+]c1C(C)C ZINC000822756450 1137073297 /nfs/dbraw/zinc/07/32/97/1137073297.db2.gz FQPKKASGANHXKG-UHFFFAOYSA-N 1 1 329.444 3.541 20 10 EHCDMO Cc1cc(C)c2c(c1)C[N@H+](Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000777219105 1137120054 /nfs/dbraw/zinc/12/00/54/1137120054.db2.gz HAZOKMGWKDFKGL-UHFFFAOYSA-N 1 1 336.479 3.698 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CC[C@H]1O ZINC000824214212 1137128569 /nfs/dbraw/zinc/12/85/69/1137128569.db2.gz BYOKBZDWXIMXJA-HNAYVOBHSA-N 1 1 330.497 3.587 20 10 EHCDMO CCc1nnc(C[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)[nH]1 ZINC000824446197 1137138049 /nfs/dbraw/zinc/13/80/49/1137138049.db2.gz SCHOHNMBYVIVQX-UHFFFAOYSA-N 1 1 344.503 3.958 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824596183 1137144626 /nfs/dbraw/zinc/14/46/26/1137144626.db2.gz CEIHBFRKNVGANK-CQSZACIVSA-N 1 1 343.471 3.801 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473176 1137145886 /nfs/dbraw/zinc/14/58/86/1137145886.db2.gz HNNCBVWZHFIPAN-OLZOCXBDSA-N 1 1 328.275 3.625 20 10 EHCDMO C[N@@H+](Cc1c(O)cccc1Cl)C1CCN(CC(F)(F)F)CC1 ZINC000825294425 1137171795 /nfs/dbraw/zinc/17/17/95/1137171795.db2.gz QBQHEZGLMQYKGI-UHFFFAOYSA-N 1 1 336.785 3.504 20 10 EHCDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1c(O)cc(O)cc1O ZINC001144520651 1137303072 /nfs/dbraw/zinc/30/30/72/1137303072.db2.gz XOSPUILEMLWQSA-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO C[C@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1ccc(Cl)cc1O ZINC000846180487 1137339893 /nfs/dbraw/zinc/33/98/93/1137339893.db2.gz KYPKATVIHCZPQT-ORAYPTAESA-N 1 1 331.843 3.573 20 10 EHCDMO CC[C@H]([NH2+]CCc1cn(C)c2ncccc12)c1ccc(F)cc1O ZINC000866574064 1137365964 /nfs/dbraw/zinc/36/59/64/1137365964.db2.gz QUULKQKUGDGXNB-KRWDZBQOSA-N 1 1 327.403 3.701 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)cc1C(C)C ZINC000121234564 1137377296 /nfs/dbraw/zinc/37/72/96/1137377296.db2.gz YUTMVGBJEXIBNB-GOSISDBHSA-N 1 1 326.440 3.872 20 10 EHCDMO CC1(C)C[C@H]([NH2+]Cc2cccc(O)c2O)CCN1Cc1ccccc1 ZINC001171977214 1137525610 /nfs/dbraw/zinc/52/56/10/1137525610.db2.gz YYOLBHZZHUXNMT-GOSISDBHSA-N 1 1 340.467 3.631 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1[O-] ZINC000873246111 1137595137 /nfs/dbraw/zinc/59/51/37/1137595137.db2.gz WYTIIOGWHJPLER-DGCLKSJQSA-N 1 1 341.293 3.584 20 10 EHCDMO COc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)c(O)c(C(C)(C)C)c1 ZINC000825885427 1137654501 /nfs/dbraw/zinc/65/45/01/1137654501.db2.gz GBFJZKISSNGOOM-SJPCQFCGSA-N 1 1 346.515 3.755 20 10 EHCDMO COc1cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)c(O)c(C(C)(C)C)c1 ZINC000825885427 1137654502 /nfs/dbraw/zinc/65/45/02/1137654502.db2.gz GBFJZKISSNGOOM-SJPCQFCGSA-N 1 1 346.515 3.755 20 10 EHCDMO COc1cc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(O)c(C(C)(C)C)c1 ZINC000825885427 1137654503 /nfs/dbraw/zinc/65/45/03/1137654503.db2.gz GBFJZKISSNGOOM-SJPCQFCGSA-N 1 1 346.515 3.755 20 10 EHCDMO COc1cc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(O)c(C(C)(C)C)c1 ZINC000825885427 1137654504 /nfs/dbraw/zinc/65/45/04/1137654504.db2.gz GBFJZKISSNGOOM-SJPCQFCGSA-N 1 1 346.515 3.755 20 10 EHCDMO Cc1ccc(CNc2cccc([C@H](C)[NH+]3CCOCC3)c2)c(O)c1 ZINC000876859631 1137663946 /nfs/dbraw/zinc/66/39/46/1137663946.db2.gz WUEPOTASUOYPCR-INIZCTEOSA-N 1 1 326.440 3.706 20 10 EHCDMO C[NH+](C)[C@@H]1CCOc2c(NCc3ccc(F)c(F)c3O)cccc21 ZINC000877488711 1137678273 /nfs/dbraw/zinc/67/82/73/1137678273.db2.gz HLRCXSJFKIIWNX-OAHLLOKOSA-N 1 1 334.366 3.668 20 10 EHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877531167 1137679986 /nfs/dbraw/zinc/67/99/86/1137679986.db2.gz IRVJRTQYKSMQGZ-OAQYLSRUSA-N 1 1 339.483 3.626 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@H](C)c1cccnc1 ZINC000877529971 1137680003 /nfs/dbraw/zinc/68/00/03/1137680003.db2.gz ARRGWOOCDAAVQA-QGZVFWFLSA-N 1 1 339.483 3.626 20 10 EHCDMO Cc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c(O)c1 ZINC000877583669 1137682044 /nfs/dbraw/zinc/68/20/44/1137682044.db2.gz LFAVMLJNHBYADT-INIZCTEOSA-N 1 1 343.389 3.882 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1F ZINC000877674935 1137685322 /nfs/dbraw/zinc/68/53/22/1137685322.db2.gz XMUMMNHGGVXCEF-XLIONFOSSA-N 1 1 328.431 3.590 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccc(OC2CCCC2)nc1 ZINC000882898235 1137837282 /nfs/dbraw/zinc/83/72/82/1137837282.db2.gz DNZRICZWYQGQFE-UHFFFAOYSA-N 1 1 334.366 3.677 20 10 EHCDMO CC[C@@H](C)C(=O)Nc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882908716 1137837584 /nfs/dbraw/zinc/83/75/84/1137837584.db2.gz BUJWNTJKISNORH-GFCCVEGCSA-N 1 1 348.393 3.945 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCOc2c(Cl)cccc21 ZINC000882918395 1137838491 /nfs/dbraw/zinc/83/84/91/1137838491.db2.gz JRFYAEULQRDRIP-AWEZNQCLSA-N 1 1 325.742 3.937 20 10 EHCDMO CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)cc(F)c2[O-])c1 ZINC000882932253 1137838941 /nfs/dbraw/zinc/83/89/41/1137838941.db2.gz CFYDLKBKYPGDQD-UHFFFAOYSA-N 1 1 334.410 3.800 20 10 EHCDMO CN(C)C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)cc1 ZINC000883112914 1137845031 /nfs/dbraw/zinc/84/50/31/1137845031.db2.gz CJPWOUYQQHQXLU-MRXNPFEDSA-N 1 1 340.801 3.716 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1c2ccccc2CC12CCOCC2 ZINC000883122612 1137845404 /nfs/dbraw/zinc/84/54/04/1137845404.db2.gz STOUILROABDGDC-IBGZPJMESA-N 1 1 345.389 3.854 20 10 EHCDMO CC[C@@H](CCC(F)(F)F)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883291079 1137853028 /nfs/dbraw/zinc/85/30/28/1137853028.db2.gz RJNNDRQGTGORGO-INIZCTEOSA-N 1 1 343.437 3.649 20 10 EHCDMO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886528810 1138090692 /nfs/dbraw/zinc/09/06/92/1138090692.db2.gz RTSNNIKLADEQCJ-ACJLOTCBSA-N 1 1 333.403 3.703 20 10 EHCDMO COC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886549029 1138094660 /nfs/dbraw/zinc/09/46/60/1138094660.db2.gz AMASMLFMGSWDJE-LBPRGKRZSA-N 1 1 332.375 3.603 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)c1 ZINC000092437262 1138228292 /nfs/dbraw/zinc/22/82/92/1138228292.db2.gz BZKQLFHMWDUWEC-GOSISDBHSA-N 1 1 331.412 3.565 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c1O ZINC000826538546 1138229479 /nfs/dbraw/zinc/22/94/79/1138229479.db2.gz FQDCJCDDCOBRLW-GWCFXTLKSA-N 1 1 326.234 3.538 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1C ZINC000125903613 1138319012 /nfs/dbraw/zinc/31/90/12/1138319012.db2.gz YASMZHDJGNPAGF-OAHLLOKOSA-N 1 1 347.480 3.606 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1C ZINC000125903613 1138319017 /nfs/dbraw/zinc/31/90/17/1138319017.db2.gz YASMZHDJGNPAGF-OAHLLOKOSA-N 1 1 347.480 3.606 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000180285860 1139824256 /nfs/dbraw/zinc/82/42/56/1139824256.db2.gz YWFCTQMUHCCBSM-SHACYNPGSA-N 1 1 347.480 3.721 20 10 EHCDMO CC1([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)OCCO1 ZINC000182829269 1139995553 /nfs/dbraw/zinc/99/55/53/1139995553.db2.gz OEEZXJYPPWYGFO-INIZCTEOSA-N 1 1 327.424 3.520 20 10 EHCDMO C[C@@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1O ZINC000185646562 1140160139 /nfs/dbraw/zinc/16/01/39/1140160139.db2.gz DCSDJOIUWPAEIL-GFCCVEGCSA-N 1 1 348.384 3.846 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1 ZINC000271019749 1141295153 /nfs/dbraw/zinc/29/51/53/1141295153.db2.gz AGIQSCMSSANQQD-UHFFFAOYSA-N 1 1 349.434 3.957 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000271165802 1141317272 /nfs/dbraw/zinc/31/72/72/1141317272.db2.gz RULWSGNCBDHFNP-GOSISDBHSA-N 1 1 339.435 3.644 20 10 EHCDMO C[N@@H+](Cc1ccc([S@@](C)=O)cc1)Cc1cc2c(cc1O)CCCC2 ZINC000160364073 1018616866 /nfs/dbraw/zinc/61/68/66/1018616866.db2.gz YSSVFXJEHXVBMY-DEOSSOPVSA-N 1 1 343.492 3.640 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000050901247 1020665002 /nfs/dbraw/zinc/66/50/02/1020665002.db2.gz GZZQRPJJUPRGQL-IRXDYDNUSA-N 1 1 332.488 3.526 20 10 EHCDMO COc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c(O)c1OC ZINC000891580702 1021990086 /nfs/dbraw/zinc/99/00/86/1021990086.db2.gz BVDNKFLGDJODEU-INIZCTEOSA-N 1 1 345.464 3.700 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(O)c1OC ZINC000891618999 1022115189 /nfs/dbraw/zinc/11/51/89/1022115189.db2.gz YHONDZFCBRBNOJ-MRXNPFEDSA-N 1 1 331.387 3.886 20 10 EHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)cc(OC)c2O)o1 ZINC000894475222 1022364178 /nfs/dbraw/zinc/36/41/78/1022364178.db2.gz MFDXYBVYNPMZEE-INIZCTEOSA-N 1 1 331.412 3.786 20 10 EHCDMO COc1ccc(N2CCC[N@H+](Cc3nc(C(C)(C)C)co3)CC2)cc1 ZINC000891774393 1022621335 /nfs/dbraw/zinc/62/13/35/1022621335.db2.gz AKPVGADFWBFYHQ-UHFFFAOYSA-N 1 1 343.471 3.693 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3nc(C(C)(C)C)co3)CC2)cc1 ZINC000891774393 1022621342 /nfs/dbraw/zinc/62/13/42/1022621342.db2.gz AKPVGADFWBFYHQ-UHFFFAOYSA-N 1 1 343.471 3.693 20 10 EHCDMO CC1(C)CC[C@H](C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)OC1 ZINC001167982359 1022824590 /nfs/dbraw/zinc/82/45/90/1022824590.db2.gz CNRATZYFNRMEFH-ZWKOTPCHSA-N 1 1 333.472 3.578 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)[nH]1 ZINC000894774103 1022871234 /nfs/dbraw/zinc/87/12/34/1022871234.db2.gz OEBUCWYSZMQSLT-CYBMUJFWSA-N 1 1 341.484 3.662 20 10 EHCDMO Fc1cc(CNc2ccc(C3CC3)c[nH+]2)ccc1N1CCOCC1 ZINC000897711635 1033128578 /nfs/dbraw/zinc/12/85/78/1033128578.db2.gz FWHXJIUHVKDFKW-UHFFFAOYSA-N 1 1 327.403 3.547 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(O)c1OC ZINC000891944119 1023484090 /nfs/dbraw/zinc/48/40/90/1023484090.db2.gz YNNDNTDZLVEZKX-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccccc1N1CCOCC1)c1ccc(F)cc1O ZINC000796721231 1033163612 /nfs/dbraw/zinc/16/36/12/1033163612.db2.gz WHHVWNBPODVZGV-GOSISDBHSA-N 1 1 344.430 3.609 20 10 EHCDMO COCCOc1ccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000892012737 1024331836 /nfs/dbraw/zinc/33/18/36/1024331836.db2.gz PDFDVSUWRDAWOX-UHFFFAOYSA-N 1 1 345.439 3.955 20 10 EHCDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 ZINC000729545332 1024658096 /nfs/dbraw/zinc/65/80/96/1024658096.db2.gz UUXSLGAIQCVGOH-IRXDYDNUSA-N 1 1 345.531 3.610 20 10 EHCDMO COc1ccc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)c(O)c1OC ZINC000895636398 1024681709 /nfs/dbraw/zinc/68/17/09/1024681709.db2.gz UEDBCTXWZVTAKZ-OKZBNKHCSA-N 1 1 339.435 3.645 20 10 EHCDMO CCCC[C@@H](CC)C[N@@H+]1C[C@H]2C[C@@H](C1)N2Cc1ccc(O)c(O)c1 ZINC001279141995 1025098385 /nfs/dbraw/zinc/09/83/85/1025098385.db2.gz LTMDIPFZCTYGJM-NXHRZFHOSA-N 1 1 332.488 3.573 20 10 EHCDMO CCOc1cc(C[NH2+]Cc2c(O)cccc2F)cc(Cl)c1OC ZINC000896642474 1025774500 /nfs/dbraw/zinc/77/45/00/1025774500.db2.gz XKOUBHGOKFQCRX-UHFFFAOYSA-N 1 1 339.794 3.882 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(F)cc2C)ccc1[N+](=O)[O-] ZINC000896800518 1026040480 /nfs/dbraw/zinc/04/04/80/1026040480.db2.gz HKOWEUHHJRSLRI-LLVKDONJSA-N 1 1 334.347 3.607 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccccc1-n1ccnc1)c1ccc(F)cc1O ZINC000375836199 1026688361 /nfs/dbraw/zinc/68/83/61/1026688361.db2.gz BIKQPUDJYRXWCY-KRWDZBQOSA-N 1 1 325.387 3.958 20 10 EHCDMO COCC[C@@H]([NH2+][C@H](C)c1cc(C(=O)OC)ccc1O)c1ccc(C)o1 ZINC000273384708 1027405526 /nfs/dbraw/zinc/40/55/26/1027405526.db2.gz CQRHLCZFOCJOSY-CZUORRHYSA-N 1 1 347.411 3.509 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cc2c(cc1O)CCCC2 ZINC000273510383 1027468401 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Cc1ncc(C[N@H+](C)Cc2cccc(Br)c2O)s1 ZINC000179382736 1034266583 /nfs/dbraw/zinc/26/65/83/1034266583.db2.gz CVZMEUKZTSEDDM-UHFFFAOYSA-N 1 1 327.247 3.552 20 10 EHCDMO COc1cccc([C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)OC)c1 ZINC000529637808 1034324333 /nfs/dbraw/zinc/32/43/33/1034324333.db2.gz FPKVBMVNLNKINA-QGZVFWFLSA-N 1 1 339.794 3.671 20 10 EHCDMO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000186652683 1035679559 /nfs/dbraw/zinc/67/95/59/1035679559.db2.gz DQUVSJOJWCLNBF-BUXKBTBVSA-N 1 1 343.377 3.844 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+](C)Cc3nccn3C(F)F)c2c1 ZINC000029886871 1037410644 /nfs/dbraw/zinc/41/06/44/1037410644.db2.gz UXXBGJQUHBEVHD-UHFFFAOYSA-N 1 1 347.365 3.778 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3nccn3C(F)F)c2c1 ZINC000029886871 1037410652 /nfs/dbraw/zinc/41/06/52/1037410652.db2.gz UXXBGJQUHBEVHD-UHFFFAOYSA-N 1 1 347.365 3.778 20 10 EHCDMO C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)[N@@H+](C)Cc1ccccc1O ZINC000111235465 1037730836 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CN(C)c1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1F ZINC000768216202 1133113320 /nfs/dbraw/zinc/11/33/20/1133113320.db2.gz QRSUBGYWMQOVKN-UHFFFAOYSA-N 1 1 326.415 3.887 20 10 EHCDMO Fc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)ccc1N1CCOCC1 ZINC000768227003 1133114304 /nfs/dbraw/zinc/11/43/04/1133114304.db2.gz DOIZKHLGMWNNRZ-HXUWFJFHSA-N 1 1 340.442 3.999 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000768244269 1133120246 /nfs/dbraw/zinc/12/02/46/1133120246.db2.gz HUGPNINEQSLSOA-CQSZACIVSA-N 1 1 338.407 3.922 20 10 EHCDMO COc1cc(O)c(C[N@@H+](CCc2ccccc2)C2CC2)cc1OC ZINC000768438948 1133138355 /nfs/dbraw/zinc/13/83/55/1133138355.db2.gz BYRPQLFLFHIDFA-UHFFFAOYSA-N 1 1 327.424 3.617 20 10 EHCDMO CCN(C)c1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000773728656 1133146575 /nfs/dbraw/zinc/14/65/75/1133146575.db2.gz DZSPTDCDDCCNEI-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000773728656 1133146579 /nfs/dbraw/zinc/14/65/79/1133146579.db2.gz DZSPTDCDDCCNEI-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO CCOc1ccc(O)c(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC000768913643 1133201822 /nfs/dbraw/zinc/20/18/22/1133201822.db2.gz MYYDHWLYXRYYNX-SOLBZPMBSA-N 1 1 332.488 3.628 20 10 EHCDMO CCC[C@@H](C)C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768915721 1133202177 /nfs/dbraw/zinc/20/21/77/1133202177.db2.gz MKQXZHRRLQGLLX-CJNGLKHVSA-N 1 1 338.879 3.562 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)cc1 ZINC000768940099 1133207063 /nfs/dbraw/zinc/20/70/63/1133207063.db2.gz GYKINPXUMUHURP-GOSISDBHSA-N 1 1 326.488 3.646 20 10 EHCDMO CC[N@@H+](CCCC(=O)OC)Cc1ccc(N(C)C)c2ccccc12 ZINC001204234114 1133215512 /nfs/dbraw/zinc/21/55/12/1133215512.db2.gz WZHWFGPNXHITCQ-UHFFFAOYSA-N 1 1 328.456 3.681 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H](c2ccccc2)O1 ZINC000769107170 1133228078 /nfs/dbraw/zinc/22/80/78/1133228078.db2.gz UMPXQNCMIRIZJT-YWZLYKJASA-N 1 1 328.431 3.854 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H](c2ccccc2)O1 ZINC000769107170 1133228083 /nfs/dbraw/zinc/22/80/83/1133228083.db2.gz UMPXQNCMIRIZJT-YWZLYKJASA-N 1 1 328.431 3.854 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c(O)c1 ZINC000769318012 1133260694 /nfs/dbraw/zinc/26/06/94/1133260694.db2.gz YKQMARDRGFXTAO-KRWDZBQOSA-N 1 1 341.407 3.857 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC001179559342 1133261972 /nfs/dbraw/zinc/26/19/72/1133261972.db2.gz GJNVNAYPHXHHGH-UFBFGSQYSA-N 1 1 341.732 3.774 20 10 EHCDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769484180 1133288622 /nfs/dbraw/zinc/28/86/22/1133288622.db2.gz SUUONPLPCSHUGP-GOSISDBHSA-N 1 1 325.408 3.587 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCSC[C@@H]1c1ccc(C)cc1 ZINC000769446371 1133292403 /nfs/dbraw/zinc/29/24/03/1133292403.db2.gz MKYDNKUYNHVJQS-QGZVFWFLSA-N 1 1 329.465 3.999 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C)cc1C(=O)NC[C@@H]1CCCC[N@@H+]1C ZINC001179965654 1133314812 /nfs/dbraw/zinc/31/48/12/1133314812.db2.gz YEJMTZGQCZZDEY-SFHVURJKSA-N 1 1 339.483 3.617 20 10 EHCDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1O ZINC000769726808 1133336155 /nfs/dbraw/zinc/33/61/55/1133336155.db2.gz AYEFSRDQANMOCJ-UHFFFAOYSA-N 1 1 340.383 3.589 20 10 EHCDMO CCN(CC)c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1F ZINC000770351782 1133419841 /nfs/dbraw/zinc/41/98/41/1133419841.db2.gz KUTRXEMFLISYBD-PKOBYXMFSA-N 1 1 333.495 3.588 20 10 EHCDMO COc1cc(C)cc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1O ZINC001182160037 1133580654 /nfs/dbraw/zinc/58/06/54/1133580654.db2.gz DUMKPYFDFNPYSS-SFHVURJKSA-N 1 1 338.451 3.694 20 10 EHCDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1cc(C)cc(Br)c1O ZINC001182284693 1133616152 /nfs/dbraw/zinc/61/61/52/1133616152.db2.gz HTFOCRUYJBGMQY-AWEZNQCLSA-N 1 1 342.277 3.854 20 10 EHCDMO CCOC[C@@H]1CCCC[N@H+]1Cc1cc(C)cc(Br)c1O ZINC001182284693 1133616154 /nfs/dbraw/zinc/61/61/54/1133616154.db2.gz HTFOCRUYJBGMQY-AWEZNQCLSA-N 1 1 342.277 3.854 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nc(-c2cccnc2)no1 ZINC000774486723 1133688871 /nfs/dbraw/zinc/68/88/71/1133688871.db2.gz YHQFVNINCZVEBU-UONOGXRCSA-N 1 1 337.427 3.609 20 10 EHCDMO C[C@H]([NH2+]CCN1CCc2c(Cl)cccc2C1)c1ccc(F)cc1O ZINC000785569302 1133728082 /nfs/dbraw/zinc/72/80/82/1133728082.db2.gz DFFWUWGISXLAHQ-ZDUSSCGKSA-N 1 1 348.849 3.894 20 10 EHCDMO Cc1cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(O)cc1Br ZINC001250120659 1133838265 /nfs/dbraw/zinc/83/82/65/1133838265.db2.gz LTAVJPJTXVQMCE-SNVBAGLBSA-N 1 1 334.204 3.940 20 10 EHCDMO Cc1ccc(C[N@H+]2CC[C@H]3CC[C@]32CNC(=O)OC(C)(C)C)c(O)c1 ZINC001184429319 1133940770 /nfs/dbraw/zinc/94/07/70/1133940770.db2.gz WCZCGRVEHTYCIE-UZLBHIALSA-N 1 1 346.471 3.580 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1scnc1C1CC1 ZINC000787289143 1133984854 /nfs/dbraw/zinc/98/48/54/1133984854.db2.gz DPRWKBRXLXWWOX-UHFFFAOYSA-N 1 1 339.258 3.778 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000774833851 1134035734 /nfs/dbraw/zinc/03/57/34/1134035734.db2.gz PUNCBJXSWUDKFL-HNNXBMFYSA-N 1 1 346.358 3.785 20 10 EHCDMO CC(C)[C@@H](O)C1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000788695000 1134163748 /nfs/dbraw/zinc/16/37/48/1134163748.db2.gz YODXJPNFUIHMRY-IAQYHMDHSA-N 1 1 331.378 3.859 20 10 EHCDMO CCOC(CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)OCC ZINC000788758935 1134165695 /nfs/dbraw/zinc/16/56/95/1134165695.db2.gz SKFWEMZFNVTXHH-LLVKDONJSA-N 1 1 335.366 3.851 20 10 EHCDMO COc1c(O)c(C[NH2+]CCc2c(C)cc(C)cc2C)ccc1[N+](=O)[O-] ZINC000774973736 1134170434 /nfs/dbraw/zinc/17/04/34/1134170434.db2.gz CYUISYMGPOWQFT-UHFFFAOYSA-N 1 1 344.411 3.567 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1CC[C@H](C)O1 ZINC000789327849 1134257893 /nfs/dbraw/zinc/25/78/93/1134257893.db2.gz QSMMZHNSGQWYNL-SMDDNHRTSA-N 1 1 328.250 3.544 20 10 EHCDMO CCSc1cc(C[NH2+]Cc2c(O)ccc(Cl)c2F)ccn1 ZINC000790987701 1134489498 /nfs/dbraw/zinc/48/94/98/1134489498.db2.gz GPQZJUKVTKLGEY-UHFFFAOYSA-N 1 1 326.824 3.982 20 10 EHCDMO CC(C)(C)OC(=O)CCCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790982911 1134495448 /nfs/dbraw/zinc/49/54/48/1134495448.db2.gz YZTFCVWVUSKHKD-UHFFFAOYSA-N 1 1 331.815 3.786 20 10 EHCDMO CCCc1nc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cs1 ZINC000775256146 1134592109 /nfs/dbraw/zinc/59/21/09/1134592109.db2.gz VZPOBTBQMTTWJL-OAHLLOKOSA-N 1 1 345.512 3.783 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(C2CCOCC2)CC1 ZINC000792168329 1134662719 /nfs/dbraw/zinc/66/27/19/1134662719.db2.gz DCZFNOTXGRXDKZ-UHFFFAOYSA-N 1 1 327.827 3.823 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1O ZINC000792900344 1134817210 /nfs/dbraw/zinc/81/72/10/1134817210.db2.gz FTZCCRXLQCNQPJ-DZGCQCFKSA-N 1 1 346.229 3.750 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1O ZINC000792900344 1134817218 /nfs/dbraw/zinc/81/72/18/1134817218.db2.gz FTZCCRXLQCNQPJ-DZGCQCFKSA-N 1 1 346.229 3.750 20 10 EHCDMO [O-]c1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000793207644 1134883702 /nfs/dbraw/zinc/88/37/02/1134883702.db2.gz QDPSDKKPIYOBEO-HNNXBMFYSA-N 1 1 348.849 3.796 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000793207205 1134884191 /nfs/dbraw/zinc/88/41/91/1134884191.db2.gz OKUZUSCODYYLJF-HNNXBMFYSA-N 1 1 348.849 3.796 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCCCC[C@H]2CCO)c1O ZINC000793609586 1134972118 /nfs/dbraw/zinc/97/21/18/1134972118.db2.gz PTQWLYXUSPQHAY-HNNXBMFYSA-N 1 1 342.277 3.590 20 10 EHCDMO Cc1cc(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)ccc1N(C)C ZINC001170508291 1135446208 /nfs/dbraw/zinc/44/62/08/1135446208.db2.gz SWTFBIHQHXYCEC-IBGZPJMESA-N 1 1 332.875 3.880 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cccc(C)c2O)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000775716933 1135556917 /nfs/dbraw/zinc/55/69/17/1135556917.db2.gz ISPVLLLGQVXRPC-RDJZCZTQSA-N 1 1 348.487 3.826 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccc(OC)cc3)C2)cc1 ZINC001197013222 1135639942 /nfs/dbraw/zinc/63/99/42/1135639942.db2.gz OZPUQKCQBJCXQG-NRFANRHFSA-N 1 1 340.467 3.725 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccc(OC)cc3)C2)cc1 ZINC001197013222 1135639945 /nfs/dbraw/zinc/63/99/45/1135639945.db2.gz OZPUQKCQBJCXQG-NRFANRHFSA-N 1 1 340.467 3.725 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)c1O ZINC000775871349 1135833353 /nfs/dbraw/zinc/83/33/53/1135833353.db2.gz REKCHCZBTPHQIE-SJORKVTESA-N 1 1 339.863 3.932 20 10 EHCDMO CCc1cc(CCC[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)on1 ZINC000809575943 1135853005 /nfs/dbraw/zinc/85/30/05/1135853005.db2.gz NJKYVODXKPGYKF-IBGZPJMESA-N 1 1 344.455 3.556 20 10 EHCDMO C[N@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)C[C@H]1CCOC1 ZINC000809589436 1135858827 /nfs/dbraw/zinc/85/88/27/1135858827.db2.gz GUFFJTCFLNMPJM-HXUWFJFHSA-N 1 1 336.479 3.718 20 10 EHCDMO C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)CC1 ZINC000809756149 1135887166 /nfs/dbraw/zinc/88/71/66/1135887166.db2.gz QDXPKYQVNQCFRN-CYBMUJFWSA-N 1 1 343.298 3.863 20 10 EHCDMO CC[C@@H]([NH2+]Cc1nnc(C)s1)c1ccc(C(F)(F)F)cc1O ZINC000810234257 1135942464 /nfs/dbraw/zinc/94/24/64/1135942464.db2.gz BBBMXDCZYZKXAN-LLVKDONJSA-N 1 1 331.363 3.812 20 10 EHCDMO CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000810252851 1135948833 /nfs/dbraw/zinc/94/88/33/1135948833.db2.gz VOXKQKQWOXSWGK-OAHLLOKOSA-N 1 1 342.936 3.914 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2cn(-c3ccccc3)nn2)cc1C ZINC001200998546 1135975894 /nfs/dbraw/zinc/97/58/94/1135975894.db2.gz NNTJRGMXDWOAOV-UHFFFAOYSA-N 1 1 336.439 3.654 20 10 EHCDMO Cn1c[nH+]c2cc(NCc3c(O)cccc3Br)ccc21 ZINC001201114460 1135984896 /nfs/dbraw/zinc/98/48/96/1135984896.db2.gz FSDWKLUQUOAAQA-UHFFFAOYSA-N 1 1 332.201 3.654 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc3sccc3c2)ccc1[N+](=O)[O-] ZINC000811510132 1136102534 /nfs/dbraw/zinc/10/25/34/1136102534.db2.gz WHOPRVMAHWAGRK-UHFFFAOYSA-N 1 1 344.392 3.814 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000811512348 1136103117 /nfs/dbraw/zinc/10/31/17/1136103117.db2.gz AZJOUENEMHEWMR-OAHLLOKOSA-N 1 1 328.843 3.683 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1F ZINC000811513572 1136103707 /nfs/dbraw/zinc/10/37/07/1136103707.db2.gz WVGMXBCFRXCSDB-GOSISDBHSA-N 1 1 339.458 3.529 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c1 ZINC000811801256 1136138336 /nfs/dbraw/zinc/13/83/36/1136138336.db2.gz HGHJSQSFIYSFHO-OAHLLOKOSA-N 1 1 349.862 3.692 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)[C@H]1CCOC1 ZINC000812777039 1136246101 /nfs/dbraw/zinc/24/61/01/1136246101.db2.gz VEKBCANUZUNVRG-HNNXBMFYSA-N 1 1 330.394 3.771 20 10 EHCDMO CCOCc1cc(CN[C@H]2CC[N@H+](C3CCCCC3)C2)ccc1OC ZINC000850382442 1136246535 /nfs/dbraw/zinc/24/65/35/1136246535.db2.gz SCFQASNRTJIJPK-IBGZPJMESA-N 1 1 346.515 3.728 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H]2CCN(C3CCCCC3)C2)ccc1OC ZINC000850382442 1136246539 /nfs/dbraw/zinc/24/65/39/1136246539.db2.gz SCFQASNRTJIJPK-IBGZPJMESA-N 1 1 346.515 3.728 20 10 EHCDMO C[C@H](NC(=O)[C@H](c1cccc(Cl)c1)[NH+](C)C)c1ccccc1O ZINC000827978435 1136434098 /nfs/dbraw/zinc/43/40/98/1136434098.db2.gz SYOWGCZEMDWHJE-SJCJKPOMSA-N 1 1 332.831 3.526 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853094006 1136508410 /nfs/dbraw/zinc/50/84/10/1136508410.db2.gz WDYPPXNLWOJXLL-CYBMUJFWSA-N 1 1 343.298 3.911 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)cc1 ZINC000815120090 1136551880 /nfs/dbraw/zinc/55/18/80/1136551880.db2.gz AFZRWYIAJUYVKA-IRXDYDNUSA-N 1 1 345.531 3.610 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnn(CC(F)F)c2)cc1 ZINC000816482862 1136723396 /nfs/dbraw/zinc/72/33/96/1136723396.db2.gz WKPKNZQAHGLGJD-UHFFFAOYSA-N 1 1 336.430 3.626 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000816494332 1136724695 /nfs/dbraw/zinc/72/46/95/1136724695.db2.gz HGCOCKVZMBQSID-CQSZACIVSA-N 1 1 326.843 3.635 20 10 EHCDMO C[N@@H+](Cc1ccc([S@@](C)=O)cc1)Cc1ccc2ccccc2c1O ZINC000816516044 1136730093 /nfs/dbraw/zinc/73/00/93/1136730093.db2.gz TTWRNCXHBVXJOB-XMMPIXPASA-N 1 1 339.460 3.915 20 10 EHCDMO C[NH+](C)CC(=O)Nc1ccc(NCc2ccc3ccccc3c2O)cc1 ZINC000816527023 1136734232 /nfs/dbraw/zinc/73/42/32/1136734232.db2.gz VVLCCGSPEDYEMM-UHFFFAOYSA-N 1 1 349.434 3.658 20 10 EHCDMO Cc1ccc2c(c1)nc(C[NH2+]Cc1cc(Cl)c(F)cc1O)n2C ZINC000816570649 1136738767 /nfs/dbraw/zinc/73/87/67/1136738767.db2.gz BIQVNXQWVWIWGB-UHFFFAOYSA-N 1 1 333.794 3.670 20 10 EHCDMO OC[C@@]1(c2ccccc2)CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816600594 1136739862 /nfs/dbraw/zinc/73/98/62/1136739862.db2.gz CCOPAIIXNYPBLH-LJQANCHMSA-N 1 1 349.833 3.711 20 10 EHCDMO OC[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816600594 1136739863 /nfs/dbraw/zinc/73/98/63/1136739863.db2.gz CCOPAIIXNYPBLH-LJQANCHMSA-N 1 1 349.833 3.711 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000817938622 1136847966 /nfs/dbraw/zinc/84/79/66/1136847966.db2.gz OOBYHLVZZVGFHO-MOPGFXCFSA-N 1 1 333.426 3.772 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2c3ccccc3CN(C)C2=O)cc1 ZINC000857874401 1136916772 /nfs/dbraw/zinc/91/67/72/1136916772.db2.gz MAUHVKGAUVZRIQ-QRWLVFNGSA-N 1 1 337.467 3.507 20 10 EHCDMO CC[C@@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1ccc(F)cc1O ZINC000858451983 1136969182 /nfs/dbraw/zinc/96/91/82/1136969182.db2.gz FUWUDRDKHACKHE-GFCCVEGCSA-N 1 1 331.313 3.525 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Br)cc1[O-] ZINC000858490629 1136972815 /nfs/dbraw/zinc/97/28/15/1136972815.db2.gz KYTLAIRDMZHSPK-OLZOCXBDSA-N 1 1 341.293 3.537 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858567363 1136979179 /nfs/dbraw/zinc/97/91/79/1136979179.db2.gz BTTBNEQTOQJMCR-NSHDSACASA-N 1 1 345.361 3.952 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)c1cc(Cl)c(Cl)cc1O ZINC000858603081 1136981907 /nfs/dbraw/zinc/98/19/07/1136981907.db2.gz QRJYMYOSMHSPCT-OTYXRUKQSA-N 1 1 343.254 3.503 20 10 EHCDMO OC1CCN(c2ccc(CNc3[nH+]ccc4ccccc43)cc2)CC1 ZINC000858634170 1136983333 /nfs/dbraw/zinc/98/33/33/1136983333.db2.gz NPRNFNDPPUBPOT-UHFFFAOYSA-N 1 1 333.435 3.808 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CC[C@@H]3CC3(Cl)Cl)CC2)cc1 ZINC000822582335 1137064299 /nfs/dbraw/zinc/06/42/99/1137064299.db2.gz CKWXFRXVIUCRCC-CQSZACIVSA-N 1 1 343.298 3.791 20 10 EHCDMO COc1ccc(N2CC[NH+](CC[C@H]3CC3(Cl)Cl)CC2)cc1F ZINC000822681057 1137070239 /nfs/dbraw/zinc/07/02/39/1137070239.db2.gz KQZRHKQULOGZIW-LBPRGKRZSA-N 1 1 347.261 3.540 20 10 EHCDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)c1 ZINC000117864437 1137085341 /nfs/dbraw/zinc/08/53/41/1137085341.db2.gz FPPPNFXJOYVZHA-QGZVFWFLSA-N 1 1 340.423 3.524 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@@H]1O ZINC000823490172 1137102351 /nfs/dbraw/zinc/10/23/51/1137102351.db2.gz WCLDKWCGIKNULH-APWZRJJASA-N 1 1 330.497 3.587 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CCN1C ZINC000823955394 1137119115 /nfs/dbraw/zinc/11/91/15/1137119115.db2.gz KPYBWLVWBULAAF-AEFFLSMTSA-N 1 1 343.540 3.957 20 10 EHCDMO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000777219181 1137119951 /nfs/dbraw/zinc/11/99/51/1137119951.db2.gz HUKPVAUTCFSFAC-HNNXBMFYSA-N 1 1 340.467 3.794 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000862221955 1137133019 /nfs/dbraw/zinc/13/30/19/1137133019.db2.gz LAAUINZZGRVHLR-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000862353971 1137139915 /nfs/dbraw/zinc/13/99/15/1137139915.db2.gz HFSOWAXTOXHUQW-GFCCVEGCSA-N 1 1 333.229 3.539 20 10 EHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3cc(Br)ccc3O)C2)cc1 ZINC000862541627 1137149305 /nfs/dbraw/zinc/14/93/05/1137149305.db2.gz XZJAOBUXRHLKPK-ZDUSSCGKSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000824932753 1137158193 /nfs/dbraw/zinc/15/81/93/1137158193.db2.gz WFLLIDMANJVJCM-MLGOLLRUSA-N 1 1 336.794 3.590 20 10 EHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)C1CCN(CC(F)(F)F)CC1 ZINC000825293809 1137171755 /nfs/dbraw/zinc/17/17/55/1137171755.db2.gz BKOXBSPNILXDCD-UHFFFAOYSA-N 1 1 336.785 3.504 20 10 EHCDMO CC(C)[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccc(N(C)C)cc1 ZINC000844278099 1137207912 /nfs/dbraw/zinc/20/79/12/1137207912.db2.gz KEKHIPVSGSSWCQ-UHFFFAOYSA-N 1 1 326.488 3.696 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)cc1C(C)C ZINC000794694073 1137234625 /nfs/dbraw/zinc/23/46/25/1137234625.db2.gz JYCQCBXKEOXUSX-HXUWFJFHSA-N 1 1 333.472 3.594 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@]3(CCOC3)OC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000794695531 1137235487 /nfs/dbraw/zinc/23/54/87/1137235487.db2.gz RGNMIZLCBUXVDO-NRFANRHFSA-N 1 1 347.499 3.768 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H](CCc3ccccc3)C2)c(O)c1 ZINC001144516174 1137304543 /nfs/dbraw/zinc/30/45/43/1137304543.db2.gz RSDFOWZQMBUYPN-MRXNPFEDSA-N 1 1 327.424 3.648 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@](O)(c3ccc(Cl)cc3)C2)c1O ZINC000846009541 1137325350 /nfs/dbraw/zinc/32/53/50/1137325350.db2.gz CPBXLIJBZVMDSC-LJQANCHMSA-N 1 1 347.842 3.538 20 10 EHCDMO FC1(F)[C@H]2C[N@@H+](Cc3ccc4c(c3)CCN4Cc3ccccc3)C[C@H]21 ZINC000846113688 1137333462 /nfs/dbraw/zinc/33/34/62/1137333462.db2.gz NVDLIVKIXFVETC-KDURUIRLSA-N 1 1 340.417 3.946 20 10 EHCDMO CC(C)C[C@@H](C[NH+]1CCCC1)NC/C=C\c1ccc(N(C)C)cc1 ZINC001202521996 1137373546 /nfs/dbraw/zinc/37/35/46/1137373546.db2.gz YMTYGDSRHPHOOD-AQWUKCDYSA-N 1 1 329.532 3.866 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]4CSC[C@H]4C3)c2c1 ZINC000872721607 1137583146 /nfs/dbraw/zinc/58/31/46/1137583146.db2.gz ICHNTYVGHYBICH-HUUCEWRRSA-N 1 1 329.465 3.739 20 10 EHCDMO CN(C(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1)c1ccc(N)cc1 ZINC000877074340 1137669588 /nfs/dbraw/zinc/66/95/88/1137669588.db2.gz HOMCEMSFGSPLMY-SFHVURJKSA-N 1 1 343.858 3.550 20 10 EHCDMO CN(C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1)c1ccc(N)cc1 ZINC000877074340 1137669589 /nfs/dbraw/zinc/66/95/89/1137669589.db2.gz HOMCEMSFGSPLMY-SFHVURJKSA-N 1 1 343.858 3.550 20 10 EHCDMO CCC[C@]1(CO)CC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000825943542 1137671960 /nfs/dbraw/zinc/67/19/60/1137671960.db2.gz GYYWHWQNQSXTIM-FQEVSTJZSA-N 1 1 335.488 3.683 20 10 EHCDMO Cc1cc(O)c(CNc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc1Cl ZINC000825955023 1137674405 /nfs/dbraw/zinc/67/44/05/1137674405.db2.gz DMJVLLQYAGORPZ-QGZVFWFLSA-N 1 1 346.858 3.533 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)sc1C ZINC000877487761 1137678036 /nfs/dbraw/zinc/67/80/36/1137678036.db2.gz AXAGOOSMSXEYFG-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@H+]2Cc2ccc(C)cc2O)sc1C ZINC000877487761 1137678037 /nfs/dbraw/zinc/67/80/37/1137678037.db2.gz AXAGOOSMSXEYFG-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)nc1Cl ZINC000878240174 1137708229 /nfs/dbraw/zinc/70/82/29/1137708229.db2.gz DGVMDLKXVZVSHI-QGZVFWFLSA-N 1 1 346.858 3.930 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1Cl ZINC000826043399 1137717096 /nfs/dbraw/zinc/71/70/96/1137717096.db2.gz IVSVZACLJLIBLQ-APWZRJJASA-N 1 1 349.833 3.654 20 10 EHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1CC2(CO1)CCOCC2 ZINC000878565069 1137720499 /nfs/dbraw/zinc/72/04/99/1137720499.db2.gz HRDFSCUCIGPSLR-GOSISDBHSA-N 1 1 333.472 3.580 20 10 EHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@H](C)Cc1ccc(OC)cc1 ZINC000128416380 1137778531 /nfs/dbraw/zinc/77/85/31/1137778531.db2.gz MCNWLLBHBYYDBF-OAHLLOKOSA-N 1 1 329.440 3.863 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000882911589 1137837781 /nfs/dbraw/zinc/83/77/81/1137837781.db2.gz XQPMEPOPVUEAQK-SFHVURJKSA-N 1 1 347.361 3.683 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc(OCC(F)F)c1 ZINC000882986278 1137840411 /nfs/dbraw/zinc/84/04/11/1137840411.db2.gz OSRBAEVTJGKRHY-UHFFFAOYSA-N 1 1 329.293 3.604 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1cccc(SC)c1)Cc1ccccc1O ZINC000130724543 1137841517 /nfs/dbraw/zinc/84/15/17/1137841517.db2.gz RIZDLXPKARGLEW-UHFFFAOYSA-N 1 1 344.480 3.965 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000883075909 1137843569 /nfs/dbraw/zinc/84/35/69/1137843569.db2.gz ORBBIOYQHKFKTF-UGSOOPFHSA-N 1 1 333.378 3.928 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2CCC3(COC3)CC2)c1 ZINC000883388748 1137858989 /nfs/dbraw/zinc/85/89/89/1137858989.db2.gz BJBTWNZTUBJWDR-UHFFFAOYSA-N 1 1 340.261 3.512 20 10 EHCDMO C[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1c(O)cccc1F ZINC000886487725 1138082540 /nfs/dbraw/zinc/08/25/40/1138082540.db2.gz RKQXVHYDDDZFNA-OAHLLOKOSA-N 1 1 328.431 3.847 20 10 EHCDMO C[C@@H]([NH2+]C1CCN([C@H](C)c2ccncc2)CC1)c1c(O)cccc1F ZINC000886553241 1138095112 /nfs/dbraw/zinc/09/51/12/1138095112.db2.gz HPIZDYQAPSAPJW-HUUCEWRRSA-N 1 1 343.446 3.803 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@H](OC(C)(C)C)[C@H]1n1cccn1)c1c(O)cccc1F ZINC000886621732 1138103366 /nfs/dbraw/zinc/10/33/66/1138103366.db2.gz ACAGJLWBUYUQHF-QUCGAITQSA-N 1 1 347.434 3.576 20 10 EHCDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc3c(cc1O)OCO3)CCC2 ZINC000126146612 1138325424 /nfs/dbraw/zinc/32/54/24/1138325424.db2.gz NZPIBUFZVZMTDT-ZDUSSCGKSA-N 1 1 346.452 3.649 20 10 EHCDMO CN(C)C(=O)Sc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000176922638 1139586410 /nfs/dbraw/zinc/58/64/10/1139586410.db2.gz HQJORODALDVEAP-UHFFFAOYSA-N 1 1 330.453 3.798 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)cc1OC ZINC000179661262 1139772746 /nfs/dbraw/zinc/77/27/46/1139772746.db2.gz BHPDGYIJZOJPNY-LLVKDONJSA-N 1 1 337.366 3.881 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000180799905 1139864713 /nfs/dbraw/zinc/86/47/13/1139864713.db2.gz ZZCOWLPSEXEHGK-ZDUSSCGKSA-N 1 1 343.324 3.584 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@H](C)c1cnccn1 ZINC000184591024 1140110512 /nfs/dbraw/zinc/11/05/12/1140110512.db2.gz DWPIYDSTPNAGEQ-LLVKDONJSA-N 1 1 336.233 3.528 20 10 EHCDMO C[C@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(F)cc1O ZINC000185048920 1140133379 /nfs/dbraw/zinc/13/33/79/1140133379.db2.gz SESSLUPXBKLLLT-KSSFIOAISA-N 1 1 342.414 3.546 20 10 EHCDMO CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000185671077 1140162402 /nfs/dbraw/zinc/16/24/02/1140162402.db2.gz WJNBCQTXNNTETG-RDJZCZTQSA-N 1 1 330.472 3.553 20 10 EHCDMO C[C@H]([NH2+]CCCNC(=O)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000193014133 1140560112 /nfs/dbraw/zinc/56/01/12/1140560112.db2.gz WAUCIQMELUMXQC-JTQLQIEISA-N 1 1 345.270 3.656 20 10 EHCDMO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)[nH]1 ZINC000271543421 1141394227 /nfs/dbraw/zinc/39/42/27/1141394227.db2.gz RDANAQPIIGXKDR-UONOGXRCSA-N 1 1 345.466 3.908 20 10 EHCDMO COc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1O ZINC000283173912 1141566968 /nfs/dbraw/zinc/56/69/68/1141566968.db2.gz ZHCIJBYUMSXTOE-AWEZNQCLSA-N 1 1 329.362 3.955 20 10 EHCDMO COc1cc(O)c(C[N@H+](Cc2ccc(F)cc2)CC2CC2)cc1OC ZINC000160205858 1014357592 /nfs/dbraw/zinc/35/75/92/1014357592.db2.gz VCQUTCJACOEDLF-UHFFFAOYSA-N 1 1 345.414 3.961 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cn3cc(Cl)ccc3n2)cc1 ZINC000050274527 1032377754 /nfs/dbraw/zinc/37/77/54/1032377754.db2.gz YGBPJVFMSXFGTD-UHFFFAOYSA-N 1 1 328.847 3.686 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cn3cc(Cl)ccc3n2)cc1 ZINC000050274527 1032377764 /nfs/dbraw/zinc/37/77/64/1032377764.db2.gz YGBPJVFMSXFGTD-UHFFFAOYSA-N 1 1 328.847 3.686 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000709007288 1018336741 /nfs/dbraw/zinc/33/67/41/1018336741.db2.gz OBRNDJFQVHCXCE-CQSZACIVSA-N 1 1 342.277 3.710 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000709007288 1018336749 /nfs/dbraw/zinc/33/67/49/1018336749.db2.gz OBRNDJFQVHCXCE-CQSZACIVSA-N 1 1 342.277 3.710 20 10 EHCDMO COc1ccccc1C[N@H+](C)Cc1cccc(Br)c1O ZINC000160420537 1018764869 /nfs/dbraw/zinc/76/48/69/1018764869.db2.gz PEXHTIKKGAAAIQ-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO COc1ccccc1C[N@@H+](C)Cc1cccc(Br)c1O ZINC000160420537 1018764887 /nfs/dbraw/zinc/76/48/87/1018764887.db2.gz PEXHTIKKGAAAIQ-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO Cc1ccc2c(ccnc2NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001167422949 1019732624 /nfs/dbraw/zinc/73/26/24/1019732624.db2.gz IBFSBRQXAHCYIQ-UHFFFAOYSA-N 1 1 346.478 3.907 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000050901244 1020665215 /nfs/dbraw/zinc/66/52/15/1020665215.db2.gz GZZQRPJJUPRGQL-IAGOWNOFSA-N 1 1 332.488 3.526 20 10 EHCDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000760400588 1032926301 /nfs/dbraw/zinc/92/63/01/1032926301.db2.gz QFPDNMDVCFYBLW-HNNXBMFYSA-N 1 1 345.483 3.825 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000178083476 1021210221 /nfs/dbraw/zinc/21/02/21/1021210221.db2.gz DCYBSSAVMFNIFJ-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO CCCC[N@@H+](Cc1ccc2oc(=O)oc2c1)Cc1ccccc1O ZINC000894678998 1022699365 /nfs/dbraw/zinc/69/93/65/1022699365.db2.gz IFEGATDXRVISRB-UHFFFAOYSA-N 1 1 327.380 3.894 20 10 EHCDMO Oc1c(F)cccc1C[N@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000277074192 1023745572 /nfs/dbraw/zinc/74/55/72/1023745572.db2.gz RMZLOPZYWNLKRJ-UHFFFAOYSA-N 1 1 333.378 3.852 20 10 EHCDMO Oc1c(F)cccc1C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000277074192 1023745581 /nfs/dbraw/zinc/74/55/81/1023745581.db2.gz RMZLOPZYWNLKRJ-UHFFFAOYSA-N 1 1 333.378 3.852 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2CC3(C2)CO[C@@H](C)C3)c1 ZINC000897778845 1033171974 /nfs/dbraw/zinc/17/19/74/1033171974.db2.gz KXTMMIMMIOJCBN-XOMBGVMMSA-N 1 1 340.261 3.510 20 10 EHCDMO OCC1([C@@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc2)CC=CC1 ZINC000895083352 1024120308 /nfs/dbraw/zinc/12/03/08/1024120308.db2.gz DOAVXQOVXDFQOA-IBGZPJMESA-N 1 1 345.389 3.830 20 10 EHCDMO CC(=O)N1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000280859282 1024346691 /nfs/dbraw/zinc/34/66/91/1024346691.db2.gz CBGZWHIQEBQWQM-PWSUYJOCSA-N 1 1 345.270 3.608 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cc2c(cc1O)CCCC2 ZINC000273510379 1027465481 /nfs/dbraw/zinc/46/54/81/1027465481.db2.gz RSAPLUIQAKMDIU-KPZWWZAWSA-N 1 1 347.405 3.933 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](CCCO)c2ccccc2)c1O ZINC000271761800 1029158505 /nfs/dbraw/zinc/15/85/05/1029158505.db2.gz HUUWHHRQIVUUFO-GOSISDBHSA-N 1 1 347.842 3.852 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1 ZINC000271902563 1029222237 /nfs/dbraw/zinc/22/22/37/1029222237.db2.gz ZNONPKKJRPGOOX-WMLDXEAASA-N 1 1 333.453 3.550 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c(C)n1-c1ccccc1 ZINC000126041192 1029653726 /nfs/dbraw/zinc/65/37/26/1029653726.db2.gz WTEBXFVSIUVNAG-MGPUTAFESA-N 1 1 339.483 3.506 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000278465730 1030959553 /nfs/dbraw/zinc/95/95/53/1030959553.db2.gz GGGXNFGAQXDJED-JTQLQIEISA-N 1 1 336.775 3.813 20 10 EHCDMO CC[N@H+](C)C[C@H]1CCN(Cc2ccc(N3CCCCC3)c(C)c2)C1 ZINC000827991789 1034391284 /nfs/dbraw/zinc/39/12/84/1034391284.db2.gz WOQXSTGWXCBLPB-HXUWFJFHSA-N 1 1 329.532 3.759 20 10 EHCDMO CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(N3CCCCC3)c(C)c2)C1 ZINC000827991789 1034391300 /nfs/dbraw/zinc/39/13/00/1034391300.db2.gz WOQXSTGWXCBLPB-HXUWFJFHSA-N 1 1 329.532 3.759 20 10 EHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(OC)c2O)C12CCC2 ZINC000761202519 1034411283 /nfs/dbraw/zinc/41/12/83/1034411283.db2.gz FQWUMLSICLHVJB-HOTGVXAUSA-N 1 1 339.863 3.834 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(Br)ccc1O ZINC000179584497 1034511433 /nfs/dbraw/zinc/51/14/33/1034511433.db2.gz VUNPCBQFUYYMEQ-UHFFFAOYSA-N 1 1 336.229 3.882 20 10 EHCDMO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)s1)c1cc(F)ccc1O ZINC000186105656 1035585929 /nfs/dbraw/zinc/58/59/29/1035585929.db2.gz NRNJZLHAXVJUIP-LLVKDONJSA-N 1 1 329.400 3.901 20 10 EHCDMO Cc1nc([C@H]2CC[N@@H+](Cc3cc(C)cc(C(C)(C)C)c3O)C2)no1 ZINC000905684569 1039040167 /nfs/dbraw/zinc/04/01/67/1039040167.db2.gz AVMLHCYVQMCAKV-AWEZNQCLSA-N 1 1 329.444 3.679 20 10 EHCDMO Cc1noc(C)c1C[N@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC000893962581 1039866045 /nfs/dbraw/zinc/86/60/45/1039866045.db2.gz NRXUWOBIUVQSMM-UHFFFAOYSA-N 1 1 343.196 3.531 20 10 EHCDMO Cc1noc(C)c1CN(C)Cc1cc(Br)cc(F)c1[O-] ZINC000893962581 1039866071 /nfs/dbraw/zinc/86/60/71/1039866071.db2.gz NRXUWOBIUVQSMM-UHFFFAOYSA-N 1 1 343.196 3.531 20 10 EHCDMO C[C@H]([NH2+]CCCC(=O)N1CCc2ccccc21)c1ccc(F)cc1O ZINC000186021063 1127235271 /nfs/dbraw/zinc/23/52/71/1127235271.db2.gz FJFWZERLNWNIOE-AWEZNQCLSA-N 1 1 342.414 3.551 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1O ZINC000765005208 1127564282 /nfs/dbraw/zinc/56/42/82/1127564282.db2.gz HREWZNZKJYHSGM-OAHLLOKOSA-N 1 1 344.842 3.708 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC000765147076 1127579130 /nfs/dbraw/zinc/57/91/30/1127579130.db2.gz VUIURNRONYBQNF-UHFFFAOYSA-N 1 1 326.346 3.777 20 10 EHCDMO Nc1ccc(NC(=O)Nc2ccc(Nc3ccc[nH+]c3N)cc2)cc1 ZINC001212410636 1128467152 /nfs/dbraw/zinc/46/71/52/1128467152.db2.gz NQHHHPQVHULUDE-UHFFFAOYSA-N 1 1 334.383 3.634 20 10 EHCDMO CCC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H]1CCc2ccccc2C1 ZINC000919951913 1123244013 /nfs/dbraw/zinc/24/40/13/1123244013.db2.gz WOWKOMXDXKXAIW-SFHVURJKSA-N 1 1 339.435 3.890 20 10 EHCDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000921052945 1123458637 /nfs/dbraw/zinc/45/86/37/1123458637.db2.gz HNTVKAKDMBPDEQ-SJORKVTESA-N 1 1 332.488 3.526 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000179560140 1123796988 /nfs/dbraw/zinc/79/69/88/1123796988.db2.gz DMPLLXKVVHJQRB-DLBZAZTESA-N 1 1 338.234 3.789 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1O ZINC000179792458 1123859188 /nfs/dbraw/zinc/85/91/88/1123859188.db2.gz CDYWIUZKHUVEMQ-MRXNPFEDSA-N 1 1 348.487 3.780 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](CCCO)[C@@H]2CCCc3ccccc32)c1 ZINC000180521094 1124025751 /nfs/dbraw/zinc/02/57/51/1124025751.db2.gz CRRVWKUHFNHNRC-HXUWFJFHSA-N 1 1 341.451 3.663 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2nccc3c2CCCC3)cc1F ZINC000922465982 1129542620 /nfs/dbraw/zinc/54/26/20/1129542620.db2.gz XZOQYCKQZXPAIN-UHFFFAOYSA-N 1 1 331.410 3.594 20 10 EHCDMO CC(C)(C)n1ncnc1C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000282594444 1131100635 /nfs/dbraw/zinc/10/06/35/1131100635.db2.gz HCWWREJYJFMXQB-UHFFFAOYSA-N 1 1 336.439 3.696 20 10 EHCDMO Cc1cc(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000742375604 1131717394 /nfs/dbraw/zinc/71/73/94/1131717394.db2.gz SKQGXRDCGBLZKN-OXQOHEQNSA-N 1 1 325.500 3.975 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)c1O ZINC000743377065 1131913181 /nfs/dbraw/zinc/91/31/81/1131913181.db2.gz XEZISNDNQQZHEK-BETUJISGSA-N 1 1 345.464 3.658 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)Cc2nccn2Cc2ccccc2)cc1C ZINC000743377686 1131914356 /nfs/dbraw/zinc/91/43/56/1131914356.db2.gz SOQPHWNXKJHXSS-UHFFFAOYSA-N 1 1 335.451 3.886 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2nccn2Cc2ccccc2)cc1C ZINC000743377686 1131914361 /nfs/dbraw/zinc/91/43/61/1131914361.db2.gz SOQPHWNXKJHXSS-UHFFFAOYSA-N 1 1 335.451 3.886 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)NCCC1=CCCCC1 ZINC000743870612 1131996609 /nfs/dbraw/zinc/99/66/09/1131996609.db2.gz ZABTWFOXWNDXAU-KRWDZBQOSA-N 1 1 344.499 3.999 20 10 EHCDMO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)CCO2 ZINC000768273941 1133120294 /nfs/dbraw/zinc/12/02/94/1133120294.db2.gz BHWRAPRYXIHYFM-QFYYESIMSA-N 1 1 335.350 3.853 20 10 EHCDMO CSc1ccccc1NCc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001178012860 1133123651 /nfs/dbraw/zinc/12/36/51/1133123651.db2.gz INUMJZDDUFZYGK-UHFFFAOYSA-N 1 1 345.487 3.912 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c(O)cc1C ZINC000768450978 1133139995 /nfs/dbraw/zinc/13/99/95/1133139995.db2.gz KVGFPIVJYLMMMM-INIZCTEOSA-N 1 1 341.407 3.775 20 10 EHCDMO COc1cc(O)c(C[N@@H+](CCc2ccc(F)cc2)C2CC2)cc1OC ZINC000768445079 1133140727 /nfs/dbraw/zinc/14/07/27/1133140727.db2.gz FIFSTJYVLZLGIB-UHFFFAOYSA-N 1 1 345.414 3.756 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc(OC)cc2OC)cc1 ZINC000773732479 1133147431 /nfs/dbraw/zinc/14/74/31/1133147431.db2.gz BKVGSOJKYUEQSC-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+]([C@H](C)C2CC2)C2CC2)c1O ZINC000768532526 1133150978 /nfs/dbraw/zinc/15/09/78/1133150978.db2.gz MPGXMGQCVJLFPP-SNVBAGLBSA-N 1 1 340.261 3.926 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCc3ccc(F)c(F)c3)CC2)cc1 ZINC000768534641 1133152413 /nfs/dbraw/zinc/15/24/13/1133152413.db2.gz KRAOAEIETJRALD-UHFFFAOYSA-N 1 1 346.421 3.728 20 10 EHCDMO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC001178304391 1133155092 /nfs/dbraw/zinc/15/50/92/1133155092.db2.gz GCTHTRWGJCUZIG-BTDLBPIBSA-N 1 1 325.330 3.675 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC001178758835 1133196326 /nfs/dbraw/zinc/19/63/26/1133196326.db2.gz KJDIQNNDVPPOTQ-UHFFFAOYSA-N 1 1 334.700 3.888 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCc3ccc(C(C)=O)cc3CC2)cc1 ZINC000773800349 1133225764 /nfs/dbraw/zinc/22/57/64/1133225764.db2.gz LUZORBMFNSLLTR-UHFFFAOYSA-N 1 1 336.479 3.946 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)c(O)c1 ZINC000769108034 1133227947 /nfs/dbraw/zinc/22/79/47/1133227947.db2.gz XFFFAPGMGODFRG-FOIQADDNSA-N 1 1 327.424 3.753 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cc(C)ccc2O)C[C@H]2CCCO2)c1 ZINC000769124354 1133229464 /nfs/dbraw/zinc/22/94/64/1133229464.db2.gz JEWJKBQVLFGYSW-HXUWFJFHSA-N 1 1 341.451 3.890 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H](O)c1cccc2ccccc21 ZINC001179123045 1133230329 /nfs/dbraw/zinc/23/03/29/1133230329.db2.gz LQXOALODRXDWBF-SFHVURJKSA-N 1 1 329.346 3.647 20 10 EHCDMO CCC[N@@H+](Cc1cccc(Br)c1O)C[C@H]1CCCCO1 ZINC000769340866 1133266406 /nfs/dbraw/zinc/26/64/06/1133266406.db2.gz YENQYCHAQDKKJE-CQSZACIVSA-N 1 1 342.277 3.936 20 10 EHCDMO CCC[N@H+](Cc1cccc(Br)c1O)C[C@H]1CCCCO1 ZINC000769340866 1133266409 /nfs/dbraw/zinc/26/64/09/1133266409.db2.gz YENQYCHAQDKKJE-CQSZACIVSA-N 1 1 342.277 3.936 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCCCC[C@H]2C)c1O ZINC000769405257 1133278774 /nfs/dbraw/zinc/27/87/74/1133278774.db2.gz RVCOHKWPJVFQPB-LLVKDONJSA-N 1 1 328.250 3.928 20 10 EHCDMO CCC[N@@H+](Cc1cc(OCC)ccc1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000769469758 1133297320 /nfs/dbraw/zinc/29/73/20/1133297320.db2.gz DZLLTCLRJWKLOR-BHIYHBOVSA-N 1 1 333.472 3.816 20 10 EHCDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769504192 1133303408 /nfs/dbraw/zinc/30/34/08/1133303408.db2.gz PKTMDBXUHTUSAQ-GOSISDBHSA-N 1 1 344.499 3.841 20 10 EHCDMO CCOc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000769513349 1133306225 /nfs/dbraw/zinc/30/62/25/1133306225.db2.gz BIPJMWNNVOTFEQ-SCLBCKFNSA-N 1 1 333.453 3.814 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000769513349 1133306227 /nfs/dbraw/zinc/30/62/27/1133306227.db2.gz BIPJMWNNVOTFEQ-SCLBCKFNSA-N 1 1 333.453 3.814 20 10 EHCDMO COc1ccc(C[C@H]2CC[N@H+]2Cc2cc(Cl)cc(OC)c2O)cc1 ZINC001180112833 1133333454 /nfs/dbraw/zinc/33/34/54/1133333454.db2.gz OTJMKGPMPMFFCC-MRXNPFEDSA-N 1 1 347.842 3.880 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@@H+](Cc2ccc(C(N)=O)cc2)C2CC2)c1 ZINC001180244826 1133349811 /nfs/dbraw/zinc/34/98/11/1133349811.db2.gz LBXUSZQFHCHEAG-UHFFFAOYSA-N 1 1 338.451 3.779 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC001180376361 1133362954 /nfs/dbraw/zinc/36/29/54/1133362954.db2.gz MUPWISWIMNSFRA-UHFFFAOYSA-N 1 1 345.512 3.617 20 10 EHCDMO CC1(C)CCC[C@](O)(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC001203364032 1133397509 /nfs/dbraw/zinc/39/75/09/1133397509.db2.gz ZJGHLKRRSPDGOZ-QGZVFWFLSA-N 1 1 329.843 3.996 20 10 EHCDMO Oc1cc(F)c(F)cc1C[NH2+]Cc1ccnc(N2CCCCCC2)c1 ZINC001180603250 1133398276 /nfs/dbraw/zinc/39/82/76/1133398276.db2.gz QXHJBUDNBGTNMK-UHFFFAOYSA-N 1 1 347.409 3.736 20 10 EHCDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc(Br)cc1O ZINC001181390889 1133487145 /nfs/dbraw/zinc/48/71/45/1133487145.db2.gz NHVIGLJFPKIFOD-MRXNPFEDSA-N 1 1 342.277 3.528 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c(C)o1 ZINC001181554900 1133500051 /nfs/dbraw/zinc/50/00/51/1133500051.db2.gz HHQZOUWXRTUMJS-UHFFFAOYSA-N 1 1 342.439 3.607 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1O ZINC001182035140 1133564553 /nfs/dbraw/zinc/56/45/53/1133564553.db2.gz WUYBWTJAXYFCJP-MRXNPFEDSA-N 1 1 347.377 3.641 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1O ZINC001182035140 1133564556 /nfs/dbraw/zinc/56/45/56/1133564556.db2.gz WUYBWTJAXYFCJP-MRXNPFEDSA-N 1 1 347.377 3.641 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@H](c3cccs3)C3CC3)cc2)CC1 ZINC000771823375 1133601870 /nfs/dbraw/zinc/60/18/70/1133601870.db2.gz MRWLMCVPYPUUJH-FQEVSTJZSA-N 1 1 341.524 3.741 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000771866959 1133603477 /nfs/dbraw/zinc/60/34/77/1133603477.db2.gz GFXYIXBZMAMSNO-VXKWHMMOSA-N 1 1 349.522 3.864 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCN(C2CCCCC2)C1=O)c1ccc(F)cc1O ZINC000785572385 1133728983 /nfs/dbraw/zinc/72/89/83/1133728983.db2.gz ZVMPHGLFDCPOMM-DYVFJYSZSA-N 1 1 334.435 3.506 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000786160790 1133808838 /nfs/dbraw/zinc/80/88/38/1133808838.db2.gz LGJAHLWRKQELLY-UHFFFAOYSA-N 1 1 331.213 3.926 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)CCc2ccc3c(c2)OCO3)cc1 ZINC001183843163 1133862970 /nfs/dbraw/zinc/86/29/70/1133862970.db2.gz HWDNWHNORLOAKX-SNAWJCMRSA-N 1 1 338.451 3.669 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000787290095 1133985292 /nfs/dbraw/zinc/98/52/92/1133985292.db2.gz MDOADWBLFGPKJR-LBPRGKRZSA-N 1 1 336.794 3.623 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@H]3CC=C(C)CC3)cc2F)CC1 ZINC000788593206 1134148811 /nfs/dbraw/zinc/14/88/11/1134148811.db2.gz GOFRBNIVEAYYBP-SFHVURJKSA-N 1 1 331.479 3.556 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000788624992 1134153114 /nfs/dbraw/zinc/15/31/14/1134153114.db2.gz IOWUXMXUACAIQD-GRYCIOLGSA-N 1 1 328.378 3.687 20 10 EHCDMO CCN(CC)C(=O)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788639173 1134154453 /nfs/dbraw/zinc/15/44/53/1134154453.db2.gz NASBFDPKZADUIY-GFCCVEGCSA-N 1 1 346.393 3.710 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2cccs2)C2CC2)ccc1[N+](=O)[O-] ZINC000774966655 1134158006 /nfs/dbraw/zinc/15/80/06/1134158006.db2.gz LXRYWRLEGRHYCN-AWEZNQCLSA-N 1 1 334.397 3.611 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](CC2CC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775015530 1134211631 /nfs/dbraw/zinc/21/16/31/1134211631.db2.gz SOWITZCNORQURA-INIZCTEOSA-N 1 1 342.395 3.940 20 10 EHCDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000775027792 1134229085 /nfs/dbraw/zinc/22/90/85/1134229085.db2.gz ISHNUBKRVRJXKO-GOSISDBHSA-N 1 1 330.384 3.724 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cccc(Br)c2O)cnc1Cl ZINC000775144819 1134386149 /nfs/dbraw/zinc/38/61/49/1134386149.db2.gz FRGCOHSRPKBOFP-UHFFFAOYSA-N 1 1 341.636 3.801 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc2c(c1)CC(=O)N2C ZINC000790960534 1134485728 /nfs/dbraw/zinc/48/57/28/1134485728.db2.gz VLMHENTWYOCDMQ-SNVBAGLBSA-N 1 1 348.805 3.554 20 10 EHCDMO Clc1ccc2c(c1)CC[N@H+](Cc1ccc(N3CCOCC3)cc1)C2 ZINC000792178422 1134663410 /nfs/dbraw/zinc/66/34/10/1134663410.db2.gz CBGNQALRJUADON-UHFFFAOYSA-N 1 1 342.870 3.735 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)NC1CC1)c1ccccc1 ZINC000772797640 1134698799 /nfs/dbraw/zinc/69/87/99/1134698799.db2.gz HQNJAMAJGVXSIU-HXUWFJFHSA-N 1 1 338.451 3.624 20 10 EHCDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792825834 1134796630 /nfs/dbraw/zinc/79/66/30/1134796630.db2.gz BMFIPBNRUYOCRC-IUODEOHRSA-N 1 1 330.394 3.507 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Br)ccc1O ZINC000793230318 1134880059 /nfs/dbraw/zinc/88/00/59/1134880059.db2.gz FWCWPGADICJRNB-LDYMZIIASA-N 1 1 338.167 3.927 20 10 EHCDMO Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000793206985 1134882712 /nfs/dbraw/zinc/88/27/12/1134882712.db2.gz MLYZKVZPRDXUOI-KRWDZBQOSA-N 1 1 344.886 3.966 20 10 EHCDMO c1ccc(C2=CCC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000793619054 1134973516 /nfs/dbraw/zinc/97/35/16/1134973516.db2.gz CLEBKUZZOGDGPN-UHFFFAOYSA-N 1 1 334.463 3.813 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)c1ncc(Br)cn1)c1ccccc1O ZINC000805749039 1135318771 /nfs/dbraw/zinc/31/87/71/1135318771.db2.gz UMNQMQJYAHNWBK-ZWNOBZJWSA-N 1 1 336.233 3.747 20 10 EHCDMO CC(C)[N@H+](Cc1ccccc1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775633804 1135364079 /nfs/dbraw/zinc/36/40/79/1135364079.db2.gz KTKCPEJVCYWTLV-UHFFFAOYSA-N 1 1 337.511 3.849 20 10 EHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775633804 1135364084 /nfs/dbraw/zinc/36/40/84/1135364084.db2.gz KTKCPEJVCYWTLV-UHFFFAOYSA-N 1 1 337.511 3.849 20 10 EHCDMO COc1cc2c(cc1OC)C[N@@H+](Cc1cc(Cl)cc(C)c1O)CC2 ZINC000775642773 1135382090 /nfs/dbraw/zinc/38/20/90/1135382090.db2.gz HMCUXHHTUAOVLP-UHFFFAOYSA-N 1 1 347.842 3.930 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)[C@@H](CC)CN1C(C)=O ZINC000775720542 1135575545 /nfs/dbraw/zinc/57/55/45/1135575545.db2.gz LASVYVBLRAZOEJ-IRXDYDNUSA-N 1 1 338.879 3.575 20 10 EHCDMO C[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)[NH+]1CCCCCC1 ZINC000807837773 1135580278 /nfs/dbraw/zinc/58/02/78/1135580278.db2.gz CARCWPPVHITMAA-LLVKDONJSA-N 1 1 345.270 3.580 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1O ZINC000775746162 1135620198 /nfs/dbraw/zinc/62/01/98/1135620198.db2.gz CGYDHGNIGKYOIR-ZDUSSCGKSA-N 1 1 346.862 3.729 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1O ZINC000775746162 1135620202 /nfs/dbraw/zinc/62/02/02/1135620202.db2.gz CGYDHGNIGKYOIR-ZDUSSCGKSA-N 1 1 346.862 3.729 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1O ZINC000775746162 1135620206 /nfs/dbraw/zinc/62/02/06/1135620206.db2.gz CGYDHGNIGKYOIR-ZDUSSCGKSA-N 1 1 346.862 3.729 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)c(O)c(C(C)(C)C)c1 ZINC000747461269 1135621741 /nfs/dbraw/zinc/62/17/41/1135621741.db2.gz PCVIXLAFKBJDOQ-MRXNPFEDSA-N 1 1 341.499 3.796 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2CCN(c3ccc(F)cc3F)CC2)cc1 ZINC001197051541 1135641682 /nfs/dbraw/zinc/64/16/82/1135641682.db2.gz LEZWMWADVGFVKB-UHFFFAOYSA-N 1 1 345.437 3.743 20 10 EHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cn(-c3ccccc3)nn2)c1O ZINC000808707060 1135717430 /nfs/dbraw/zinc/71/74/30/1135717430.db2.gz ZLBJJNWHJHGNCC-ZDUSSCGKSA-N 1 1 342.830 3.786 20 10 EHCDMO C[C@@H]([NH2+]Cc1nc(-c2ccc(F)cc2)no1)c1ccc(N(C)C)cc1 ZINC000775835744 1135796397 /nfs/dbraw/zinc/79/63/97/1135796397.db2.gz WSNRMIHYEMGQRE-CYBMUJFWSA-N 1 1 340.402 3.793 20 10 EHCDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000809692593 1135867057 /nfs/dbraw/zinc/86/70/57/1135867057.db2.gz AZRZUVXJFDXUTD-IZAXUBKRSA-N 1 1 327.424 3.580 20 10 EHCDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000809720626 1135878303 /nfs/dbraw/zinc/87/83/03/1135878303.db2.gz JZPSBEBSVAZUAC-OAHLLOKOSA-N 1 1 340.851 3.535 20 10 EHCDMO Cc1nonc1C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000809743989 1135884262 /nfs/dbraw/zinc/88/42/62/1135884262.db2.gz PNSINQCSCUNTNO-UHFFFAOYSA-N 1 1 331.460 3.968 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2Cc3ccc(OC)cc3C3(CC3)C2)c1 ZINC000811519123 1136098103 /nfs/dbraw/zinc/09/81/03/1136098103.db2.gz UGCMZWHIZPNYNM-UHFFFAOYSA-N 1 1 339.435 3.847 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc(O)c3O)cc2)C1 ZINC000776337110 1136157745 /nfs/dbraw/zinc/15/77/45/1136157745.db2.gz RPXKWJGDJKSEJZ-CQSZACIVSA-N 1 1 340.423 3.582 20 10 EHCDMO CCN1CCC[C@@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850098981 1136210949 /nfs/dbraw/zinc/21/09/49/1136210949.db2.gz PXEPIULDIYGVIT-HNNXBMFYSA-N 1 1 334.504 3.520 20 10 EHCDMO Cc1cc(Cl)cc(CNc2cccc(C[N@H+]3CC[C@H](O)C3)c2)c1O ZINC000812778223 1136245861 /nfs/dbraw/zinc/24/58/61/1136245861.db2.gz HZFNHGGQOAXERG-SFHVURJKSA-N 1 1 346.858 3.533 20 10 EHCDMO C[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1cc(Br)c(F)cc1O ZINC000850524567 1136277656 /nfs/dbraw/zinc/27/76/56/1136277656.db2.gz HAVVEXJSBJCXMQ-NXEZZACHSA-N 1 1 344.224 3.656 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CCC[C@H]1Cc1cnn(C)c1)c1ccc(F)cc1O ZINC000850540199 1136282098 /nfs/dbraw/zinc/28/20/98/1136282098.db2.gz JFERPJLRHZGBCG-WBAXXEDZSA-N 1 1 331.435 3.717 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1c(OC)cccc1OC ZINC000813334517 1136319663 /nfs/dbraw/zinc/31/96/63/1136319663.db2.gz NMTKQRAGNKPVAJ-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO C[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1O ZINC000109772341 1136340029 /nfs/dbraw/zinc/34/00/29/1136340029.db2.gz IINPRLNSNYLNGI-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1O ZINC000109772341 1136340033 /nfs/dbraw/zinc/34/00/33/1136340033.db2.gz IINPRLNSNYLNGI-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H](O)Cc1ccccc1 ZINC000111232781 1136524651 /nfs/dbraw/zinc/52/46/51/1136524651.db2.gz TZBMQJBQRYAFQQ-IBGZPJMESA-N 1 1 337.419 3.591 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@](CO)(c3ccccc3)C2)ccc1N(C)C ZINC000815111606 1136550323 /nfs/dbraw/zinc/55/03/23/1136550323.db2.gz DBLNMDLBBIHIQB-QFIPXVFZSA-N 1 1 338.495 3.587 20 10 EHCDMO Cc1cc(CN2CCO[C@H](CCC[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000853623164 1136550411 /nfs/dbraw/zinc/55/04/11/1136550411.db2.gz FRQWSLUBPDFICZ-GOSISDBHSA-N 1 1 348.531 3.541 20 10 EHCDMO Cc1cc(C[N@H+](C)CCCN(C)Cc2ccco2)ccc1N(C)C ZINC000815116728 1136551192 /nfs/dbraw/zinc/55/11/92/1136551192.db2.gz BIRHGRDMEMTXRB-UHFFFAOYSA-N 1 1 329.488 3.608 20 10 EHCDMO Cc1cc(C[N@H+](C)Cc2nc(-c3cccs3)no2)ccc1N(C)C ZINC000815116118 1136551462 /nfs/dbraw/zinc/55/14/62/1136551462.db2.gz AMGBMDSBLITDGY-UHFFFAOYSA-N 1 1 342.468 3.805 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)ccc1N(C)C ZINC000815116118 1136551463 /nfs/dbraw/zinc/55/14/63/1136551463.db2.gz AMGBMDSBLITDGY-UHFFFAOYSA-N 1 1 342.468 3.805 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815554219 1136609713 /nfs/dbraw/zinc/60/97/13/1136609713.db2.gz VCDJSTSXDKOHSM-RISCZKNCSA-N 1 1 342.361 3.958 20 10 EHCDMO C[C@@H]([NH2+]Cc1cn2ccsc2n1)c1cccc(C(F)(F)F)c1O ZINC000815567268 1136611683 /nfs/dbraw/zinc/61/16/83/1136611683.db2.gz SKPYTURLPSFHNE-SECBINFHSA-N 1 1 341.358 3.971 20 10 EHCDMO CC(=O)Nc1cccc2c1CCN(Cc1cc(Cl)c(F)cc1O)C2 ZINC000816494492 1136724907 /nfs/dbraw/zinc/72/49/07/1136724907.db2.gz NPVZGSJVXLBMMT-UHFFFAOYSA-N 1 1 348.805 3.701 20 10 EHCDMO C[N@@H+](Cc1ccc2ccccc2c1O)[C@@H]1CCN(c2ccccc2)C1=O ZINC000816504446 1136728299 /nfs/dbraw/zinc/72/82/99/1136728299.db2.gz NJLCBPQIICWZJF-HXUWFJFHSA-N 1 1 346.430 3.783 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCN1CC(F)F ZINC000816516656 1136730074 /nfs/dbraw/zinc/73/00/74/1136730074.db2.gz MHMGXMPSAIONHP-INIZCTEOSA-N 1 1 334.410 3.707 20 10 EHCDMO CCn1c(C[NH2+]Cc2cc(Cl)c(F)cc2O)nc2ccccc21 ZINC000816569809 1136738218 /nfs/dbraw/zinc/73/82/18/1136738218.db2.gz XLSBSPDZPIZMLN-UHFFFAOYSA-N 1 1 333.794 3.844 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000816616664 1136742335 /nfs/dbraw/zinc/74/23/35/1136742335.db2.gz CAURVCYIMWPRIY-LBPRGKRZSA-N 1 1 338.785 3.692 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000817281708 1136791291 /nfs/dbraw/zinc/79/12/91/1136791291.db2.gz NTGUQESQUBBGRE-LLVKDONJSA-N 1 1 333.325 3.898 20 10 EHCDMO Cc1nc(C(C)C)sc1[C@H](C)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939576 1136847167 /nfs/dbraw/zinc/84/71/67/1136847167.db2.gz CQTUESWRJQTUGL-GUYCJALGSA-N 1 1 346.544 3.992 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000817939239 1136848291 /nfs/dbraw/zinc/84/82/91/1136848291.db2.gz APOJVDIZNMQSKS-VQTJNVASSA-N 1 1 327.447 3.632 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+][C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000817943537 1136849485 /nfs/dbraw/zinc/84/94/85/1136849485.db2.gz VEGANQWJEVKXPV-ROUUACIJSA-N 1 1 327.472 3.649 20 10 EHCDMO CC[C@@H]([NH2+]CCC[NH2+]C(C)C)c1cc(Br)ccc1[O-] ZINC000817953614 1136851192 /nfs/dbraw/zinc/85/11/92/1136851192.db2.gz PMHMTVVNIWBFGM-CQSZACIVSA-N 1 1 329.282 3.584 20 10 EHCDMO Cc1cc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c(C)n1-c1ccccn1 ZINC000818050474 1136860985 /nfs/dbraw/zinc/86/09/85/1136860985.db2.gz JQRRHLQTQNLIGB-UHFFFAOYSA-N 1 1 345.406 3.698 20 10 EHCDMO COc1cc(C)cc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1O ZINC000818287842 1136869702 /nfs/dbraw/zinc/86/97/02/1136869702.db2.gz STVDYFMRLRSDSY-MRXNPFEDSA-N 1 1 347.480 3.952 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000818357104 1136875620 /nfs/dbraw/zinc/87/56/20/1136875620.db2.gz VPLHUDZFASIJQR-BDAKNGLRSA-N 1 1 340.832 3.701 20 10 EHCDMO COC1CCN(c2ccc(C[N@@H+]3Cc4ccc(O)cc4C3)cc2)CC1 ZINC000859477600 1137016679 /nfs/dbraw/zinc/01/66/79/1137016679.db2.gz GKPCMJJFOHHHHY-UHFFFAOYSA-N 1 1 338.451 3.523 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3Cc4ccc(O)cc4C3)cc2)CC1 ZINC000859477600 1137016680 /nfs/dbraw/zinc/01/66/80/1137016680.db2.gz GKPCMJJFOHHHHY-UHFFFAOYSA-N 1 1 338.451 3.523 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cs1 ZINC000772855825 1137045768 /nfs/dbraw/zinc/04/57/68/1137045768.db2.gz BRPSKGBNZOVMRL-CYBMUJFWSA-N 1 1 333.526 3.856 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cc(F)cc(Cl)c1 ZINC000777217340 1137119220 /nfs/dbraw/zinc/11/92/20/1137119220.db2.gz MQECLWVXDVBUHQ-UHFFFAOYSA-N 1 1 348.849 3.948 20 10 EHCDMO CC[C@]1(O)CC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000824214873 1137128378 /nfs/dbraw/zinc/12/83/78/1137128378.db2.gz IKCHPUOCHYQHMY-IBGZPJMESA-N 1 1 330.497 3.731 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(O)cccc1Br ZINC000862351390 1137139479 /nfs/dbraw/zinc/13/94/79/1137139479.db2.gz OKHWLBDFRVOBGL-PSASIEDQSA-N 1 1 338.167 3.927 20 10 EHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Br)[C@@H]1[C@H]1CCCO1 ZINC000862371905 1137141098 /nfs/dbraw/zinc/14/10/98/1137141098.db2.gz NSHMPTKDVDKKNU-HUUCEWRRSA-N 1 1 340.261 3.544 20 10 EHCDMO c1cn2c(n1)[C@H]([NH2+]Cc1ccc3c(c1)CCN3Cc1ccccc1)CC2 ZINC000824526727 1137141399 /nfs/dbraw/zinc/14/13/99/1137141399.db2.gz PEGFYTFXFVJPRZ-HXUWFJFHSA-N 1 1 344.462 3.680 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC=C(c3cn(C(C)C)nn3)CC2)c1O ZINC000824737503 1137148664 /nfs/dbraw/zinc/14/86/64/1137148664.db2.gz BHMXCXLFTACISI-UHFFFAOYSA-N 1 1 326.444 3.552 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821295 1137153769 /nfs/dbraw/zinc/15/37/69/1137153769.db2.gz XWDHQZHVWVDOCE-HNNXBMFYSA-N 1 1 342.395 3.689 20 10 EHCDMO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000825006167 1137160062 /nfs/dbraw/zinc/16/00/62/1137160062.db2.gz YWMPJXUMLFUVTC-LBPRGKRZSA-N 1 1 340.393 3.839 20 10 EHCDMO CCc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794702896 1137236208 /nfs/dbraw/zinc/23/62/08/1137236208.db2.gz KPCMZYXFKOSXTP-YCRPNKLZSA-N 1 1 347.499 3.632 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@](C)(c3cccc(F)c3)C2)cc1OC ZINC000844718073 1137247630 /nfs/dbraw/zinc/24/76/30/1137247630.db2.gz LDZAIDPGLPFBIZ-FQEVSTJZSA-N 1 1 345.414 3.712 20 10 EHCDMO CC[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccc(C)cc1O ZINC000794815708 1137263797 /nfs/dbraw/zinc/26/37/97/1137263797.db2.gz KYBCGRXJXNMIDI-MRXNPFEDSA-N 1 1 340.402 3.866 20 10 EHCDMO CCOCC1CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144306899 1137270823 /nfs/dbraw/zinc/27/08/23/1137270823.db2.gz WBXPIZKSCBLILJ-UHFFFAOYSA-N 1 1 346.240 3.542 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2occc2Br)c1 ZINC000845973248 1137322648 /nfs/dbraw/zinc/32/26/48/1137322648.db2.gz WMUNOKJTIGAACF-VIFPVBQESA-N 1 1 326.190 3.607 20 10 EHCDMO CN(C)c1ccc(/C=C\CN2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066939 1137332566 /nfs/dbraw/zinc/33/25/66/1137332566.db2.gz JPZODFYKXWINLP-GNQFWKNRSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@@H+]2CCN(C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066939 1137332568 /nfs/dbraw/zinc/33/25/68/1137332568.db2.gz JPZODFYKXWINLP-GNQFWKNRSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCN(C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066939 1137332570 /nfs/dbraw/zinc/33/25/70/1137332570.db2.gz JPZODFYKXWINLP-GNQFWKNRSA-N 1 1 349.522 3.625 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000866407882 1137352444 /nfs/dbraw/zinc/35/24/44/1137352444.db2.gz YOVSKOIWVGBGLA-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1cc(NCc2cc3ccccc3cc2O)c[nH+]c1N1CCOCC1 ZINC001171404986 1137472671 /nfs/dbraw/zinc/47/26/71/1137472671.db2.gz OCBKPRDYSOEBLZ-UHFFFAOYSA-N 1 1 349.434 3.698 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]4CSC[C@@H]4C3)c2c1 ZINC000872721605 1137583111 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C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1c(O)cccc1F ZINC000886505020 1138085397 /nfs/dbraw/zinc/08/53/97/1138085397.db2.gz FCZFRYFXUAWMMW-NWDGAFQWSA-N 1 1 328.387 3.828 20 10 EHCDMO Cc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc(N2CCCC2)n1 ZINC000886612702 1138102129 /nfs/dbraw/zinc/10/21/29/1138102129.db2.gz RYKJEIHPLRETLF-AWEZNQCLSA-N 1 1 329.419 3.686 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000091891464 1138222732 /nfs/dbraw/zinc/22/27/32/1138222732.db2.gz VRGPISQPEZGYLJ-YJBOKZPZSA-N 1 1 347.480 3.941 20 10 EHCDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093888734 1138242954 /nfs/dbraw/zinc/24/29/54/1138242954.db2.gz LDCSIGRMXJRHKM-NPMXOYFQSA-N 1 1 330.497 3.683 20 10 EHCDMO COCc1cccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000179236251 1139744953 /nfs/dbraw/zinc/74/49/53/1139744953.db2.gz IQLBHNAZMWWBBA-FQEVSTJZSA-N 1 1 341.451 3.720 20 10 EHCDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179575503 1139766574 /nfs/dbraw/zinc/76/65/74/1139766574.db2.gz DMLWOFYAPIJWCQ-LSDHHAIUSA-N 1 1 334.460 3.517 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CC[C@@H]1CCOC1=O)Cc1ccccc1O ZINC000179643719 1139771723 /nfs/dbraw/zinc/77/17/23/1139771723.db2.gz IYIRCBHCKDBWCC-FUHWJXTLSA-N 1 1 339.435 3.909 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CC[C@@H]1CCOC1=O)Cc1ccccc1O ZINC000179643734 1139772000 /nfs/dbraw/zinc/77/20/00/1139772000.db2.gz IYIRCBHCKDBWCC-SJLPKXTDSA-N 1 1 339.435 3.909 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccc(SC)c(OC)c2)c1 ZINC000179919833 1139792345 /nfs/dbraw/zinc/79/23/45/1139792345.db2.gz BIRPKCSNLCCWTF-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1O ZINC000180798539 1139863418 /nfs/dbraw/zinc/86/34/18/1139863418.db2.gz DJBRXZSLANBZSD-CQSZACIVSA-N 1 1 339.361 3.753 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@@H](C)c1cnccn1 ZINC000184591003 1140110353 /nfs/dbraw/zinc/11/03/53/1140110353.db2.gz DWPIYDSTPNAGEQ-NSHDSACASA-N 1 1 336.233 3.528 20 10 EHCDMO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185050935 1140133716 /nfs/dbraw/zinc/13/37/16/1140133716.db2.gz UZQKCPHHMJBRBE-ZIAGYGMSSA-N 1 1 344.430 3.910 20 10 EHCDMO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000185077458 1140135342 /nfs/dbraw/zinc/13/53/42/1140135342.db2.gz WNKKDQWFNBDGTE-ZDUSSCGKSA-N 1 1 336.451 3.609 20 10 EHCDMO COc1ccccc1N1CC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2O)C1 ZINC000185269302 1140142691 /nfs/dbraw/zinc/14/26/91/1140142691.db2.gz PWOPPGBRNZQFRZ-HUUCEWRRSA-N 1 1 344.430 3.717 20 10 EHCDMO CSC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000188176591 1140285886 /nfs/dbraw/zinc/28/58/86/1140285886.db2.gz UQGZISATCXIVRM-QAPCUYQASA-N 1 1 331.481 3.679 20 10 EHCDMO C[C@@H]([NH2+]CCCOC1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193007058 1140559266 /nfs/dbraw/zinc/55/92/66/1140559266.db2.gz RFSZIGTXXIFTOH-LLVKDONJSA-N 1 1 348.270 3.935 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1OC ZINC000271056818 1141301043 /nfs/dbraw/zinc/30/10/43/1141301043.db2.gz AQUAUABNDYSYGM-CQSZACIVSA-N 1 1 331.387 3.538 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)[C@@H](C)CO1 ZINC001204432517 1015566289 /nfs/dbraw/zinc/56/62/89/1015566289.db2.gz TWNNAJFRJWPXPJ-JKSUJKDBSA-N 1 1 330.497 3.994 20 10 EHCDMO C[C@@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccccc1O ZINC000183403572 1032167823 /nfs/dbraw/zinc/16/78/23/1032167823.db2.gz OEFLISTXGSYYBD-ACJLOTCBSA-N 1 1 325.387 3.705 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000738147822 1032238786 /nfs/dbraw/zinc/23/87/86/1032238786.db2.gz BTOSRZACWWSBCE-MRXNPFEDSA-N 1 1 347.499 3.837 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H](O)c2ccc(F)cc2)C2CC2)cc1 ZINC000134066109 1018070349 /nfs/dbraw/zinc/07/03/49/1018070349.db2.gz RODXWYMMLNZGKA-FQEVSTJZSA-N 1 1 328.431 3.590 20 10 EHCDMO COc1cc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(O)cc1C ZINC000160406112 1018735449 /nfs/dbraw/zinc/73/54/49/1018735449.db2.gz JDAUUORGPPDJIS-UGSOOPFHSA-N 1 1 333.453 3.733 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1O ZINC000091891325 1032855017 /nfs/dbraw/zinc/85/50/17/1032855017.db2.gz HBFPLGFZGCHSEI-CABCVRRESA-N 1 1 333.453 3.550 20 10 EHCDMO CO[C@]1(C)CCC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000280333521 1020314035 /nfs/dbraw/zinc/31/40/35/1020314035.db2.gz HWESFJDGIVPXPO-QGZVFWFLSA-N 1 1 325.836 3.639 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000280333521 1020314043 /nfs/dbraw/zinc/31/40/43/1020314043.db2.gz HWESFJDGIVPXPO-QGZVFWFLSA-N 1 1 325.836 3.639 20 10 EHCDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2Cc2nc(C3CC3)no2)C1 ZINC000345882245 1020571188 /nfs/dbraw/zinc/57/11/88/1020571188.db2.gz MDICPBHRJDEWBQ-UHFFFAOYSA-N 1 1 336.439 3.717 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2[O-])C[C@H]1C ZINC000894902753 1022059488 /nfs/dbraw/zinc/05/94/88/1022059488.db2.gz LAGDUQLKZCKWPI-RNCFNFMXSA-N 1 1 348.668 3.665 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCCC[C@H]2c2nccn2CC)c1O ZINC000281040403 1024587028 /nfs/dbraw/zinc/58/70/28/1024587028.db2.gz GTZMCLOMIBXFQP-INIZCTEOSA-N 1 1 329.444 3.735 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCC[C@H]2c2nccn2CC)c1O ZINC000281040403 1024587033 /nfs/dbraw/zinc/58/70/33/1024587033.db2.gz GTZMCLOMIBXFQP-INIZCTEOSA-N 1 1 329.444 3.735 20 10 EHCDMO C[C@H]([NH2+]CC1([S@@](C)=O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000281145887 1024672460 /nfs/dbraw/zinc/67/24/60/1024672460.db2.gz UWSMPKKDAJJGLR-GWNMQOMSSA-N 1 1 336.284 3.651 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)c2cncs2)c1 ZINC000897932742 1033233325 /nfs/dbraw/zinc/23/33/25/1033233325.db2.gz OYWTYPUOMTUTNY-SECBINFHSA-N 1 1 327.247 3.770 20 10 EHCDMO CCC[N@@H+](CC(=O)N1c2ccccc2C[C@H]1C)Cc1ccccc1O ZINC000727831268 1025220991 /nfs/dbraw/zinc/22/09/91/1025220991.db2.gz SAWVJIJQRQLLHA-MRXNPFEDSA-N 1 1 338.451 3.582 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1O ZINC000896532089 1025546385 /nfs/dbraw/zinc/54/63/85/1025546385.db2.gz SSYOWQMYKVMBRN-AWEZNQCLSA-N 1 1 332.469 3.702 20 10 EHCDMO CCOc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1OC(=O)CC ZINC000896639800 1025795369 /nfs/dbraw/zinc/79/53/69/1025795369.db2.gz XTHLIMSZPLCICP-UHFFFAOYSA-N 1 1 347.386 3.535 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(N(C)C)cc1 ZINC000284386934 1029106061 /nfs/dbraw/zinc/10/60/61/1029106061.db2.gz OXTDGRWUJQCFAT-QGZVFWFLSA-N 1 1 334.467 3.848 20 10 EHCDMO CSc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000161824751 1030432686 /nfs/dbraw/zinc/43/26/86/1030432686.db2.gz ZLIXSEUKAPOCHU-UHFFFAOYSA-N 1 1 342.508 3.877 20 10 EHCDMO CCCN(CCC)C(=O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000759693720 1030930071 /nfs/dbraw/zinc/93/00/71/1030930071.db2.gz JCQGIZWCKMQIKD-UHFFFAOYSA-N 1 1 345.531 3.757 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@@H](C)Sc2ccccc2)ccc1[N+](=O)[O-] ZINC000278554502 1031360735 /nfs/dbraw/zinc/36/07/35/1031360735.db2.gz ZQPVBRWIRJNYTA-GFCCVEGCSA-N 1 1 348.424 3.579 20 10 EHCDMO Cc1cn(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)c(C)[nH+]1 ZINC000760179561 1031879162 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EHCDMO C[C@H]([NH2+]Cc1ccc(CO)c(F)c1)c1cccc(C(F)(F)F)c1O ZINC000788686012 1134157218 /nfs/dbraw/zinc/15/72/18/1134157218.db2.gz LWXLIUUIAJYDNG-JTQLQIEISA-N 1 1 343.320 3.893 20 10 EHCDMO COc1c(O)c(C[NH2+]CC[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775004020 1134198283 /nfs/dbraw/zinc/19/82/83/1134198283.db2.gz ASTLACJAXWVOJD-CYBMUJFWSA-N 1 1 330.384 3.592 20 10 EHCDMO CC(C)n1ncnc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000789295813 1134249990 /nfs/dbraw/zinc/24/99/90/1134249990.db2.gz YTUCPBINPBOUGZ-UHFFFAOYSA-N 1 1 328.460 3.900 20 10 EHCDMO COc1ccnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1OC ZINC000789322004 1134255787 /nfs/dbraw/zinc/25/57/87/1134255787.db2.gz CZHFRMHCBGDMCU-UHFFFAOYSA-N 1 1 342.439 3.749 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1CC[C@@H](C)O1 ZINC000789327842 1134257646 /nfs/dbraw/zinc/25/76/46/1134257646.db2.gz QSMMZHNSGQWYNL-BXUZGUMPSA-N 1 1 328.250 3.544 20 10 EHCDMO CC(C)N1CCC[C@@H]([N@@H+](Cc2ccccc2O)C2CCCC2)C1=O ZINC000790288153 1134390200 /nfs/dbraw/zinc/39/02/00/1134390200.db2.gz PHLAYZBLCBVYHZ-GOSISDBHSA-N 1 1 330.472 3.536 20 10 EHCDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(Br)cc(C)c1O ZINC000775175167 1134475618 /nfs/dbraw/zinc/47/56/18/1134475618.db2.gz GKXACJRSRDYMFZ-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO CC[N@@H+](Cc1ccnn1-c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000790900736 1134481047 /nfs/dbraw/zinc/48/10/47/1134481047.db2.gz GJHXCTKGBCSXGY-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1nc2c(s1)CCCC2 ZINC000790965757 1134486456 /nfs/dbraw/zinc/48/64/56/1134486456.db2.gz ZMJVRBGCNYFCSZ-UHFFFAOYSA-N 1 1 340.851 3.852 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000790970737 1134487724 /nfs/dbraw/zinc/48/77/24/1134487724.db2.gz DQIKFFXEBBPDJV-CQSZACIVSA-N 1 1 330.186 3.661 20 10 EHCDMO CC[C@H]1C[C@H]([N@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)CCO1 ZINC001170227991 1134723283 /nfs/dbraw/zinc/72/32/83/1134723283.db2.gz RIBICLMPUSDLMC-CABCVRRESA-N 1 1 328.456 3.503 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c(C(F)(F)F)c1 ZINC000793608020 1134968289 /nfs/dbraw/zinc/96/82/89/1134968289.db2.gz HIVHJARDPBFIJH-DLBZAZTESA-N 1 1 342.405 3.915 20 10 EHCDMO CN(CC(=O)Nc1ccccc1Cl)Cc1cccc(Cl)c1[O-] ZINC000775641674 1135381260 /nfs/dbraw/zinc/38/12/60/1135381260.db2.gz CZXLHLKAHDVJJW-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO CCCCCCNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000775668377 1135453467 /nfs/dbraw/zinc/45/34/67/1135453467.db2.gz YELMNPCHHARGHB-SFHVURJKSA-N 1 1 332.488 3.609 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735223 1135590367 /nfs/dbraw/zinc/59/03/67/1135590367.db2.gz NZURKSNTGMFTOJ-PGRDOPGGSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735223 1135590372 /nfs/dbraw/zinc/59/03/72/1135590372.db2.gz NZURKSNTGMFTOJ-PGRDOPGGSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735223 1135590376 /nfs/dbraw/zinc/59/03/76/1135590376.db2.gz NZURKSNTGMFTOJ-PGRDOPGGSA-N 1 1 335.495 3.631 20 10 EHCDMO CCN(C)c1ccc(C[N@H+](C)CC(=O)NCCC2=CCCCC2)cc1 ZINC001198072112 1135773464 /nfs/dbraw/zinc/77/34/64/1135773464.db2.gz QACNUIDCUNNYJD-UHFFFAOYSA-N 1 1 343.515 3.581 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)CC(=O)NCCC2=CCCCC2)cc1 ZINC001198072112 1135773467 /nfs/dbraw/zinc/77/34/67/1135773467.db2.gz QACNUIDCUNNYJD-UHFFFAOYSA-N 1 1 343.515 3.581 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2CCNC(=O)OC(C)(C)C)c1O ZINC000809723814 1135879062 /nfs/dbraw/zinc/87/90/62/1135879062.db2.gz PROCQNKFOXCXJC-QGZVFWFLSA-N 1 1 348.487 3.970 20 10 EHCDMO CC[N@H+](Cc1ccncc1)Cc1cc(C)cc(Br)c1O ZINC000809726449 1135879470 /nfs/dbraw/zinc/87/94/70/1135879470.db2.gz KMGGRKOTBJEASM-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(C)cc(Br)c1O ZINC000809726449 1135879472 /nfs/dbraw/zinc/87/94/72/1135879472.db2.gz KMGGRKOTBJEASM-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCCN(c3ccc(F)cc3)CC2)cc1 ZINC001203936771 1135911625 /nfs/dbraw/zinc/91/16/25/1135911625.db2.gz NDTPBNSVHOHVTI-UHFFFAOYSA-N 1 1 327.447 3.604 20 10 EHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000776012568 1135919935 /nfs/dbraw/zinc/91/99/35/1135919935.db2.gz HQUDLTAWDZENQT-PBHICJAKSA-N 1 1 342.405 3.686 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](n3cc(C)cn3)C2)cc1F ZINC000811518144 1136098269 /nfs/dbraw/zinc/09/82/69/1136098269.db2.gz HWHIWIPPHQRTTD-KRWDZBQOSA-N 1 1 330.451 3.624 20 10 EHCDMO FC(F)(F)CC[NH+]1CCN(c2ccc(OC(F)(F)F)cc2)CC1 ZINC001202368242 1136134724 /nfs/dbraw/zinc/13/47/24/1136134724.db2.gz JVGDCPGRRKMQMT-UHFFFAOYSA-N 1 1 342.283 3.660 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000811782327 1136134945 /nfs/dbraw/zinc/13/49/45/1136134945.db2.gz DCOSQTFWPFOFCK-QFIPXVFZSA-N 1 1 346.430 3.910 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1O ZINC000814170569 1136414962 /nfs/dbraw/zinc/41/49/62/1136414962.db2.gz ZBJQQJJHTWCGIW-GXTWGEPZSA-N 1 1 346.215 3.940 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074188 1136547090 /nfs/dbraw/zinc/54/70/90/1136547090.db2.gz LDUONBXRLRHGPX-NQIIRXRSSA-N 1 1 327.516 3.510 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074188 1136547093 /nfs/dbraw/zinc/54/70/93/1136547093.db2.gz LDUONBXRLRHGPX-NQIIRXRSSA-N 1 1 327.516 3.510 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815554217 1136609759 /nfs/dbraw/zinc/60/97/59/1136609759.db2.gz VCDJSTSXDKOHSM-BXUZGUMPSA-N 1 1 342.361 3.958 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815554392 1136609904 /nfs/dbraw/zinc/60/99/04/1136609904.db2.gz YQDVMLZPIKLGCE-IAQYHMDHSA-N 1 1 325.330 3.795 20 10 EHCDMO C[C@H]([NH2+]CCN1CCCC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815559862 1136610830 /nfs/dbraw/zinc/61/08/30/1136610830.db2.gz RPOBBEXVISLMEU-STQMWFEESA-N 1 1 330.394 3.936 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000776767497 1136656312 /nfs/dbraw/zinc/65/63/12/1136656312.db2.gz SQBNGDBHHCVKPK-NRFANRHFSA-N 1 1 337.394 3.778 20 10 EHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000748049498 1136682938 /nfs/dbraw/zinc/68/29/38/1136682938.db2.gz DJQVJCWHVDVUAF-OAHLLOKOSA-N 1 1 325.449 3.842 20 10 EHCDMO COc1cc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)cc(OC)c1 ZINC000816489058 1136724287 /nfs/dbraw/zinc/72/42/87/1136724287.db2.gz KSVXFRUPXMAEGM-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc(OC)c1 ZINC000816489058 1136724290 /nfs/dbraw/zinc/72/42/90/1136724290.db2.gz KSVXFRUPXMAEGM-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@@H](C(F)(F)F)O1 ZINC000816515792 1136729842 /nfs/dbraw/zinc/72/98/42/1136729842.db2.gz KZDSWEDSASHTOF-NHYWBVRUSA-N 1 1 325.330 3.697 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H](C(F)(F)F)O1 ZINC000816515792 1136729845 /nfs/dbraw/zinc/72/98/45/1136729845.db2.gz KZDSWEDSASHTOF-NHYWBVRUSA-N 1 1 325.330 3.697 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(F)cc1 ZINC000816536478 1136731388 /nfs/dbraw/zinc/73/13/88/1136731388.db2.gz YPZDOZLZVYVFCF-INIZCTEOSA-N 1 1 340.801 3.716 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000816560005 1136736648 /nfs/dbraw/zinc/73/66/48/1136736648.db2.gz BNKSMFSPLSMIAM-XBFCOCLRSA-N 1 1 333.881 3.654 20 10 EHCDMO CC(C)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1nnc2ccccn21 ZINC000816562590 1136737650 /nfs/dbraw/zinc/73/76/50/1136737650.db2.gz RBIBZVDAQZVGFO-MRXNPFEDSA-N 1 1 348.809 3.714 20 10 EHCDMO OC[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CC[C@H]1C(F)(F)F ZINC000816607665 1136740963 /nfs/dbraw/zinc/74/09/63/1136740963.db2.gz BHORWTOLGBERIK-GOEBONIOSA-N 1 1 339.357 3.538 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000817938495 1136847525 /nfs/dbraw/zinc/84/75/25/1136847525.db2.gz LPQLIJMHOVVWJZ-RBUKOAKNSA-N 1 1 333.426 3.772 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000817938496 1136847551 /nfs/dbraw/zinc/84/75/51/1136847551.db2.gz LPQLIJMHOVVWJZ-RTBURBONSA-N 1 1 333.426 3.772 20 10 EHCDMO CCOc1ccccc1[C@H](C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817938596 1136847797 /nfs/dbraw/zinc/84/77/97/1136847797.db2.gz OABPWQKOFVCOOZ-HNAYVOBHSA-N 1 1 327.472 3.502 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000817938493 1136847833 /nfs/dbraw/zinc/84/78/33/1136847833.db2.gz LPQLIJMHOVVWJZ-MOPGFXCFSA-N 1 1 333.426 3.772 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000817938746 1136847872 /nfs/dbraw/zinc/84/78/72/1136847872.db2.gz RFHIWOCSRTUEIC-ROUUACIJSA-N 1 1 345.487 3.718 20 10 EHCDMO CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817966456 1136853379 /nfs/dbraw/zinc/85/33/79/1136853379.db2.gz OGKFQMAFQVVSPA-HOCLYGCPSA-N 1 1 341.293 3.585 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2c3ccccc3CN(C)C2=O)cc1 ZINC000857874402 1136916596 /nfs/dbraw/zinc/91/65/96/1136916596.db2.gz MAUHVKGAUVZRIQ-YWZLYKJASA-N 1 1 337.467 3.507 20 10 EHCDMO CCCc1nc(C)c(C[NH2+]Cc2c(O)cccc2Br)o1 ZINC000858169207 1136946174 /nfs/dbraw/zinc/94/61/74/1136946174.db2.gz ZAMRHHZRPPNEHL-UHFFFAOYSA-N 1 1 339.233 3.693 20 10 EHCDMO O=[N+]([O-])c1cnc(S[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000819936155 1136968222 /nfs/dbraw/zinc/96/82/22/1136968222.db2.gz WYFZXAOVPWQRLU-ZDUSSCGKSA-N 1 1 335.454 3.808 20 10 EHCDMO O=[N+]([O-])c1cnc(S[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000819936155 1136968224 /nfs/dbraw/zinc/96/82/24/1136968224.db2.gz WYFZXAOVPWQRLU-ZDUSSCGKSA-N 1 1 335.454 3.808 20 10 EHCDMO COC(=O)C1=CC[C@@H]([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858471848 1136971172 /nfs/dbraw/zinc/97/11/72/1136971172.db2.gz FLHLXORWIYDGRI-PSASIEDQSA-N 1 1 330.211 3.611 20 10 EHCDMO CCOC(=O)C1=CC[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000858506099 1136974651 /nfs/dbraw/zinc/97/46/51/1136974651.db2.gz CUZGKLLKQMNHGK-PWSUYJOCSA-N 1 1 343.345 3.714 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2C[C@H](O)C(C)(C)C2)cc1 ZINC000824307420 1137131665 /nfs/dbraw/zinc/13/16/65/1137131665.db2.gz JDTXXHKDVWFUJR-SFHVURJKSA-N 1 1 330.497 3.587 20 10 EHCDMO CC[N@@H+](CCc1ccccn1)Cc1c(O)cccc1Br ZINC000862232279 1137133548 /nfs/dbraw/zinc/13/35/48/1137133548.db2.gz VNRHBPDTXOXJBO-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000862398600 1137142753 /nfs/dbraw/zinc/14/27/53/1137142753.db2.gz MTBOOEFKFWCCSE-WFASDCNBSA-N 1 1 340.261 3.546 20 10 EHCDMO CC(C)(C[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1)C(N)=O ZINC000824608239 1137144909 /nfs/dbraw/zinc/14/49/09/1137144909.db2.gz DOMKLPFECQLAKZ-OAHLLOKOSA-N 1 1 340.467 3.659 20 10 EHCDMO C[C@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824645188 1137146059 /nfs/dbraw/zinc/14/60/59/1137146059.db2.gz ZQENUHVHMWCOAA-UWVGGRQHSA-N 1 1 346.830 3.576 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@]3(CC(=O)c4ccccc4O3)C2)c1O ZINC000862481553 1137146207 /nfs/dbraw/zinc/14/62/07/1137146207.db2.gz IOIVPTUAFTUCTJ-OAQYLSRUSA-N 1 1 337.419 3.701 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cn(C2CCC2)nn1)C1CCCC1 ZINC000824777180 1137151457 /nfs/dbraw/zinc/15/14/57/1137151457.db2.gz LPBVALJUWPLUJY-UHFFFAOYSA-N 1 1 326.444 3.654 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1O ZINC000825215787 1137169229 /nfs/dbraw/zinc/16/92/29/1137169229.db2.gz WCIDYQAWYLPITA-MRXNPFEDSA-N 1 1 327.877 3.773 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc3ncccc3c2)c1 ZINC000794828185 1137267640 /nfs/dbraw/zinc/26/76/40/1137267640.db2.gz LNGXECWOOYIQST-ZDUSSCGKSA-N 1 1 336.391 3.578 20 10 EHCDMO Fc1ccccc1C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000120565145 1137286301 /nfs/dbraw/zinc/28/63/01/1137286301.db2.gz HYQMFTMZFVCKKW-UHFFFAOYSA-N 1 1 340.442 3.827 20 10 EHCDMO CN(C)c1ccc(/C=C/CN2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066940 1137332596 /nfs/dbraw/zinc/33/25/96/1137332596.db2.gz JPZODFYKXWINLP-KXOMFBTKSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+]2CCN(C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066940 1137332598 /nfs/dbraw/zinc/33/25/98/1137332598.db2.gz JPZODFYKXWINLP-KXOMFBTKSA-N 1 1 349.522 3.625 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCN(C)C[C@@H]2Cc2ccccc2)cc1 ZINC000846066940 1137332599 /nfs/dbraw/zinc/33/25/99/1137332599.db2.gz JPZODFYKXWINLP-KXOMFBTKSA-N 1 1 349.522 3.625 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000846167579 1137337283 /nfs/dbraw/zinc/33/72/83/1137337283.db2.gz KXYXHUFTZHJKAM-WMZOPIPTSA-N 1 1 340.467 3.574 20 10 EHCDMO Cc1cc(C(=O)N[C@@H]2CCC[N@H+](C)C2)c(C)n1-c1ccc(Cl)cc1 ZINC001144808420 1137351471 /nfs/dbraw/zinc/35/14/71/1137351471.db2.gz VHVAIEQQRDQHFS-MRXNPFEDSA-N 1 1 345.874 3.572 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000773256565 1137481769 /nfs/dbraw/zinc/48/17/69/1137481769.db2.gz COWFZTGSRSADTH-CVEARBPZSA-N 1 1 326.440 3.579 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](C[C@H]3CCOC3)C1)CCCC2 ZINC000773263056 1137482166 /nfs/dbraw/zinc/48/21/66/1137482166.db2.gz PJVDFPYPKGOOQD-DLBZAZTESA-N 1 1 329.484 3.910 20 10 EHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)n1 ZINC000872807531 1137584893 /nfs/dbraw/zinc/58/48/93/1137584893.db2.gz UBVKWDZTCXGOJZ-CQSZACIVSA-N 1 1 325.437 3.695 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000873272884 1137596013 /nfs/dbraw/zinc/59/60/13/1137596013.db2.gz WYTGIXHTEKLPIA-NHYWBVRUSA-N 1 1 341.293 3.584 20 10 EHCDMO Nc1ccc(NC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2)cc1 ZINC000876504666 1137654321 /nfs/dbraw/zinc/65/43/21/1137654321.db2.gz SJPDWBNJLMNXEL-QGZVFWFLSA-N 1 1 329.831 3.525 20 10 EHCDMO Nc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2)cc1 ZINC000876504666 1137654322 /nfs/dbraw/zinc/65/43/22/1137654322.db2.gz SJPDWBNJLMNXEL-QGZVFWFLSA-N 1 1 329.831 3.525 20 10 EHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)c1ccccc1 ZINC000876682572 1137658910 /nfs/dbraw/zinc/65/89/10/1137658910.db2.gz JYSFUZJPNHIVSY-GOSISDBHSA-N 1 1 338.495 3.883 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CC2(CO1)CCOCC2)C1CCCC1 ZINC000878104410 1137702570 /nfs/dbraw/zinc/70/25/70/1137702570.db2.gz VKIHSVCQGNFLMJ-IBGZPJMESA-N 1 1 345.483 3.723 20 10 EHCDMO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000883082098 1137843860 /nfs/dbraw/zinc/84/38/60/1137843860.db2.gz WTTZXVZEULXGTG-UHFFFAOYSA-N 1 1 341.398 3.661 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H](O)c1ccc(C(F)(F)F)cc1 ZINC000883119927 1137845349 /nfs/dbraw/zinc/84/53/49/1137845349.db2.gz NVHYQKUHHBOGNW-AWEZNQCLSA-N 1 1 347.283 3.512 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1c(O)cccc1F ZINC000886553625 1138095591 /nfs/dbraw/zinc/09/55/91/1138095591.db2.gz RYDFCNIJAIGWSQ-CHWSQXEVSA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1c(O)cccc1F ZINC000886614086 1138102152 /nfs/dbraw/zinc/10/21/52/1138102152.db2.gz MZKMLCOPIAJLRI-SNVBAGLBSA-N 1 1 328.309 3.838 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774203 1138138236 /nfs/dbraw/zinc/13/82/36/1138138236.db2.gz JTAXCANGDMVUBG-LIRRHRJNSA-N 1 1 347.455 3.569 20 10 EHCDMO CCCOc1ccc(C[N@@H+]2CCO[C@@H](c3nc(C)cs3)C2)c(O)c1 ZINC000092790205 1138232094 /nfs/dbraw/zinc/23/20/94/1138232094.db2.gz CSZPLPBZDMYTTF-QGZVFWFLSA-N 1 1 348.468 3.519 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCO[C@@H](c3nc(C)cs3)C2)c(O)c1 ZINC000092790205 1138232095 /nfs/dbraw/zinc/23/20/95/1138232095.db2.gz CSZPLPBZDMYTTF-QGZVFWFLSA-N 1 1 348.468 3.519 20 10 EHCDMO COc1ccc(Cl)cc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000264596424 1138570789 /nfs/dbraw/zinc/57/07/89/1138570789.db2.gz IGXXQBUGEKUJLZ-LBPRGKRZSA-N 1 1 348.830 3.513 20 10 EHCDMO C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385189 1139087925 /nfs/dbraw/zinc/08/79/25/1139087925.db2.gz YEIFFRBBNYANTO-IAGOWNOFSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385189 1139087932 /nfs/dbraw/zinc/08/79/32/1139087932.db2.gz YEIFFRBBNYANTO-IAGOWNOFSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385189 1139087943 /nfs/dbraw/zinc/08/79/43/1139087943.db2.gz YEIFFRBBNYANTO-IAGOWNOFSA-N 1 1 345.506 3.951 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(OC)c(OC)c2)c1 ZINC000179660494 1139772161 /nfs/dbraw/zinc/77/21/61/1139772161.db2.gz UUPLHTILJUFVFF-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C(F)(F)F)cs2)c1 ZINC000182456804 1139973430 /nfs/dbraw/zinc/97/34/30/1139973430.db2.gz JLPXTMPJQJQELP-QMMMGPOBSA-N 1 1 332.347 3.727 20 10 EHCDMO C[C@H]([NH2+]Cc1ccccc1CN1CCCC1=O)c1ccc(F)cc1O ZINC000184987890 1140129757 /nfs/dbraw/zinc/12/97/57/1140129757.db2.gz NHNRSBWZJWVQBO-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1CN1CCCC1=O)c1ccc(F)cc1O ZINC000184987912 1140130015 /nfs/dbraw/zinc/13/00/15/1140130015.db2.gz NHNRSBWZJWVQBO-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184997981 1140130401 /nfs/dbraw/zinc/13/04/01/1140130401.db2.gz HISYGRXWWTZMRS-GHMZBOCLSA-N 1 1 329.271 3.834 20 10 EHCDMO COC(=O)CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185999066 1140181674 /nfs/dbraw/zinc/18/16/74/1140181674.db2.gz JAHSYKQTCJGOFB-DYVFJYSZSA-N 1 1 331.387 3.876 20 10 EHCDMO Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192793871 1140551441 /nfs/dbraw/zinc/55/14/41/1140551441.db2.gz DALQXBXPLSFNPM-MRVPVSSYSA-N 1 1 328.243 3.900 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1O ZINC000271245869 1141333263 /nfs/dbraw/zinc/33/32/63/1141333263.db2.gz HBFPLGFZGCHSEI-HUUCEWRRSA-N 1 1 333.453 3.550 20 10 EHCDMO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)[nH]1 ZINC000271599156 1141404601 /nfs/dbraw/zinc/40/46/01/1141404601.db2.gz ZLHABCWOHBAKLH-GJZGRUSLSA-N 1 1 327.476 3.769 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Br)cc2O)s1 ZINC000274144227 1141479398 /nfs/dbraw/zinc/47/93/98/1141479398.db2.gz DQUCZEYYTGZCFN-YUMQZZPRSA-N 1 1 342.262 3.726 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc1 ZINC000160167177 1014176979 /nfs/dbraw/zinc/17/69/79/1014176979.db2.gz XVWGPPAZCWFQGT-FQEVSTJZSA-N 1 1 340.467 3.639 20 10 EHCDMO CC[C@H](c1ccncc1)[N@@H+](CC)Cc1cc(OC)c(OC)cc1O ZINC000160281977 1016877162 /nfs/dbraw/zinc/87/71/62/1016877162.db2.gz LNZZZMCRYCPNFY-MRXNPFEDSA-N 1 1 330.428 3.778 20 10 EHCDMO CCC[C@@H](C)NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000683437210 1017078865 /nfs/dbraw/zinc/07/88/65/1017078865.db2.gz HSBSIXXXUMQGPI-MRXNPFEDSA-N 1 1 341.499 3.713 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000377711248 1018241503 /nfs/dbraw/zinc/24/15/03/1018241503.db2.gz ZENWWFTYODUZKA-MRXNPFEDSA-N 1 1 343.427 3.779 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000377711248 1018241518 /nfs/dbraw/zinc/24/15/18/1018241518.db2.gz ZENWWFTYODUZKA-MRXNPFEDSA-N 1 1 343.427 3.779 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)CCCC3)C[C@@H]1n1ccnc1 ZINC000160405271 1018735716 /nfs/dbraw/zinc/73/57/16/1018735716.db2.gz ZKSSMZMMOXGCKO-BEFAXECRSA-N 1 1 325.456 3.551 20 10 EHCDMO CC[C@@H]1C[NH+](Cc2cc(Br)cc(C)c2O)C[C@@H](CC)O1 ZINC000398744125 1021150540 /nfs/dbraw/zinc/15/05/40/1021150540.db2.gz SJPCLEJGBQLZTB-HUUCEWRRSA-N 1 1 342.277 3.853 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCOc2ccccc2C1 ZINC000707141296 1021269210 /nfs/dbraw/zinc/26/92/10/1021269210.db2.gz YKRUSMLSWFQJBA-UHFFFAOYSA-N 1 1 334.213 3.549 20 10 EHCDMO CC(C)[N@@H+](CCO)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255356465 1021413688 /nfs/dbraw/zinc/41/36/88/1021413688.db2.gz TVEGMMXMJJAEJY-UHFFFAOYSA-N 1 1 340.427 3.743 20 10 EHCDMO C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1cccc(Br)c1[O-] ZINC000048794767 1022840722 /nfs/dbraw/zinc/84/07/22/1022840722.db2.gz RXLIWEUOPCUGNN-ZDUSSCGKSA-N 1 1 341.293 3.509 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2ccc(F)cc2Cl)c(O)c1OC ZINC000891993995 1024254338 /nfs/dbraw/zinc/25/43/38/1024254338.db2.gz YYIBZJNBEUTHCC-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)c(O)c1OC ZINC000891993995 1024254350 /nfs/dbraw/zinc/25/43/50/1024254350.db2.gz YYIBZJNBEUTHCC-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCCN(c2ccccc2Cl)C1=O ZINC000119529196 1024418172 /nfs/dbraw/zinc/41/81/72/1024418172.db2.gz SHQHUNXSXQTHJH-KRWDZBQOSA-N 1 1 344.842 3.673 20 10 EHCDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 ZINC000843776482 1024453967 /nfs/dbraw/zinc/45/39/67/1024453967.db2.gz OODMEYCBUZCQQA-MRXNPFEDSA-N 1 1 342.487 3.511 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC[S@@](=O)c2ccccc2)cc1 ZINC000729542900 1024596611 /nfs/dbraw/zinc/59/66/11/1024596611.db2.gz RWIMEDSXBZHKEO-XMMPIXPASA-N 1 1 344.524 3.772 20 10 EHCDMO CC[N@@H+](Cc1cn(C)nc1-c1cccnc1)Cc1ccc(N(C)C)cc1 ZINC000156839457 1024612342 /nfs/dbraw/zinc/61/23/42/1024612342.db2.gz WIFOCFPDLXHFSB-UHFFFAOYSA-N 1 1 349.482 3.570 20 10 EHCDMO CCC[N@@H+](CCCN(C)C(=O)OC(C)(C)C)Cc1ccccc1O ZINC001167521923 1025001515 /nfs/dbraw/zinc/00/15/15/1025001515.db2.gz NCLYAJOQJVAYTC-UHFFFAOYSA-N 1 1 336.476 3.861 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3nc4c(s3)CCC4)C2)c1 ZINC000896515790 1025525631 /nfs/dbraw/zinc/52/56/31/1025525631.db2.gz JQNGOQUEKIBWKW-CYBMUJFWSA-N 1 1 344.480 3.726 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281937906 1025731658 /nfs/dbraw/zinc/73/16/58/1025731658.db2.gz DUXNBWVZRBYCAV-SFHVURJKSA-N 1 1 338.499 3.665 20 10 EHCDMO CCOc1cccc(C[NH2+]Cc2c(O)cccc2F)c1OC(F)F ZINC000896641117 1025794440 /nfs/dbraw/zinc/79/44/40/1025794440.db2.gz PTLYCDSGTUEDKC-UHFFFAOYSA-N 1 1 341.329 3.821 20 10 EHCDMO Cc1cc(Cl)cc(C[NH2+]Cc2nnc(C(C)(C)C)s2)c1O ZINC000271876916 1029212169 /nfs/dbraw/zinc/21/21/69/1029212169.db2.gz ZMWBMSWZPNYJCI-UHFFFAOYSA-N 1 1 325.865 3.793 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1ccc(N(C)C)cc1 ZINC000090450117 1030116146 /nfs/dbraw/zinc/11/61/46/1030116146.db2.gz VTVKSFPNPJDWAX-CVEARBPZSA-N 1 1 335.455 3.745 20 10 EHCDMO COCc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc1 ZINC000160180355 1030580493 /nfs/dbraw/zinc/58/04/93/1030580493.db2.gz UJRSHGIPSLCRQK-HXUWFJFHSA-N 1 1 341.451 3.720 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2cc(C)sc2C)ccc1[N+](=O)[O-] ZINC000278570099 1031418207 /nfs/dbraw/zinc/41/82/07/1031418207.db2.gz CRKIVTJCOUUBLB-JTQLQIEISA-N 1 1 336.413 3.838 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](Cc1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000796664113 1031714630 /nfs/dbraw/zinc/71/46/30/1031714630.db2.gz UPYCRNIYTSZORA-IEBWSBKVSA-N 1 1 330.447 3.745 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1O ZINC000323929861 1033982395 /nfs/dbraw/zinc/98/23/95/1033982395.db2.gz QGMGYOSIWZDGGZ-ZDUSSCGKSA-N 1 1 333.325 3.897 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780386121 1035020632 /nfs/dbraw/zinc/02/06/32/1035020632.db2.gz UOPYQBAPFNMPGD-SKDRFNHKSA-N 1 1 333.325 3.897 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780386121 1035020636 /nfs/dbraw/zinc/02/06/36/1035020636.db2.gz UOPYQBAPFNMPGD-SKDRFNHKSA-N 1 1 333.325 3.897 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(-c2noc([C@@H]([NH3+])CC(F)F)n2)cc1 ZINC001211643134 1037359462 /nfs/dbraw/zinc/35/94/62/1037359462.db2.gz PEWJSPVUBBVMTO-AWEZNQCLSA-N 1 1 332.354 3.799 20 10 EHCDMO CCC[NH+]1CCC(NCc2ccc(N3CCC(C)CC3)cc2)CC1 ZINC000157487945 1037622150 /nfs/dbraw/zinc/62/21/50/1037622150.db2.gz RCTMZBXBSDRXRH-UHFFFAOYSA-N 1 1 329.532 3.887 20 10 EHCDMO CCCN1CCC([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)CC1 ZINC000157487945 1037622162 /nfs/dbraw/zinc/62/21/62/1037622162.db2.gz RCTMZBXBSDRXRH-UHFFFAOYSA-N 1 1 329.532 3.887 20 10 EHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc(OC)c(OC)cc1O ZINC000180444675 1038176614 /nfs/dbraw/zinc/17/66/14/1038176614.db2.gz GCONUHOCXYSTKL-KRWDZBQOSA-N 1 1 329.440 3.863 20 10 EHCDMO CC(=O)N1CCCCC[C@@H]1C1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000378497476 1038676092 /nfs/dbraw/zinc/67/60/92/1038676092.db2.gz QDWNMWINFFFDIQ-LJQANCHMSA-N 1 1 348.462 3.534 20 10 EHCDMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccccc1)c1ccc(F)cc1O ZINC000363849410 1038681313 /nfs/dbraw/zinc/68/13/13/1038681313.db2.gz GSFVNOQCZDVQLD-ORAYPTAESA-N 1 1 325.387 3.705 20 10 EHCDMO CCc1nn(C)cc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000183376665 1038703025 /nfs/dbraw/zinc/70/30/25/1038703025.db2.gz JEPKNEXKJFVCMY-UHFFFAOYSA-N 1 1 326.488 3.605 20 10 EHCDMO Cc1nc2ccccc2n1CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000184869745 1038939604 /nfs/dbraw/zinc/93/96/04/1038939604.db2.gz ZSOCMORGPNIBAK-ZDUSSCGKSA-N 1 1 327.403 3.930 20 10 EHCDMO Cc1[nH]c2nc[nH+]c(N3CC=C(c4c[nH]c5ncccc45)CC3)c2c1C ZINC000645106526 1040610930 /nfs/dbraw/zinc/61/09/30/1040610930.db2.gz FSSYXWVZKDPXNY-UHFFFAOYSA-N 1 1 344.422 3.745 20 10 EHCDMO CCC[N@@H+](Cc1csc(N(C)C2CC2)n1)Cc1ccccc1O ZINC000151158479 1040629505 /nfs/dbraw/zinc/62/95/05/1040629505.db2.gz RUDZRXKMDPAQOO-UHFFFAOYSA-N 1 1 331.485 3.860 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3cccc(C)c3)C2)cc1OC ZINC000784025043 1040828816 /nfs/dbraw/zinc/82/88/16/1040828816.db2.gz DNETWFMIZMERNG-INIZCTEOSA-N 1 1 327.424 3.707 20 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EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1c(F)cccc1F ZINC000917014267 1122438773 /nfs/dbraw/zinc/43/87/73/1122438773.db2.gz PUZFCYYBXUVKRG-IBGZPJMESA-N 1 1 348.437 3.975 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(F)ccc3OC)CC2)cc1 ZINC000917207923 1122550846 /nfs/dbraw/zinc/55/08/46/1122550846.db2.gz PWFFUKAVHFHPIZ-UHFFFAOYSA-N 1 1 344.430 3.555 20 10 EHCDMO CCc1ccc(CC[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000734640165 1131261138 /nfs/dbraw/zinc/26/11/38/1131261138.db2.gz QHHSONXCULZGGC-UHFFFAOYSA-N 1 1 338.495 3.760 20 10 EHCDMO CC(C)[N@@H+](C)CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000181583783 1124958262 /nfs/dbraw/zinc/95/82/62/1124958262.db2.gz QPSXGJFHYUUGCZ-KRWDZBQOSA-N 1 1 340.467 3.822 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000182317866 1125252225 /nfs/dbraw/zinc/25/22/25/1125252225.db2.gz RZUGYKRUFCBQAV-STQMWFEESA-N 1 1 339.395 3.863 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](Cc3ccccc3)C1)OCO2 ZINC000729985333 1130662778 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C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C(F)(F)F)O1 ZINC000744439355 1132099249 /nfs/dbraw/zinc/09/92/49/1132099249.db2.gz KXQAJABXJCKAKA-ZBEGNZNMSA-N 1 1 325.330 3.697 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C(F)(F)F)O1 ZINC000744439355 1132099255 /nfs/dbraw/zinc/09/92/55/1132099255.db2.gz KXQAJABXJCKAKA-ZBEGNZNMSA-N 1 1 325.330 3.697 20 10 EHCDMO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C ZINC001169124019 1132665752 /nfs/dbraw/zinc/66/57/52/1132665752.db2.gz PJOJUOCAVOWUQZ-MFCZKXCZSA-N 1 1 328.500 3.847 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 ZINC001169782067 1132856988 /nfs/dbraw/zinc/85/69/88/1132856988.db2.gz JKYGQOBZRRKYRJ-LJQANCHMSA-N 1 1 338.451 3.519 20 10 EHCDMO Cc1nc(CC[NH2+]Cc2cc(C)cc(Br)c2O)cs1 ZINC001177199528 1133037682 /nfs/dbraw/zinc/03/76/82/1133037682.db2.gz KWSFYUMDHVESTF-UHFFFAOYSA-N 1 1 341.274 3.560 20 10 EHCDMO CCc1ccccc1NCc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177415838 1133062952 /nfs/dbraw/zinc/06/29/52/1133062952.db2.gz CJMGRYPBNGUGJH-UHFFFAOYSA-N 1 1 327.447 3.752 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cnc1Cl ZINC000768163164 1133103342 /nfs/dbraw/zinc/10/33/42/1133103342.db2.gz VXYLBOJRMOMZPA-QGZVFWFLSA-N 1 1 346.858 3.930 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2c(O)cccc2OC)cc1 ZINC000768209059 1133108655 /nfs/dbraw/zinc/10/86/55/1133108655.db2.gz YIFMGHLCROBWAG-UHFFFAOYSA-N 1 1 328.456 3.879 20 10 EHCDMO C[N@@H+](CCc1cccc2ccccc21)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768444670 1133139949 /nfs/dbraw/zinc/13/99/49/1133139949.db2.gz NGJUVEMLCSSYSF-OAQYLSRUSA-N 1 1 349.430 3.646 20 10 EHCDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768447940 1133140356 /nfs/dbraw/zinc/14/03/56/1133140356.db2.gz RSHOCHWQVMVTPO-QUCCMNQESA-N 1 1 327.424 3.647 20 10 EHCDMO CCC[N@@H+](Cc1cc(OC)c(C)cc1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000768446804 1133140605 /nfs/dbraw/zinc/14/06/05/1133140605.db2.gz OSIKVTCVFKDTQG-LZQZEXGQSA-N 1 1 333.472 3.735 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1O ZINC000768554237 1133155251 /nfs/dbraw/zinc/15/52/51/1133155251.db2.gz FQLJVUXWSYMCPY-GOSISDBHSA-N 1 1 342.414 3.810 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cc1F ZINC000768892911 1133198009 /nfs/dbraw/zinc/19/80/09/1133198009.db2.gz UCNQNWAAHOEVDV-INIZCTEOSA-N 1 1 330.451 3.775 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)CC2CCCC2)c1O ZINC000769191914 1133233666 /nfs/dbraw/zinc/23/36/66/1133233666.db2.gz LHYIXLKZMZTOLW-UHFFFAOYSA-N 1 1 328.250 3.785 20 10 EHCDMO CCCCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000769200834 1133242707 /nfs/dbraw/zinc/24/27/07/1133242707.db2.gz DFINXGAACVRLIM-QGZVFWFLSA-N 1 1 332.488 3.609 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CC[C@@H](C3CC3)O2)c1 ZINC001179691136 1133271683 /nfs/dbraw/zinc/27/16/83/1133271683.db2.gz ZCMZEDQZKIMTHM-HIFRSBDPSA-N 1 1 340.261 3.510 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c(O)c1 ZINC000769504743 1133304767 /nfs/dbraw/zinc/30/47/67/1133304767.db2.gz YOYXLFVLYLUSCK-GOSISDBHSA-N 1 1 326.440 3.867 20 10 EHCDMO CCN(CC)c1ccc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1F ZINC000769514316 1133305831 /nfs/dbraw/zinc/30/58/31/1133305831.db2.gz JDXOGKXMXWOQEO-IBGZPJMESA-N 1 1 347.522 3.836 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cc(F)cc(F)c1[O-] ZINC001180012273 1133316652 /nfs/dbraw/zinc/31/66/52/1133316652.db2.gz ZJJMWZYOCTZAIK-UHFFFAOYSA-N 1 1 335.394 3.936 20 10 EHCDMO COCC[N@H+](Cc1ccc(C)cc1C)Cc1cc(F)cc(F)c1O ZINC001180012273 1133316656 /nfs/dbraw/zinc/31/66/56/1133316656.db2.gz ZJJMWZYOCTZAIK-UHFFFAOYSA-N 1 1 335.394 3.936 20 10 EHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cc(F)cc(F)c1O ZINC001180012273 1133316658 /nfs/dbraw/zinc/31/66/58/1133316658.db2.gz ZJJMWZYOCTZAIK-UHFFFAOYSA-N 1 1 335.394 3.936 20 10 EHCDMO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H](C)C(C)(C)C ZINC001180262172 1133352771 /nfs/dbraw/zinc/35/27/71/1133352771.db2.gz LQOCCWGNQYGPTF-GFCCVEGCSA-N 1 1 327.852 3.703 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cn(C)nc2C(F)F)cc1 ZINC000770645213 1133454482 /nfs/dbraw/zinc/45/44/82/1133454482.db2.gz IMJYCFPWDMYZQT-UHFFFAOYSA-N 1 1 336.430 3.836 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001181465383 1133490715 /nfs/dbraw/zinc/49/07/15/1133490715.db2.gz XEBWHCWTBYFXQJ-UHFFFAOYSA-N 1 1 331.213 3.926 20 10 EHCDMO Oc1cc(F)c(F)cc1CN1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC001182160353 1133580931 /nfs/dbraw/zinc/58/09/31/1133580931.db2.gz ITJZINUHAZHRKU-OAHLLOKOSA-N 1 1 330.378 3.655 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)cc1 ZINC000771818317 1133600746 /nfs/dbraw/zinc/60/07/46/1133600746.db2.gz JQWHEYPGBWXCKL-NRFANRHFSA-N 1 1 341.474 3.818 20 10 EHCDMO C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774226783 1133642242 /nfs/dbraw/zinc/64/22/42/1133642242.db2.gz RWCWKRTUJUHZOI-YHAQOWFVSA-N 1 1 329.271 3.832 20 10 EHCDMO CCNC(=O)C1(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CCC1 ZINC000774382083 1133667673 /nfs/dbraw/zinc/66/76/73/1133667673.db2.gz QCZRKCIVPBHOGA-JTQLQIEISA-N 1 1 345.270 3.656 20 10 EHCDMO CCOC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000774355778 1133669753 /nfs/dbraw/zinc/66/97/53/1133669753.db2.gz MDVWNSBLOMPXIJ-VHSXEESVSA-N 1 1 347.242 3.580 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1cc(F)cc(F)c1O ZINC000787025742 1133939009 /nfs/dbraw/zinc/93/90/09/1133939009.db2.gz LVMXLLKYUSPVIH-GLEZIHRCSA-N 1 1 345.748 3.847 20 10 EHCDMO CCOCCOCC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000787423331 1134001244 /nfs/dbraw/zinc/00/12/44/1134001244.db2.gz JZONZHCMICEYLU-UHFFFAOYSA-N 1 1 329.440 3.544 20 10 EHCDMO C[C@H]([NH2+]CC1(N(C)C)CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788505020 1134133794 /nfs/dbraw/zinc/13/37/94/1134133794.db2.gz IWLVCAFCFDZHHH-LBPRGKRZSA-N 1 1 330.394 3.936 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2cc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000774983553 1134174182 /nfs/dbraw/zinc/17/41/82/1134174182.db2.gz OTNDZOXTWWQGFE-UHFFFAOYSA-N 1 1 348.424 3.539 20 10 EHCDMO COc1c(O)c(C[NH2+]C2(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000775023476 1134222395 /nfs/dbraw/zinc/22/23/95/1134222395.db2.gz KQXHJNGYOURHBP-UHFFFAOYSA-N 1 1 348.786 3.741 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000775025136 1134227491 /nfs/dbraw/zinc/22/74/91/1134227491.db2.gz CJGKYILFERRPSC-UHFFFAOYSA-N 1 1 348.374 3.516 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@@H](C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000775025937 1134228061 /nfs/dbraw/zinc/22/80/61/1134228061.db2.gz XMIPAFXAPIKYEM-CYBMUJFWSA-N 1 1 330.384 3.511 20 10 EHCDMO CC(C)(C)OC(=O)O[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203648197 1134263591 /nfs/dbraw/zinc/26/35/91/1134263591.db2.gz FXJGGKCXLMDISC-ZDUSSCGKSA-N 1 1 327.808 3.572 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)c2nc(C)cc(=O)[nH]2)cc1 ZINC000790268491 1134391519 /nfs/dbraw/zinc/39/15/19/1134391519.db2.gz RARVOABBGOLREL-HNNXBMFYSA-N 1 1 328.460 3.530 20 10 EHCDMO Oc1ccc(Cl)c(F)c1CN[C@@H]1COc2cc(F)cc(F)c21 ZINC000790986281 1134488743 /nfs/dbraw/zinc/48/87/43/1134488743.db2.gz MDNOWVSHCZIXPY-LLVKDONJSA-N 1 1 329.705 3.686 20 10 EHCDMO COC(=O)CC1([NH2+]Cc2c(O)ccc(Cl)c2F)CCCCC1 ZINC000790976551 1134493673 /nfs/dbraw/zinc/49/36/73/1134493673.db2.gz HXNKPWLURLHSLI-UHFFFAOYSA-N 1 1 329.799 3.540 20 10 EHCDMO COc1cccc(O[C@H](C)C[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790974908 1134494318 /nfs/dbraw/zinc/49/43/18/1134494318.db2.gz ZMSLFJKJTRFEBF-LLVKDONJSA-N 1 1 339.794 3.750 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12 ZINC000790980185 1134495638 /nfs/dbraw/zinc/49/56/38/1134495638.db2.gz JQXXJMPSJADCLC-QKCSRTOESA-N 1 1 333.881 3.654 20 10 EHCDMO Oc1ccc(Cl)c(F)c1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000792165495 1134661542 /nfs/dbraw/zinc/66/15/42/1134661542.db2.gz RCDXITLOSFUSNV-CYBMUJFWSA-N 1 1 326.843 3.635 20 10 EHCDMO C[C@H]1CCSCC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000792195673 1134666624 /nfs/dbraw/zinc/66/66/24/1134666624.db2.gz DJNXLUPDNXLYCO-HNNXBMFYSA-N 1 1 349.500 3.913 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353081 1134754066 /nfs/dbraw/zinc/75/40/66/1134754066.db2.gz VLHAWGMLJXMWDO-AWEZNQCLSA-N 1 1 344.411 3.762 20 10 EHCDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792761404 1134786995 /nfs/dbraw/zinc/78/69/95/1134786995.db2.gz MKECWNVVHCUEGY-HNNXBMFYSA-N 1 1 330.394 3.772 20 10 EHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Br)ccc1O ZINC000793230314 1134880106 /nfs/dbraw/zinc/88/01/06/1134880106.db2.gz FWCWPGADICJRNB-KCJUWKMLSA-N 1 1 338.167 3.927 20 10 EHCDMO CC(C)[PH+](CCNC(=O)c1cc(O)c(O)c(Cl)c1)C(C)C ZINC001193633762 1135162352 /nfs/dbraw/zinc/16/23/52/1135162352.db2.gz GAPRYWLCKFXULT-UHFFFAOYSA-N 1 1 331.780 3.780 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@H]2C2(O)CC2)ccc1N1CCCCC1 ZINC001194954554 1135345507 /nfs/dbraw/zinc/34/55/07/1135345507.db2.gz XDZVLZGUTWPPKI-FQEVSTJZSA-N 1 1 328.500 3.865 20 10 EHCDMO C[N@H+]1CCC[C@H](NC(=O)c2ccccc2NN=C2C=CC(=O)C=C2)C1 ZINC001195279014 1135404212 /nfs/dbraw/zinc/40/42/12/1135404212.db2.gz LAWNWDIXYRXBNY-SKAIHHOBSA-N 1 1 338.411 3.632 20 10 EHCDMO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c1O ZINC000775739463 1135596968 /nfs/dbraw/zinc/59/69/68/1135596968.db2.gz HLOXBALACMEQIZ-ZBFHGGJFSA-N 1 1 334.460 3.578 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)CN1CC2(CCCC2)CC1=O ZINC000747451271 1135609131 /nfs/dbraw/zinc/60/91/31/1135609131.db2.gz CBKVHLBLIPJGPG-UHFFFAOYSA-N 1 1 343.515 3.713 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1c1cccc(F)c1 ZINC000747467495 1135633709 /nfs/dbraw/zinc/63/37/09/1135633709.db2.gz PHPIRNKHWVOMCS-CWTRNNRKSA-N 1 1 329.371 3.843 20 10 EHCDMO CCN(CC)c1ccc(CN(C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809540427 1135849409 /nfs/dbraw/zinc/84/94/09/1135849409.db2.gz AZDPMQZEHAGNRW-UHFFFAOYSA-N 1 1 346.544 3.683 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccccc3OC3CC3)CC2)cc1 ZINC000809577368 1135852607 /nfs/dbraw/zinc/85/26/07/1135852607.db2.gz OYQZBOWIARZVPD-UHFFFAOYSA-N 1 1 338.451 3.559 20 10 EHCDMO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000809700834 1135869492 /nfs/dbraw/zinc/86/94/92/1135869492.db2.gz PEQMJWJARBJPCG-GXTWGEPZSA-N 1 1 342.277 3.670 20 10 EHCDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cccc(Br)c1O ZINC000809700834 1135869494 /nfs/dbraw/zinc/86/94/94/1135869494.db2.gz PEQMJWJARBJPCG-GXTWGEPZSA-N 1 1 342.277 3.670 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2COC(=O)NC2CCCCC2)c1 ZINC000809719282 1135877281 /nfs/dbraw/zinc/87/72/81/1135877281.db2.gz DOYFFSUKXIQYFZ-GOSISDBHSA-N 1 1 346.471 3.724 20 10 EHCDMO C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766797 1135879381 /nfs/dbraw/zinc/87/93/81/1135879381.db2.gz AYDWBIJOZOEAIV-ABAIWWIYSA-N 1 1 329.271 3.615 20 10 EHCDMO C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766797 1135879385 /nfs/dbraw/zinc/87/93/85/1135879385.db2.gz AYDWBIJOZOEAIV-ABAIWWIYSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766797 1135879389 /nfs/dbraw/zinc/87/93/89/1135879389.db2.gz AYDWBIJOZOEAIV-ABAIWWIYSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766797 1135879393 /nfs/dbraw/zinc/87/93/93/1135879393.db2.gz AYDWBIJOZOEAIV-ABAIWWIYSA-N 1 1 329.271 3.615 20 10 EHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000809768277 1135880792 /nfs/dbraw/zinc/88/07/92/1135880792.db2.gz GTDKQZHXEQYZIM-GWCFXTLKSA-N 1 1 328.250 3.926 20 10 EHCDMO CC(C)(C)OC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1O)C2 ZINC000809772322 1135881407 /nfs/dbraw/zinc/88/14/07/1135881407.db2.gz SUGYKKWNIIGDKK-HXUWFJFHSA-N 1 1 346.471 3.615 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCCCC[C@@H]1c1c(C)n[nH]c1C ZINC000809757188 1135887019 /nfs/dbraw/zinc/88/70/19/1135887019.db2.gz LCVJBDJMDLLKBJ-MRXNPFEDSA-N 1 1 329.444 3.858 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+](CCc1ccccn1)Cc1ccncc1 ZINC000809763359 1135888641 /nfs/dbraw/zinc/88/86/41/1135888641.db2.gz NKIAZOWNWVCUHX-UHFFFAOYSA-N 1 1 337.398 3.566 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H](C)c1cccnc1 ZINC000809763859 1135888732 /nfs/dbraw/zinc/88/87/32/1135888732.db2.gz AMNDZUZVXBUZEE-QGZVFWFLSA-N 1 1 325.456 3.501 20 10 EHCDMO OC[C@@]1(Cc2ccc(F)cc2)CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000809790922 1135893188 /nfs/dbraw/zinc/89/31/88/1135893188.db2.gz SGJBASAFHICONT-LJQANCHMSA-N 1 1 349.833 3.612 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(C(F)(F)F)cc1O ZINC000810253839 1135948858 /nfs/dbraw/zinc/94/88/58/1135948858.db2.gz DWNRRAZSBIASEQ-WCQYABFASA-N 1 1 339.361 3.732 20 10 EHCDMO CO[C@H](C)c1nc(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])cs1 ZINC000776232461 1136087472 /nfs/dbraw/zinc/08/74/72/1136087472.db2.gz YIJYAINLAIEMMD-MRVPVSSYSA-N 1 1 330.812 3.638 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c1O ZINC000811519678 1136098529 /nfs/dbraw/zinc/09/85/29/1136098529.db2.gz BOENMKFZSJHZGK-CQSZACIVSA-N 1 1 326.227 3.651 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2COC(=O)NC2CCCC2)c1O ZINC000811510863 1136103212 /nfs/dbraw/zinc/10/32/12/1136103212.db2.gz QJDUAZWUKYQQMY-GOSISDBHSA-N 1 1 346.471 3.724 20 10 EHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)[C@](C)(CNC(=O)OC(C)(C)C)C2)c1O ZINC000811512034 1136103383 /nfs/dbraw/zinc/10/33/83/1136103383.db2.gz BYSGHCUEPZRQRI-FOIQADDNSA-N 1 1 348.487 3.683 20 10 EHCDMO COc1cc(C[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)c(O)c(C(C)(C)C)c1 ZINC000850228068 1136224187 /nfs/dbraw/zinc/22/41/87/1136224187.db2.gz JKEKPJXKAKRMNF-GFCCVEGCSA-N 1 1 346.475 3.791 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C1CCOCC1 ZINC000850494678 1136271053 /nfs/dbraw/zinc/27/10/53/1136271053.db2.gz WDWUYRDJIXFDBR-ABAIWWIYSA-N 1 1 347.377 3.503 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccc(N2CCCCC2)cc1 ZINC000850498885 1136272264 /nfs/dbraw/zinc/27/22/64/1136272264.db2.gz FGMLYYPLDHLZSS-MPGHIAIKSA-N 1 1 325.460 3.625 20 10 EHCDMO COc1ccc(Br)cc1C[N@@H+](C)Cc1ccccc1O ZINC000109773478 1136339692 /nfs/dbraw/zinc/33/96/92/1136339692.db2.gz PEWOUPOMHXQYGT-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1 ZINC000814175706 1136410587 /nfs/dbraw/zinc/41/05/87/1136410587.db2.gz JPAZZXLGZAEAFS-NVXWUHKLSA-N 1 1 346.471 3.532 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1N(C)C ZINC000815022404 1136538689 /nfs/dbraw/zinc/53/86/89/1136538689.db2.gz XZBVMWFZQURHSW-QGZVFWFLSA-N 1 1 347.503 3.550 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@](CO)(c3ccccc3)C2)ccc1N(C)C ZINC000815111603 1136550327 /nfs/dbraw/zinc/55/03/27/1136550327.db2.gz DBLNMDLBBIHIQB-JOCHJYFZSA-N 1 1 338.495 3.587 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@](C)(C(F)F)O1 ZINC000853631072 1136551089 /nfs/dbraw/zinc/55/10/89/1136551089.db2.gz SAYRUGNJPGKBGD-ADLMAVQZSA-N 1 1 343.414 3.640 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@](C)(C(F)F)O1 ZINC000853631072 1136551092 /nfs/dbraw/zinc/55/10/92/1136551092.db2.gz SAYRUGNJPGKBGD-ADLMAVQZSA-N 1 1 343.414 3.640 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)cc1F ZINC000815121979 1136552549 /nfs/dbraw/zinc/55/25/49/1136552549.db2.gz IBDRITKBDLXJNJ-UHFFFAOYSA-N 1 1 339.414 3.760 20 10 EHCDMO C[C@@H]([NH2+]CCN1CCC[C@@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815559199 1136610663 /nfs/dbraw/zinc/61/06/63/1136610663.db2.gz AALCREGVZJJZKW-CHWSQXEVSA-N 1 1 330.394 3.794 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H]3C3CCOCC3)c2c1 ZINC000776772183 1136659275 /nfs/dbraw/zinc/65/92/75/1136659275.db2.gz MNRRBDDIXPVEIC-HXUWFJFHSA-N 1 1 341.451 3.945 20 10 EHCDMO O=C1CCCCN1[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816505232 1136728357 /nfs/dbraw/zinc/72/83/57/1136728357.db2.gz QQQYVCGMIVHNIN-GOSISDBHSA-N 1 1 338.451 3.522 20 10 EHCDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816509349 1136728808 /nfs/dbraw/zinc/72/88/08/1136728808.db2.gz NKVMAIDOMUWOAV-AWEZNQCLSA-N 1 1 344.455 3.890 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000816549743 1136733022 /nfs/dbraw/zinc/73/30/22/1136733022.db2.gz XLMMPYNZGBTADV-QMMMGPOBSA-N 1 1 335.766 3.617 20 10 EHCDMO Cn1cc([C@H]2CSCC[N@H+]2Cc2ccc3ccccc3c2O)cn1 ZINC000816591277 1136735062 /nfs/dbraw/zinc/73/50/62/1136735062.db2.gz ZJJYKGQWCWYMLN-GOSISDBHSA-N 1 1 339.464 3.569 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@H](O)CC23CCC3)ccc1N1CCCCC1 ZINC000817290498 1136791666 /nfs/dbraw/zinc/79/16/66/1136791666.db2.gz JIWVPNHSXQERKK-IBGZPJMESA-N 1 1 328.500 3.865 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000817938624 1136847148 /nfs/dbraw/zinc/84/71/48/1136847148.db2.gz OOBYHLVZZVGFHO-RBUKOAKNSA-N 1 1 333.426 3.772 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000817938623 1136847556 /nfs/dbraw/zinc/84/75/56/1136847556.db2.gz OOBYHLVZZVGFHO-OALUTQOASA-N 1 1 333.426 3.772 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000817938582 1136847731 /nfs/dbraw/zinc/84/77/31/1136847731.db2.gz NOVOBHQTCORKKN-SGTLLEGYSA-N 1 1 335.854 3.896 20 10 EHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000817938917 1136847943 /nfs/dbraw/zinc/84/79/43/1136847943.db2.gz VKIVWTNWZLUODS-ACJLOTCBSA-N 1 1 349.425 3.705 20 10 EHCDMO CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817986528 1136855316 /nfs/dbraw/zinc/85/53/16/1136855316.db2.gz RFDYOJJMGPVBOM-HNNXBMFYSA-N 1 1 328.378 3.762 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)c1ncc(C(=O)OC)s1)c1ccc(N(C)C)cc1 ZINC000818357642 1136875732 /nfs/dbraw/zinc/87/57/32/1136875732.db2.gz DCBMGBNFFCDQSA-SWLSCSKDSA-N 1 1 347.484 3.798 20 10 EHCDMO CC(C)c1ncc2c(n1)CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000857876661 1136916563 /nfs/dbraw/zinc/91/65/63/1136916563.db2.gz IUCQLGQNNHBSFV-WAYWQWQTSA-N 1 1 336.483 3.738 20 10 EHCDMO c1nc2c(s1)CCC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000858355845 1136961221 /nfs/dbraw/zinc/96/12/21/1136961221.db2.gz WWTMLELAPWVOAQ-MRXNPFEDSA-N 1 1 345.537 3.864 20 10 EHCDMO C[C@H]([NH2+]CCN(C)CC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000858597320 1136981593 /nfs/dbraw/zinc/98/15/93/1136981593.db2.gz YSJHLVKXRNSMIW-QMMMGPOBSA-N 1 1 327.202 3.547 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1F ZINC000822529324 1137062389 /nfs/dbraw/zinc/06/23/89/1137062389.db2.gz CEGDKDBEISCYEQ-LJQANCHMSA-N 1 1 332.463 3.673 20 10 EHCDMO C[C@@H]1COCCC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823459426 1137100548 /nfs/dbraw/zinc/10/05/48/1137100548.db2.gz TXNLVVCADFQALA-MRXNPFEDSA-N 1 1 330.497 3.995 20 10 EHCDMO CCN1CCC([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC1 ZINC000823584309 1137104988 /nfs/dbraw/zinc/10/49/88/1137104988.db2.gz GWVWKOAFDHRESI-UHFFFAOYSA-N 1 1 343.540 3.958 20 10 EHCDMO CCCCCNC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000862023453 1137127153 /nfs/dbraw/zinc/12/71/53/1137127153.db2.gz FJZKEHIJZDBCEV-SFHVURJKSA-N 1 1 345.531 3.804 20 10 EHCDMO CC(C)[N@@H+](CCc1nccs1)Cc1cc(F)c(N(C)C)cc1F ZINC000862249826 1137135162 /nfs/dbraw/zinc/13/51/62/1137135162.db2.gz DLZIAYYFQASVLL-UHFFFAOYSA-N 1 1 339.455 3.940 20 10 EHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(O)cccc1Br ZINC000862351393 1137139552 /nfs/dbraw/zinc/13/95/52/1137139552.db2.gz OKHWLBDFRVOBGL-WPRPVWTQSA-N 1 1 338.167 3.927 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1O ZINC000862473540 1137145809 /nfs/dbraw/zinc/14/58/09/1137145809.db2.gz VAYCCIOUGMVVKJ-KGLIPLIRSA-N 1 1 342.302 3.933 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@]3(CC(=O)c4ccccc4O3)C2)c1 ZINC000862482890 1137146424 /nfs/dbraw/zinc/14/64/24/1137146424.db2.gz YVUKPMFMSVCGOD-OAQYLSRUSA-N 1 1 337.419 3.701 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1(C)C ZINC000824820821 1137153725 /nfs/dbraw/zinc/15/37/25/1137153725.db2.gz OBZQEEFZTLLYHL-CQSZACIVSA-N 1 1 342.277 3.710 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000825412359 1137176963 /nfs/dbraw/zinc/17/69/63/1137176963.db2.gz HMAZOUVZRXYRLT-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO CCOc1ccc(N(C)Cc2cccc(C[NH+]3CCOCC3)c2)cc1 ZINC000864012406 1137211829 /nfs/dbraw/zinc/21/18/29/1137211829.db2.gz LMZNTHBTCHSIHN-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)O[C@@H](C4CC4)C3)c2c1 ZINC000794646868 1137220874 /nfs/dbraw/zinc/22/08/74/1137220874.db2.gz KMPLKRATGSDYNA-RNODOKPDSA-N 1 1 327.424 3.553 20 10 EHCDMO CCc1cc(C[N@H+]2CCO[C@]3(CCO[C@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000794665806 1137222502 /nfs/dbraw/zinc/22/25/02/1137222502.db2.gz VZYGJTRGPGMEFP-YCRPNKLZSA-N 1 1 347.499 3.632 20 10 EHCDMO C[N@@H+](Cc1[nH]nc2ccc(F)cc21)Cc1ccc(N2CCCC2)cc1 ZINC001144199666 1137250540 /nfs/dbraw/zinc/25/05/40/1137250540.db2.gz QDNOCUZTCSDXCJ-UHFFFAOYSA-N 1 1 338.430 3.934 20 10 EHCDMO C[N@H+](Cc1cccc(O)c1)Cc1cc(Br)c(F)cc1O ZINC001144298661 1137268572 /nfs/dbraw/zinc/26/85/72/1137268572.db2.gz IAPOVYXNQPLDST-UHFFFAOYSA-N 1 1 340.192 3.631 20 10 EHCDMO C[N@@H+](Cc1cccc(O)c1)Cc1cc(Br)c(F)cc1O ZINC001144298661 1137268574 /nfs/dbraw/zinc/26/85/74/1137268574.db2.gz IAPOVYXNQPLDST-UHFFFAOYSA-N 1 1 340.192 3.631 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1[O-] ZINC001144306969 1137270760 /nfs/dbraw/zinc/27/07/60/1137270760.db2.gz YDADRSYMKIYLAA-CQSZACIVSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306969 1137270761 /nfs/dbraw/zinc/27/07/61/1137270761.db2.gz YDADRSYMKIYLAA-CQSZACIVSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306969 1137270762 /nfs/dbraw/zinc/27/07/62/1137270762.db2.gz YDADRSYMKIYLAA-CQSZACIVSA-N 1 1 346.240 3.683 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)c(O)c1 ZINC001144509349 1137303745 /nfs/dbraw/zinc/30/37/45/1137303745.db2.gz UHJONXHCJZDAQA-QFIPXVFZSA-N 1 1 347.414 3.951 20 10 EHCDMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCN(C)CC3)cc1)CC2 ZINC000846055785 1137331125 /nfs/dbraw/zinc/33/11/25/1137331125.db2.gz NTPRZBSURPLNEO-JOCHJYFZSA-N 1 1 335.495 3.524 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)c1 ZINC000846184847 1137340164 /nfs/dbraw/zinc/34/01/64/1137340164.db2.gz OFQHZBNSZZNRPP-JQAFLVLXSA-N 1 1 329.799 3.534 20 10 EHCDMO C[C@@H]1C[C@H](N(C)Cc2ccc(N(C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC001171767755 1137509403 /nfs/dbraw/zinc/50/94/03/1137509403.db2.gz PMIDPONTCDTZBP-GCJKJVERSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767755 1137509405 /nfs/dbraw/zinc/50/94/05/1137509405.db2.gz PMIDPONTCDTZBP-GCJKJVERSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767755 1137509406 /nfs/dbraw/zinc/50/94/06/1137509406.db2.gz PMIDPONTCDTZBP-GCJKJVERSA-N 1 1 337.511 3.847 20 10 EHCDMO Oc1c(C[NH2+][C@H]2Cc3cccc(F)c3C2)cc(Cl)c2cccnc12 ZINC001171777612 1137510328 /nfs/dbraw/zinc/51/03/28/1137510328.db2.gz QXIPCELKNFYRJF-ZDUSSCGKSA-N 1 1 342.801 3.990 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](c3cc(C(C)C)n[nH]3)C2)c1O ZINC000872790754 1137584444 /nfs/dbraw/zinc/58/44/44/1137584444.db2.gz QOYXWGSBMORASK-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000872790754 1137584445 /nfs/dbraw/zinc/58/44/45/1137584445.db2.gz QOYXWGSBMORASK-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000872790754 1137584446 /nfs/dbraw/zinc/58/44/46/1137584446.db2.gz QOYXWGSBMORASK-HNNXBMFYSA-N 1 1 343.471 3.935 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccccc1Cl ZINC000876536322 1137654883 /nfs/dbraw/zinc/65/48/83/1137654883.db2.gz YETDZHLSWDGRRD-UHFFFAOYSA-N 1 1 344.886 3.933 20 10 EHCDMO OC1CCN(c2ccc(C[N@@H+](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000876559878 1137655649 /nfs/dbraw/zinc/65/56/49/1137655649.db2.gz HVEQAAIQRVKFBM-UHFFFAOYSA-N 1 1 336.479 3.812 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC4(C3)CCCCC4)cc2)CC1 ZINC000876767480 1137660852 /nfs/dbraw/zinc/66/08/52/1137660852.db2.gz KIHLWBYMDXUXTL-UHFFFAOYSA-N 1 1 328.500 3.804 20 10 EHCDMO CC1(C)C[N@H+](Cc2ccc(Br)cc2O)[C@H]1[C@@H]1CCCO1 ZINC000825943724 1137671920 /nfs/dbraw/zinc/67/19/20/1137671920.db2.gz JAIFXSHDWUAWGQ-GJZGRUSLSA-N 1 1 340.261 3.544 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(Br)cc2O)[C@H]1[C@@H]1CCCO1 ZINC000825943724 1137671921 /nfs/dbraw/zinc/67/19/21/1137671921.db2.gz JAIFXSHDWUAWGQ-GJZGRUSLSA-N 1 1 340.261 3.544 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c(O)c1 ZINC000877194857 1137672569 /nfs/dbraw/zinc/67/25/69/1137672569.db2.gz DFORJEBPTHYTSF-AWEZNQCLSA-N 1 1 339.361 3.753 20 10 EHCDMO C[C@@H]([NH2+]Cc1ncccc1Br)c1ccc(N(C)C)cc1 ZINC000878455194 1137716721 /nfs/dbraw/zinc/71/67/21/1137716721.db2.gz RUNRHXHSZFAOQX-GFCCVEGCSA-N 1 1 334.261 3.761 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc2c(c1)OCCO2 ZINC000882909960 1137837773 /nfs/dbraw/zinc/83/77/73/1137837773.db2.gz IGWVCYTZHFEMDF-OAHLLOKOSA-N 1 1 335.350 3.683 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000882921265 1137838614 /nfs/dbraw/zinc/83/86/14/1137838614.db2.gz CAYFVIZDJBCQRB-KUHUBIRLSA-N 1 1 333.378 3.928 20 10 EHCDMO CCC[N@@H+](CC(=O)N[C@@H](C)c1ccc(F)cc1)Cc1ccccc1O ZINC000130720684 1137841192 /nfs/dbraw/zinc/84/11/92/1137841192.db2.gz UHWMLXGPWIBBNP-HNNXBMFYSA-N 1 1 344.430 3.621 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(C(F)(F)F)nc1 ZINC000883204113 1137848430 /nfs/dbraw/zinc/84/84/30/1137848430.db2.gz SJXPTHXXRWGDSO-MRVPVSSYSA-N 1 1 332.272 3.935 20 10 EHCDMO CCC(CC)[N@H+](CCOC)Cc1cccc(Br)c1O ZINC000133487797 1137894296 /nfs/dbraw/zinc/89/42/96/1137894296.db2.gz MDICRQQWDZECFM-UHFFFAOYSA-N 1 1 330.266 3.792 20 10 EHCDMO CCC(CC)[N@@H+](CCOC)Cc1cccc(Br)c1O ZINC000133487797 1137894297 /nfs/dbraw/zinc/89/42/97/1137894297.db2.gz MDICRQQWDZECFM-UHFFFAOYSA-N 1 1 330.266 3.792 20 10 EHCDMO C[N@@H+](Cc1cccc(C(=O)N2CCCCC2)c1)Cc1ccccc1O ZINC000109770454 1137897356 /nfs/dbraw/zinc/89/73/56/1137897356.db2.gz TZJHDLNCSKRCJT-UHFFFAOYSA-N 1 1 338.451 3.650 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccc(Cl)n1)C[C@H]1CCCO1 ZINC000072629266 1138106732 /nfs/dbraw/zinc/10/67/32/1138106732.db2.gz HHHNBRFVWUCHCD-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)N1CCCC1)Cc1ccccc1O ZINC000176674264 1139572494 /nfs/dbraw/zinc/57/24/94/1139572494.db2.gz IYXICFBGOODKCC-KRWDZBQOSA-N 1 1 338.451 3.578 20 10 EHCDMO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185050893 1140134006 /nfs/dbraw/zinc/13/40/06/1140134006.db2.gz UZQKCPHHMJBRBE-KGLIPLIRSA-N 1 1 344.430 3.910 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000186232128 1140193377 /nfs/dbraw/zinc/19/33/77/1140193377.db2.gz WCSRMWZJVHPHOR-QOJFYFMMSA-N 1 1 337.341 3.990 20 10 EHCDMO C[C@@H](CO[C@@H]1CCOC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192943200 1140556438 /nfs/dbraw/zinc/55/64/38/1140556438.db2.gz RYOLBUFGXKQNOZ-GARJFASQSA-N 1 1 334.243 3.544 20 10 EHCDMO CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000193102752 1140564254 /nfs/dbraw/zinc/56/42/54/1140564254.db2.gz WFCHHWJNXYEYPY-VIFPVBQESA-N 1 1 333.259 3.512 20 10 EHCDMO COc1ccccc1-c1noc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)n1 ZINC000266172468 1140651732 /nfs/dbraw/zinc/65/17/32/1140651732.db2.gz RVJDWGYXOGRBFQ-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)cc1F ZINC000271224780 1141329023 /nfs/dbraw/zinc/32/90/23/1141329023.db2.gz ACKRIICHIPLTGF-YJBOKZPZSA-N 1 1 332.419 3.573 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1O ZINC000271259291 1141335011 /nfs/dbraw/zinc/33/50/11/1141335011.db2.gz GTGDDNWIYLJGBC-QZTJIDSGSA-N 1 1 345.414 3.628 20 10 EHCDMO Fc1ccc2c(c1)[nH]cc2C1=CCN(c2[nH+]cnc3[nH]ccc32)CC1 ZINC000339141475 1141507569 /nfs/dbraw/zinc/50/75/69/1141507569.db2.gz RIAAAZVUAYMQEP-UHFFFAOYSA-N 1 1 333.370 3.872 20 10 EHCDMO C[C@@H](N[C@@H](c1nccn1C)c1cccc(F)c1)c1ccc(F)cc1[O-] ZINC000184959533 1032347078 /nfs/dbraw/zinc/34/70/78/1032347078.db2.gz INDUUJQCBVOZPF-KZULUSFZSA-N 1 1 343.377 3.844 20 10 EHCDMO C[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1O ZINC000170788800 1017093343 /nfs/dbraw/zinc/09/33/43/1017093343.db2.gz PQLDXJOIHHHRBG-HNNXBMFYSA-N 1 1 328.431 3.847 20 10 EHCDMO COc1cccc(C[N@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)c1O ZINC000091963163 1032745259 /nfs/dbraw/zinc/74/52/59/1032745259.db2.gz CPLMVHJQFLRMQZ-IRXDYDNUSA-N 1 1 345.439 3.862 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)c(O)c1 ZINC000091958733 1032746567 /nfs/dbraw/zinc/74/65/67/1032746567.db2.gz OCMHJFSYIQEWHQ-LPHOPBHVSA-N 1 1 345.439 3.862 20 10 EHCDMO COc1cc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c(O)cc1C ZINC000160349407 1018411725 /nfs/dbraw/zinc/41/17/25/1018411725.db2.gz AWDJJXKCNNLPSB-UHFFFAOYSA-N 1 1 332.469 3.677 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c(O)cc1C ZINC000160349407 1018411735 /nfs/dbraw/zinc/41/17/35/1018411735.db2.gz AWDJJXKCNNLPSB-UHFFFAOYSA-N 1 1 332.469 3.677 20 10 EHCDMO CCOCCCN1CC[C@@H]([NH2+][C@@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857495 1020074821 /nfs/dbraw/zinc/07/48/21/1020074821.db2.gz JHERGUYJBIHTRT-YTQUADARSA-N 1 1 334.504 3.570 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@@H](C)c1cccc(O)c1 ZINC000891714288 1022444960 /nfs/dbraw/zinc/44/49/60/1022444960.db2.gz UZQGSEOQNNAZEE-ZDUSSCGKSA-N 1 1 331.412 3.698 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2CC3(C2)CO[C@H](C)C3)c1 ZINC000897778840 1033172083 /nfs/dbraw/zinc/17/20/83/1033172083.db2.gz KXTMMIMMIOJCBN-FFKNIBCLSA-N 1 1 340.261 3.510 20 10 EHCDMO [O-]c1c(Br)cccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895585616 1024629374 /nfs/dbraw/zinc/62/93/74/1024629374.db2.gz YTCXDWMUOFOKNB-NSHDSACASA-N 1 1 339.258 3.601 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895585616 1024629384 /nfs/dbraw/zinc/62/93/84/1024629384.db2.gz YTCXDWMUOFOKNB-NSHDSACASA-N 1 1 339.258 3.601 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895585616 1024629392 /nfs/dbraw/zinc/62/93/92/1024629392.db2.gz YTCXDWMUOFOKNB-NSHDSACASA-N 1 1 339.258 3.601 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000281078447 1024633272 /nfs/dbraw/zinc/63/32/72/1024633272.db2.gz JCLZJOVITRSTSA-QMMMGPOBSA-N 1 1 329.293 3.808 20 10 EHCDMO COc1ccccc1OC1CC[NH+](Cc2cc(F)c(F)cc2O)CC1 ZINC001142527592 1033276902 /nfs/dbraw/zinc/27/69/02/1033276902.db2.gz ZYTRQPFYXACWFJ-UHFFFAOYSA-N 1 1 349.377 3.722 20 10 EHCDMO CCn1cnnc1C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000158449549 1025970812 /nfs/dbraw/zinc/97/08/12/1025970812.db2.gz HTVBLFPUDCHBNA-MRXNPFEDSA-N 1 1 327.476 3.529 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000273160551 1027287876 /nfs/dbraw/zinc/28/78/76/1027287876.db2.gz KJKGMWMFAAFXJR-IBGZPJMESA-N 1 1 349.434 3.862 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(Br)cc1O ZINC000273500944 1027462649 /nfs/dbraw/zinc/46/26/49/1027462649.db2.gz QCBOZNIIJVSEAG-NOZJJQNGSA-N 1 1 336.233 3.606 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000840892944 1027590277 /nfs/dbraw/zinc/59/02/77/1027590277.db2.gz FILOUNJVBWTJKE-KRWDZBQOSA-N 1 1 331.548 3.845 20 10 EHCDMO CC[C@](O)(CCC(F)(F)F)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000897521846 1028178616 /nfs/dbraw/zinc/17/86/16/1028178616.db2.gz CVPLHPCDLHLNAU-ZDUSSCGKSA-N 1 1 343.748 3.758 20 10 EHCDMO C[N@H+](Cc1coc(-c2c(F)cccc2F)n1)Cc1ccccc1O ZINC000157251194 1030381605 /nfs/dbraw/zinc/38/16/05/1030381605.db2.gz LFEQLHAIHSJTFB-UHFFFAOYSA-N 1 1 330.334 3.957 20 10 EHCDMO C[N@@H+](Cc1coc(-c2c(F)cccc2F)n1)Cc1ccccc1O ZINC000157251194 1030381623 /nfs/dbraw/zinc/38/16/23/1030381623.db2.gz LFEQLHAIHSJTFB-UHFFFAOYSA-N 1 1 330.334 3.957 20 10 EHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)n1 ZINC000093453352 1030612251 /nfs/dbraw/zinc/61/22/51/1030612251.db2.gz YPERELLDHXDBBB-OAQYLSRUSA-N 1 1 337.467 3.564 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(-c2ccccc2)n(C)n1 ZINC000527858334 1031335719 /nfs/dbraw/zinc/33/57/19/1031335719.db2.gz PQSKVMDCHSBROD-HNNXBMFYSA-N 1 1 333.435 3.873 20 10 EHCDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000128842006 1031354353 /nfs/dbraw/zinc/35/43/53/1031354353.db2.gz IYFCIRHAAYUKGO-HNNXBMFYSA-N 1 1 346.421 3.994 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138037 1032049881 /nfs/dbraw/zinc/04/98/81/1032049881.db2.gz CQTXVRVRKOJPAW-WBVHZDCISA-N 1 1 328.431 3.704 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1O ZINC000761201908 1034422080 /nfs/dbraw/zinc/42/20/80/1034422080.db2.gz IMXJOCOJTSVKFK-UKRRQHHQSA-N 1 1 327.877 3.914 20 10 EHCDMO O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1O)Nc1ccccc1 ZINC000179559149 1034491319 /nfs/dbraw/zinc/49/13/19/1034491319.db2.gz MJLATSQBTRPCBK-SFHVURJKSA-N 1 1 339.439 3.568 20 10 EHCDMO CC[N@@H+](CCC1CC1)Cc1cc(Br)cc(OC)c1O ZINC000761226303 1034822798 /nfs/dbraw/zinc/82/27/98/1034822798.db2.gz OHMQFEOELVNVAB-UHFFFAOYSA-N 1 1 328.250 3.785 20 10 EHCDMO Cc1noc(C)c1CC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000164670013 1035731591 /nfs/dbraw/zinc/73/15/91/1035731591.db2.gz GRXYHCCOVVCFFW-UHFFFAOYSA-N 1 1 327.472 3.956 20 10 EHCDMO C[N@H+](Cc1coc(-c2ccc(F)c(F)c2)n1)Cc1ccccc1O ZINC000109773842 1037681672 /nfs/dbraw/zinc/68/16/72/1037681672.db2.gz PAMSSBYGFFCDOA-UHFFFAOYSA-N 1 1 330.334 3.957 20 10 EHCDMO C[N@@H+](Cc1coc(-c2ccc(F)c(F)c2)n1)Cc1ccccc1O ZINC000109773842 1037681682 /nfs/dbraw/zinc/68/16/82/1037681682.db2.gz PAMSSBYGFFCDOA-UHFFFAOYSA-N 1 1 330.334 3.957 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1Cn1cccn1)c1ccc(F)cc1O ZINC000184911214 1038955254 /nfs/dbraw/zinc/95/52/54/1038955254.db2.gz GGJPGSWGDCPKHO-CQSZACIVSA-N 1 1 325.387 3.627 20 10 EHCDMO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000924709736 1039617214 /nfs/dbraw/zinc/61/72/14/1039617214.db2.gz ZEPUBEXZTMXTBY-QGZVFWFLSA-N 1 1 343.496 3.703 20 10 EHCDMO COc1cc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000164048267 1041139618 /nfs/dbraw/zinc/13/96/18/1041139618.db2.gz JBLZDLBJZYHXEN-AWEZNQCLSA-N 1 1 333.472 3.699 20 10 EHCDMO [O-]c1c(Cl)cccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000279352826 1043990710 /nfs/dbraw/zinc/99/07/10/1043990710.db2.gz GIVKQTIXOIWUET-UHFFFAOYSA-N 1 1 345.874 3.958 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000734446734 1131236635 /nfs/dbraw/zinc/23/66/35/1131236635.db2.gz CRGUQLWXKXSRMN-MRXNPFEDSA-N 1 1 345.512 3.569 20 10 EHCDMO COc1ccc(COCCC[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185321272 1126866844 /nfs/dbraw/zinc/86/68/44/1126866844.db2.gz PNCYFMRDAPZSJJ-CQSZACIVSA-N 1 1 333.403 3.797 20 10 EHCDMO COc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c2ccccc2n1 ZINC000185573774 1126945469 /nfs/dbraw/zinc/94/54/69/1126945469.db2.gz YHHVHLGHEOFBCX-LBPRGKRZSA-N 1 1 326.371 3.939 20 10 EHCDMO C[C@@H](NCCC[NH+]1CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764665059 1127520440 /nfs/dbraw/zinc/52/04/40/1127520440.db2.gz ATZSBNKETIBYCL-QGZVFWFLSA-N 1 1 333.495 3.953 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)cc1 ZINC000914782984 1120984283 /nfs/dbraw/zinc/98/42/83/1120984283.db2.gz YUGNOMBTXHEOKX-UHFFFAOYSA-N 1 1 335.403 3.964 20 10 EHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000762076948 1121094520 /nfs/dbraw/zinc/09/45/20/1121094520.db2.gz XFLFSMHNWFLTER-UHFFFAOYSA-N 1 1 327.472 3.552 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@](O)(C(F)(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000762182060 1121158247 /nfs/dbraw/zinc/15/82/47/1121158247.db2.gz BAKVWDDNFQYNSX-QGZVFWFLSA-N 1 1 345.405 3.751 20 10 EHCDMO Cc1ccc(N2CCC[N@@H+](Cc3cc4c(cc3O)CCC4)CC2)cc1 ZINC000917486306 1122611888 /nfs/dbraw/zinc/61/18/88/1122611888.db2.gz WVFVPDOCSDWTDD-UHFFFAOYSA-N 1 1 336.479 3.902 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1CCc1ccccc1)OCO2 ZINC000917476690 1122612727 /nfs/dbraw/zinc/61/27/27/1122612727.db2.gz GQIPADJPNNAINL-QGZVFWFLSA-N 1 1 325.408 3.718 20 10 EHCDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000921052942 1123458802 /nfs/dbraw/zinc/45/88/02/1123458802.db2.gz HNTVKAKDMBPDEQ-DLBZAZTESA-N 1 1 332.488 3.526 20 10 EHCDMO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C12CCC2 ZINC000763452830 1123571610 /nfs/dbraw/zinc/57/16/10/1123571610.db2.gz NAIFQLXSFWBCDW-DLBZAZTESA-N 1 1 335.419 3.513 20 10 EHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C12CCC2 ZINC000763452830 1123571612 /nfs/dbraw/zinc/57/16/12/1123571612.db2.gz NAIFQLXSFWBCDW-DLBZAZTESA-N 1 1 335.419 3.513 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1O ZINC000180258550 1123976649 /nfs/dbraw/zinc/97/66/49/1123976649.db2.gz CABPPXGBJYAFAV-HZPDHXFCSA-N 1 1 348.487 3.826 20 10 EHCDMO COC[C@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183066639 1125434817 /nfs/dbraw/zinc/43/48/17/1125434817.db2.gz VXIXKMDWFZEVAM-SFHVURJKSA-N 1 1 341.451 3.830 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC000183096649 1125443504 /nfs/dbraw/zinc/44/35/04/1125443504.db2.gz MUAVZKKMZMPGLK-HXUWFJFHSA-N 1 1 339.435 3.582 20 10 EHCDMO C[C@H](C(=O)NC1CCCC1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000741711659 1131635932 /nfs/dbraw/zinc/63/59/32/1131635932.db2.gz MMXJYNURDPNXFZ-QGZVFWFLSA-N 1 1 343.515 3.556 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000741752905 1131644108 /nfs/dbraw/zinc/64/41/08/1131644108.db2.gz HYOJLMZHBDIYML-UHFFFAOYSA-N 1 1 339.483 3.776 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000741752905 1131644115 /nfs/dbraw/zinc/64/41/15/1131644115.db2.gz HYOJLMZHBDIYML-UHFFFAOYSA-N 1 1 339.483 3.776 20 10 EHCDMO C[C@@H](CNCc1ccc(N2CCCCC2)cc1)[NH+]1CCC(C)CC1 ZINC000742731464 1131782048 /nfs/dbraw/zinc/78/20/48/1131782048.db2.gz XYUVTICDOOZWHZ-IBGZPJMESA-N 1 1 329.532 3.887 20 10 EHCDMO CCOC(=O)C[C@H]1CC[C@H]([N@@H+](CC)Cc2ccc(N(C)C)cc2)C1 ZINC001173660091 1132114357 /nfs/dbraw/zinc/11/43/57/1132114357.db2.gz HUGWFYQRRSEUAE-HKUYNNGSSA-N 1 1 332.488 3.696 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2cc(C)ccc2O)ccc1OC(F)F ZINC000768169206 1133104595 /nfs/dbraw/zinc/10/45/95/1133104595.db2.gz SIRIKORAFMEVHQ-UHFFFAOYSA-N 1 1 337.366 3.943 20 10 EHCDMO C[N@@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C1CCC(C(C)(C)C)CC1 ZINC000768440091 1133138270 /nfs/dbraw/zinc/13/82/70/1133138270.db2.gz NTLFQXBMCBCASI-JMLCCBQJSA-N 1 1 333.472 3.855 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1CC1CCCCC1)[C@@H](O)CO2 ZINC000768443599 1133139107 /nfs/dbraw/zinc/13/91/07/1133139107.db2.gz HKQRYUDVXJZZKN-APWZRJJASA-N 1 1 331.456 3.753 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2ccccc2)cc1OC ZINC000768441534 1133139248 /nfs/dbraw/zinc/13/92/48/1133139248.db2.gz DFPBTPHJSZUGKU-IBGZPJMESA-N 1 1 327.424 3.993 20 10 EHCDMO Oc1cc2c(cc1C[N@H+](Cc1ccccc1)CC1CCC1)[C@H](O)CO2 ZINC000768443186 1133139487 /nfs/dbraw/zinc/13/94/87/1133139487.db2.gz QYPALGIYXNRBPB-HXUWFJFHSA-N 1 1 339.435 3.620 20 10 EHCDMO CC[N@@H+](Cc1ccc2ccccc2c1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768442540 1133139623 /nfs/dbraw/zinc/13/96/23/1133139623.db2.gz LKNWWVVNBPTPON-OAQYLSRUSA-N 1 1 349.430 3.993 20 10 EHCDMO Oc1cc2c(cc1CN1CC[C@H](C[NH+]3CCCCC3)C1)CCCC2 ZINC000768465484 1133144646 /nfs/dbraw/zinc/14/46/46/1133144646.db2.gz HSYLHHVFXHOHSO-QGZVFWFLSA-N 1 1 328.500 3.579 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(COC)o2)c(O)c1 ZINC000768542475 1133153882 /nfs/dbraw/zinc/15/38/82/1133153882.db2.gz VXEUXXVSVKQBBF-QGZVFWFLSA-N 1 1 331.412 3.867 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCc1ccccc1F)C[C@@H]1CCCO1 ZINC000768663063 1133167972 /nfs/dbraw/zinc/16/79/72/1133167972.db2.gz HTQRIALVDOPRIB-SFHVURJKSA-N 1 1 329.415 3.755 20 10 EHCDMO CNC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000768906213 1133201331 /nfs/dbraw/zinc/20/13/31/1133201331.db2.gz NGMYCGDOQLQITE-KRWDZBQOSA-N 1 1 346.515 3.698 20 10 EHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000769027856 1133215082 /nfs/dbraw/zinc/21/50/82/1133215082.db2.gz BBGHCTYHUMRRBH-QGZVFWFLSA-N 1 1 347.459 3.586 20 10 EHCDMO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC001179015480 1133221386 /nfs/dbraw/zinc/22/13/86/1133221386.db2.gz BQMCOGBBJVWHRE-ZCBMTBAISA-N 1 1 349.522 3.701 20 10 EHCDMO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC001179015479 1133221579 /nfs/dbraw/zinc/22/15/79/1133221579.db2.gz BQMCOGBBJVWHRE-OENHHBGDSA-N 1 1 349.522 3.701 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCCN(c3nccs3)CC2)cc1 ZINC000769101976 1133232504 /nfs/dbraw/zinc/23/25/04/1133232504.db2.gz KHHRZCULAIFGLQ-UHFFFAOYSA-N 1 1 344.528 3.702 20 10 EHCDMO CC1CC[NH+](C[C@@H]2CCCN(Cc3ccc(N(C)C)cc3)C2)CC1 ZINC000769147965 1133234788 /nfs/dbraw/zinc/23/47/88/1133234788.db2.gz KBGAKACISIZIEN-FQEVSTJZSA-N 1 1 329.532 3.697 20 10 EHCDMO CCOc1cccc(CN2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1O ZINC000769149256 1133234937 /nfs/dbraw/zinc/23/49/37/1133234937.db2.gz ZMHCOJRQERLQSD-ROUUACIJSA-N 1 1 346.515 3.877 20 10 EHCDMO CCOc1cccc(CN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1O ZINC000769149256 1133234942 /nfs/dbraw/zinc/23/49/42/1133234942.db2.gz ZMHCOJRQERLQSD-ROUUACIJSA-N 1 1 346.515 3.877 20 10 EHCDMO CCC[N@@H+](Cc1cc(C)ccc1O)[C@H](C)C(=O)Nc1ccccc1 ZINC000769210463 1133245264 /nfs/dbraw/zinc/24/52/64/1133245264.db2.gz GRXWXCGIRYLJFX-MRXNPFEDSA-N 1 1 326.440 3.940 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000769318105 1133261212 /nfs/dbraw/zinc/26/12/12/1133261212.db2.gz ISKZXLVBDUODHB-KRWDZBQOSA-N 1 1 342.458 3.898 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc(Cl)cc1F ZINC000769350875 1133268592 /nfs/dbraw/zinc/26/85/92/1133268592.db2.gz JCEOUTJVEWEWKP-UHFFFAOYSA-N 1 1 348.849 3.948 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CCN(C(=O)C(C)(C)C)CC2(C)C)cc1 ZINC000773829332 1133283562 /nfs/dbraw/zinc/28/35/62/1133283562.db2.gz BFLFEIZPKWWEHP-UHFFFAOYSA-N 1 1 345.531 3.612 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCN(C(=O)C(C)(C)C)CC2(C)C)cc1 ZINC000773829332 1133283567 /nfs/dbraw/zinc/28/35/67/1133283567.db2.gz BFLFEIZPKWWEHP-UHFFFAOYSA-N 1 1 345.531 3.612 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H](c3cccc(O)c3)C2)cc1 ZINC000769445859 1133291742 /nfs/dbraw/zinc/29/17/42/1133291742.db2.gz GZCISXHMKJNRTN-OAQYLSRUSA-N 1 1 340.467 3.812 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCO[C@@H](c3cccc(O)c3)C2)cc1 ZINC000769445859 1133291746 /nfs/dbraw/zinc/29/17/46/1133291746.db2.gz GZCISXHMKJNRTN-OAQYLSRUSA-N 1 1 340.467 3.812 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1 ZINC000769476783 1133299622 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Fc1cccc([C@@H]2CC[N@H+]2Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000769507594 1133305555 /nfs/dbraw/zinc/30/55/55/1133305555.db2.gz MQHLKMCYCQNYCS-IBGZPJMESA-N 1 1 344.405 3.748 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000770376653 1133414806 /nfs/dbraw/zinc/41/48/06/1133414806.db2.gz WRDGNDAVQVWISN-UXHICEINSA-N 1 1 328.500 3.925 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)cc1C ZINC000770381844 1133416978 /nfs/dbraw/zinc/41/69/78/1133416978.db2.gz SJQUQYAZEHOCIE-NVXWUHKLSA-N 1 1 348.487 3.887 20 10 EHCDMO Cc1nnc([C@@H]2CCC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)[nH]1 ZINC000770348273 1133418448 /nfs/dbraw/zinc/41/84/48/1133418448.db2.gz JKEAWVTXGWRMEB-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO Cc1n[nH]c([C@@H]2CCC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)n1 ZINC000770348273 1133418452 /nfs/dbraw/zinc/41/84/52/1133418452.db2.gz JKEAWVTXGWRMEB-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)n1 ZINC000770348273 1133418454 /nfs/dbraw/zinc/41/84/54/1133418454.db2.gz JKEAWVTXGWRMEB-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO Cc1nc([C@@H]2CCC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)n[nH]1 ZINC000770348273 1133418459 /nfs/dbraw/zinc/41/84/59/1133418459.db2.gz JKEAWVTXGWRMEB-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO Cc1nc([C@@H]2CCC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)n[nH]1 ZINC000770348273 1133418462 /nfs/dbraw/zinc/41/84/62/1133418462.db2.gz JKEAWVTXGWRMEB-GOSISDBHSA-N 1 1 348.450 3.865 20 10 EHCDMO C[C@H]1CCC[N@@H+](Cc2ccccc2O)[C@@H]1CNC(=O)OC(C)(C)C ZINC000770510908 1133435555 /nfs/dbraw/zinc/43/55/55/1133435555.db2.gz VBLHOEWXTNKORN-GOEBONIOSA-N 1 1 334.460 3.517 20 10 EHCDMO CCc1cc(C[N@@H+](C)CCc2cnccn2)c(O)c(C(C)(C)C)c1 ZINC000770660264 1133455729 /nfs/dbraw/zinc/45/57/29/1133455729.db2.gz AIMHESCTDHLNJE-UHFFFAOYSA-N 1 1 327.472 3.717 20 10 EHCDMO CCc1cccc(C[N@H+]2CCC[C@@H](Oc3ncccc3F)C2)c1O ZINC001181428116 1133485347 /nfs/dbraw/zinc/48/53/47/1133485347.db2.gz RRUYJBDKHQLFET-MRXNPFEDSA-N 1 1 330.403 3.532 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)Cc2cc[nH]c(=O)c2)cc1 ZINC001181566662 1133503828 /nfs/dbraw/zinc/50/38/28/1133503828.db2.gz ZDERRJXNBROOSI-UHFFFAOYSA-N 1 1 337.423 3.649 20 10 EHCDMO CN(C)c1ncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)s1 ZINC000771924272 1133610061 /nfs/dbraw/zinc/61/00/61/1133610061.db2.gz HVNSZBZOLRUJJZ-UHFFFAOYSA-N 1 1 343.452 3.710 20 10 EHCDMO CN(C)c1ncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)s1 ZINC000771924272 1133610066 /nfs/dbraw/zinc/61/00/66/1133610066.db2.gz HVNSZBZOLRUJJZ-UHFFFAOYSA-N 1 1 343.452 3.710 20 10 EHCDMO Fc1cc(C[N@H+]2CC[C@H]2c2ccccc2)ccc1N1CCOCC1 ZINC000771940816 1133618154 /nfs/dbraw/zinc/61/81/54/1133618154.db2.gz WUKQCGXMDMABEZ-IBGZPJMESA-N 1 1 326.415 3.609 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774172379 1133627884 /nfs/dbraw/zinc/62/78/84/1133627884.db2.gz BSZWGRWZUXEXAC-CMPLNLGQSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@H]([NH2+]CCNc1ccccn1)c1cc(Cl)c(Cl)cc1O ZINC000774196434 1133630576 /nfs/dbraw/zinc/63/05/76/1133630576.db2.gz BBEQJMOMNREBJF-JTQLQIEISA-N 1 1 326.227 3.857 20 10 EHCDMO C[C@H]([NH2+]CCC(=O)NC(C)(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774237100 1133639662 /nfs/dbraw/zinc/63/96/62/1133639662.db2.gz OZXDMYPKMXYBOW-VIFPVBQESA-N 1 1 333.259 3.654 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCn2ccnc2C1)c1cc(Cl)c(Cl)cc1O ZINC000774361947 1133664962 /nfs/dbraw/zinc/66/49/62/1133664962.db2.gz YVGVLKSCXFLAPZ-UWVGGRQHSA-N 1 1 326.227 3.561 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCSC[C@@H]1C1CCC1 ZINC001182463205 1133681628 /nfs/dbraw/zinc/68/16/28/1133681628.db2.gz UOWNVAUAVKLGOG-CQSZACIVSA-N 1 1 342.302 3.872 20 10 EHCDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@H](C)C2)c(O)c1OC ZINC001182734088 1133726261 /nfs/dbraw/zinc/72/62/61/1133726261.db2.gz MRGQHPNHVNPGTO-CQSZACIVSA-N 1 1 327.424 3.571 20 10 EHCDMO COc1nc(C)cc(C)c1C[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001183065784 1133764962 /nfs/dbraw/zinc/76/49/62/1133764962.db2.gz PDXJZQJLOGVGJM-FPLPWBNLSA-N 1 1 339.483 3.918 20 10 EHCDMO COc1nc(C)cc(C)c1C[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001183065784 1133764966 /nfs/dbraw/zinc/76/49/66/1133764966.db2.gz PDXJZQJLOGVGJM-FPLPWBNLSA-N 1 1 339.483 3.918 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@H]2CCN2C(=O)OC(C)(C)C)c1 ZINC001184012891 1133887881 /nfs/dbraw/zinc/88/78/81/1133887881.db2.gz QAYBKFAPLWVMFW-QGZVFWFLSA-N 1 1 348.487 3.957 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1nnnn1C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000786785572 1133903402 /nfs/dbraw/zinc/90/34/02/1133903402.db2.gz OGUIMOCHHDDCDV-CABCVRRESA-N 1 1 342.491 3.656 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc2cnccc2c1 ZINC000787291253 1133985585 /nfs/dbraw/zinc/98/55/85/1133985585.db2.gz VHPLMARXSYHTPX-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CCCCO)c(C)n1-c1cc(C)cc(C)c1 ZINC000788283306 1134108312 /nfs/dbraw/zinc/10/83/12/1134108312.db2.gz VMCOKLMBQWMCRV-UHFFFAOYSA-N 1 1 342.483 3.598 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CCCCO)c(C)n1-c1cc(C)cc(C)c1 ZINC000788283306 1134108315 /nfs/dbraw/zinc/10/83/15/1134108315.db2.gz VMCOKLMBQWMCRV-UHFFFAOYSA-N 1 1 342.483 3.598 20 10 EHCDMO Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788584681 1134147998 /nfs/dbraw/zinc/14/79/98/1134147998.db2.gz PILAFMGNADRSQP-VIFPVBQESA-N 1 1 327.350 3.612 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000788778620 1134174897 /nfs/dbraw/zinc/17/48/97/1134174897.db2.gz XXSZUXNSNJQLOV-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788821712 1134177290 /nfs/dbraw/zinc/17/72/90/1134177290.db2.gz YPZSAODNMCGWOG-NSHDSACASA-N 1 1 327.350 3.657 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](CC2CC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775015537 1134211553 /nfs/dbraw/zinc/21/15/53/1134211553.db2.gz SOWITZCNORQURA-MRXNPFEDSA-N 1 1 342.395 3.940 20 10 EHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)c2cccc(N3CCOC3=O)c2)c1 ZINC000789768222 1134329514 /nfs/dbraw/zinc/32/95/14/1134329514.db2.gz GEPWDPGRMJPWQV-OAHLLOKOSA-N 1 1 340.423 3.850 20 10 EHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cccc(O)c2O)cc1 ZINC000790537069 1134427505 /nfs/dbraw/zinc/42/75/05/1134427505.db2.gz ASYSLVKHNLNKGJ-AWEZNQCLSA-N 1 1 340.423 3.725 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1O ZINC000790935531 1134479606 /nfs/dbraw/zinc/47/96/06/1134479606.db2.gz YJMCBUOVVDDDNH-WFASDCNBSA-N 1 1 342.277 3.589 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000790935137 1134480951 /nfs/dbraw/zinc/48/09/51/1134480951.db2.gz VDTVTQLEKLSLSU-GXTWGEPZSA-N 1 1 342.277 3.589 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000790935137 1134480953 /nfs/dbraw/zinc/48/09/53/1134480953.db2.gz VDTVTQLEKLSLSU-GXTWGEPZSA-N 1 1 342.277 3.589 20 10 EHCDMO CC[N@H+](Cc1nccn1-c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000792156836 1134659014 /nfs/dbraw/zinc/65/90/14/1134659014.db2.gz ONBJUKZSXRULKD-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO CC[N@@H+](Cc1nccn1-c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000792156836 1134659016 /nfs/dbraw/zinc/65/90/16/1134659016.db2.gz ONBJUKZSXRULKD-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO Oc1ccc(Cl)c(F)c1CN1CCC([NH+]2CCCCC2)CC1 ZINC000792162359 1134659723 /nfs/dbraw/zinc/65/97/23/1134659723.db2.gz IDYVXABADJMMOB-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(CC)cc3)C2)c1 ZINC000792190832 1134666404 /nfs/dbraw/zinc/66/64/04/1134666404.db2.gz VHOULALMOQMYDQ-NRFANRHFSA-N 1 1 341.451 3.927 20 10 EHCDMO COCC[N@H+](Cc1cccc(Br)c1O)[C@@H]1CC[C@H](C)C1 ZINC000792192375 1134666516 /nfs/dbraw/zinc/66/65/16/1134666516.db2.gz JHLWXAOHYKBOEQ-GXTWGEPZSA-N 1 1 342.277 3.792 20 10 EHCDMO COCC[N@@H+](Cc1cccc(Br)c1O)[C@@H]1CC[C@H](C)C1 ZINC000792192375 1134666517 /nfs/dbraw/zinc/66/65/17/1134666517.db2.gz JHLWXAOHYKBOEQ-GXTWGEPZSA-N 1 1 342.277 3.792 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2CCCCO2)c(C(F)(F)F)c1 ZINC000792791190 1134790348 /nfs/dbraw/zinc/79/03/48/1134790348.db2.gz FDVNDTQRJVBXHJ-OAHLLOKOSA-N 1 1 330.394 3.772 20 10 EHCDMO CC1(C)CCC[C@@H](C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)O1 ZINC001192014980 1134955980 /nfs/dbraw/zinc/95/59/80/1134955980.db2.gz XUKUOTIOYNTUQH-ROUUACIJSA-N 1 1 333.472 3.721 20 10 EHCDMO CC1(C)CCC[C@@H](C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)O1 ZINC001192014978 1134956318 /nfs/dbraw/zinc/95/63/18/1134956318.db2.gz XUKUOTIOYNTUQH-MSOLQXFVSA-N 1 1 333.472 3.721 20 10 EHCDMO Cc1cc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)nc2sccc21 ZINC000793681589 1134981392 /nfs/dbraw/zinc/98/13/92/1134981392.db2.gz XTHCNUSSTIHRGB-UHFFFAOYSA-N 1 1 340.448 3.810 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](c2cnn(C)c2)C(C)(C)C)c1O ZINC000775550150 1135059968 /nfs/dbraw/zinc/05/99/68/1135059968.db2.gz YGQKRYNIRFUAGB-QGZVFWFLSA-N 1 1 349.862 3.859 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2C2(O)CC2)ccc1N1CCCCC1 ZINC001194954555 1135346110 /nfs/dbraw/zinc/34/61/10/1135346110.db2.gz XDZVLZGUTWPPKI-HXUWFJFHSA-N 1 1 328.500 3.865 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)CCCc3ccccc3)cc2)CC1 ZINC000775652375 1135417291 /nfs/dbraw/zinc/41/72/91/1135417291.db2.gz YNBNLKSPCKLWRD-UHFFFAOYSA-N 1 1 337.511 3.503 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)CCCc3ccccc3)cc2)CC1 ZINC000775652375 1135417295 /nfs/dbraw/zinc/41/72/95/1135417295.db2.gz YNBNLKSPCKLWRD-UHFFFAOYSA-N 1 1 337.511 3.503 20 10 EHCDMO CC(C)c1cn(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(=S)n1C ZINC000747454211 1135610497 /nfs/dbraw/zinc/61/04/97/1135610497.db2.gz PHHQFMCYNKAMKL-UHFFFAOYSA-N 1 1 332.517 3.835 20 10 EHCDMO CC(C)c1cn(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(=S)n1C ZINC000747454211 1135610500 /nfs/dbraw/zinc/61/05/00/1135610500.db2.gz PHHQFMCYNKAMKL-UHFFFAOYSA-N 1 1 332.517 3.835 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1CNc1c[nH+]ccc1-n1ccnn1 ZINC000808426341 1135659763 /nfs/dbraw/zinc/65/97/63/1135659763.db2.gz RDJLHSZJAICKGW-UHFFFAOYSA-N 1 1 343.390 3.647 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2COC(=O)NC2CCCCC2)c1O ZINC000809719019 1135877397 /nfs/dbraw/zinc/87/73/97/1135877397.db2.gz UTOGVWGUHYRELQ-GOSISDBHSA-N 1 1 346.471 3.724 20 10 EHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(F)c2[O-])cc1 ZINC000809738326 1135882654 /nfs/dbraw/zinc/88/26/54/1135882654.db2.gz URSFBTZSDVOJFS-UHFFFAOYSA-N 1 1 336.838 3.878 20 10 EHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2c([O-])ccc(Cl)c2F)cc1 ZINC000809738964 1135883303 /nfs/dbraw/zinc/88/33/03/1135883303.db2.gz RHCRGSSNTPTWHH-UHFFFAOYSA-N 1 1 336.838 3.878 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H](C)c1cccnc1 ZINC000809763857 1135888923 /nfs/dbraw/zinc/88/89/23/1135888923.db2.gz AMNDZUZVXBUZEE-KRWDZBQOSA-N 1 1 325.456 3.501 20 10 EHCDMO C[C@H](COc1cccc(F)c1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199659334 1135917581 /nfs/dbraw/zinc/91/75/81/1135917581.db2.gz YEWPBEYDCVEQBA-SNVBAGLBSA-N 1 1 327.758 3.881 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)C1CCOCC1 ZINC000776029714 1135933835 /nfs/dbraw/zinc/93/38/35/1135933835.db2.gz NGVAXPWWLPGATJ-MRXNPFEDSA-N 1 1 325.836 3.543 20 10 EHCDMO CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810215470 1135938392 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331.847 3.568 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](n4cc(C)cn4)C3)c2c1 ZINC000811799903 1136138218 /nfs/dbraw/zinc/13/82/18/1136138218.db2.gz DHMMBIVHOCQXAG-MRXNPFEDSA-N 1 1 337.423 3.506 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000776293809 1136145083 /nfs/dbraw/zinc/14/50/83/1136145083.db2.gz OASFSYWRZXCMGB-IBGZPJMESA-N 1 1 333.431 3.989 20 10 EHCDMO C[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812298617 1136196450 /nfs/dbraw/zinc/19/64/50/1136196450.db2.gz PGLJLYQNLRBNLQ-NEPJUHHUSA-N 1 1 331.334 3.674 20 10 EHCDMO COCC[C@H]1COCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000812300203 1136196822 /nfs/dbraw/zinc/19/68/22/1136196822.db2.gz UMHYZNOZARXGSD-HNNXBMFYSA-N 1 1 341.407 3.529 20 10 EHCDMO Cc1c[nH]c(C[NH2+]Cc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n1 ZINC000850284950 1136231361 /nfs/dbraw/zinc/23/13/61/1136231361.db2.gz NOMMVYURGHKNDG-CYBMUJFWSA-N 1 1 332.879 3.898 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CCC[C@H](C)O2)c1 ZINC000850379298 1136246210 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C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1cccc(Cl)c1 ZINC000876537729 1137654846 /nfs/dbraw/zinc/65/48/46/1137654846.db2.gz AMOAZRATUKQPAI-UHFFFAOYSA-N 1 1 344.886 3.933 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cc3c(cc[nH]c3=O)o2)C2CC2)cc1 ZINC000876570388 1137655858 /nfs/dbraw/zinc/65/58/58/1137655858.db2.gz BKIJDPDEBWRJAG-UHFFFAOYSA-N 1 1 337.423 3.764 20 10 EHCDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 ZINC000876614973 1137656992 /nfs/dbraw/zinc/65/69/92/1137656992.db2.gz XVSUHRFFQSTQFM-UHFFFAOYSA-N 1 1 334.460 3.532 20 10 EHCDMO CC(C)(C)C1=CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000876817153 1137662396 /nfs/dbraw/zinc/66/23/96/1137662396.db2.gz YZWSSDZJUYADFE-UHFFFAOYSA-N 1 1 328.500 3.826 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000877498196 1137678646 /nfs/dbraw/zinc/67/86/46/1137678646.db2.gz NJWNXWVABWXLMM-MRXNPFEDSA-N 1 1 325.456 3.613 20 10 EHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877531066 1137680065 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C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000016873338 1137946810 /nfs/dbraw/zinc/94/68/10/1137946810.db2.gz CXJBHIGDHGTFAC-LLVKDONJSA-N 1 1 342.420 3.924 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1O ZINC000120540610 1137950653 /nfs/dbraw/zinc/95/06/53/1137950653.db2.gz ANJAJSDKSYYTRO-HNNXBMFYSA-N 1 1 333.453 3.644 20 10 EHCDMO C[C@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1c(O)cccc1F ZINC000886505012 1138085311 /nfs/dbraw/zinc/08/53/11/1138085311.db2.gz DVYULMFJNVMSGI-YOEHRIQHSA-N 1 1 342.414 3.546 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1c(O)cccc1F ZINC000886505341 1138085600 /nfs/dbraw/zinc/08/56/00/1138085600.db2.gz WIHIHRJEDRROFG-CQSZACIVSA-N 1 1 329.419 3.767 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1c(O)cccc1F ZINC000886505340 1138085666 /nfs/dbraw/zinc/08/56/66/1138085666.db2.gz WIHIHRJEDRROFG-AWEZNQCLSA-N 1 1 329.419 3.767 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(N2CCOCC2)cc1 ZINC000886512629 1138087127 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20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(Cl)c1[O-] ZINC000179617133 1139769608 /nfs/dbraw/zinc/76/96/08/1139769608.db2.gz XJSSDAZYVMCHBZ-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000180802125 1139864549 /nfs/dbraw/zinc/86/45/49/1139864549.db2.gz ARTWNPKSEDXEBJ-AWEZNQCLSA-N 1 1 339.361 3.753 20 10 EHCDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466653 1140419710 /nfs/dbraw/zinc/41/97/10/1140419710.db2.gz CJCWTVJTUJYYMY-KRWDZBQOSA-N 1 1 342.458 3.725 20 10 EHCDMO C[C@@H](OC[C@@H](O)C[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000269618395 1141127654 /nfs/dbraw/zinc/12/76/54/1141127654.db2.gz HIMVCSPJNHIHHR-KDOFPFPSSA-N 1 1 349.858 3.616 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cscn1 ZINC000271069975 1141303842 /nfs/dbraw/zinc/30/38/42/1141303842.db2.gz DWGRMFNVAVRDMJ-MGPQQGTHSA-N 1 1 349.475 3.747 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H](c3cc(C)n[nH]3)C2)c(O)c1 ZINC000283159234 1141564379 /nfs/dbraw/zinc/56/43/79/1141564379.db2.gz YCDNDRQWYBIVGD-OAHLLOKOSA-N 1 1 329.444 3.592 20 10 EHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@@H](c3cc(C)[nH]n3)C2)c(O)c1 ZINC000283159234 1141564382 /nfs/dbraw/zinc/56/43/82/1141564382.db2.gz YCDNDRQWYBIVGD-OAHLLOKOSA-N 1 1 329.444 3.592 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H](c3cc(C)[nH]n3)C2)c(O)c1 ZINC000283159234 1141564387 /nfs/dbraw/zinc/56/43/87/1141564387.db2.gz YCDNDRQWYBIVGD-OAHLLOKOSA-N 1 1 329.444 3.592 20 10 EHCDMO CCC[N@@H+](Cc1ccc(C(=O)OC)c(F)c1)Cc1ccccc1O ZINC000089123418 1032259158 /nfs/dbraw/zinc/25/91/58/1032259158.db2.gz RLPKVOSTDNENHJ-UHFFFAOYSA-N 1 1 331.387 3.730 20 10 EHCDMO COc1cccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278755242 1032388555 /nfs/dbraw/zinc/38/85/55/1032388555.db2.gz NMRZGSGPXUTXMC-MRVPVSSYSA-N 1 1 332.347 3.727 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCCc3cnccc3C)CC2)cc1 ZINC000377615863 1018065545 /nfs/dbraw/zinc/06/55/45/1018065545.db2.gz NWOPJPGVRKRJEH-UHFFFAOYSA-N 1 1 339.483 3.544 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)cc1OC ZINC000160377612 1018650918 /nfs/dbraw/zinc/65/09/18/1018650918.db2.gz GHEYMNXCALYCMZ-PBHICJAKSA-N 1 1 327.424 3.787 20 10 EHCDMO CCOC(=O)N[C@H](C[NH2+][C@H](CC)c1ccc(F)cc1O)CC(C)C ZINC000796677209 1021367068 /nfs/dbraw/zinc/36/70/68/1021367068.db2.gz AYIGKJIANSDWIG-GOEBONIOSA-N 1 1 340.439 3.733 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2ccccc2F)C2CC2)c(O)c1OC ZINC000891515560 1021805782 /nfs/dbraw/zinc/80/57/82/1021805782.db2.gz HRJFDSGOSBFYEY-UHFFFAOYSA-N 1 1 331.387 3.713 20 10 EHCDMO OCC1([C@@H]([NH2+]Cc2cc(F)cc(F)c2O)c2cccs2)CCC1 ZINC000894946019 1022268920 /nfs/dbraw/zinc/26/89/20/1022268920.db2.gz CKJRLSYKIGMZHU-INIZCTEOSA-N 1 1 339.407 3.725 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000294327949 1023014214 /nfs/dbraw/zinc/01/42/14/1023014214.db2.gz RJNCSRLFTQMLJL-UHFFFAOYSA-N 1 1 337.778 3.636 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1Cc1ccc(F)cc1)OCO2 ZINC000729471526 1023195368 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CC(=O)c1cc(Cl)cc(C[N@@H+](C)CCc2ncc(C)s2)c1O ZINC000157758904 1025122649 /nfs/dbraw/zinc/12/26/49/1025122649.db2.gz ZLLXZDKPQIMUFA-UHFFFAOYSA-N 1 1 338.860 3.688 20 10 EHCDMO Cc1nn(C(C)C)cc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000281688725 1025352475 /nfs/dbraw/zinc/35/24/75/1025352475.db2.gz RXRBBFYINRALJQ-LJQANCHMSA-N 1 1 343.471 3.659 20 10 EHCDMO [O-]c1cccc(F)c1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000896644661 1025779977 /nfs/dbraw/zinc/77/99/77/1025779977.db2.gz YPKCVLWDVVZOMJ-KSZLIROESA-N 1 1 340.442 3.674 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1O ZINC000127841761 1027363912 /nfs/dbraw/zinc/36/39/12/1027363912.db2.gz INXNFSZCRQTEBG-HNNXBMFYSA-N 1 1 338.407 3.922 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](Cc3nc(C)cs3)C2)c(O)c1 ZINC000897299363 1027405023 /nfs/dbraw/zinc/40/50/23/1027405023.db2.gz ZVDYCZMRZYPPRX-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCCc2nc(C)cs2)c1 ZINC000273550407 1027488816 /nfs/dbraw/zinc/48/88/16/1027488816.db2.gz FTWRASSDLRZZEY-ZDUSSCGKSA-N 1 1 348.468 3.617 20 10 EHCDMO CC(C)([NH2+]Cc1cc(Cl)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000154032890 1028964460 /nfs/dbraw/zinc/96/44/60/1028964460.db2.gz BGPREMSEPZSUGZ-UHFFFAOYSA-N 1 1 342.830 3.651 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000278112346 1029093766 /nfs/dbraw/zinc/09/37/66/1029093766.db2.gz BLJFNOICPAYHQW-YVEFUNNKSA-N 1 1 342.395 3.641 20 10 EHCDMO C[C@H]([NH2+][C@@H](C(N)=O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000126123734 1029668365 /nfs/dbraw/zinc/66/83/65/1029668365.db2.gz VACTWYXWYNWTLT-OXJNMPFZSA-N 1 1 337.467 3.554 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)c1O ZINC000160143768 1030557474 /nfs/dbraw/zinc/55/74/74/1030557474.db2.gz BQMZBCSXOFHRGR-GOSISDBHSA-N 1 1 328.387 3.774 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cc3ccccc3o2)cc1OC ZINC000160343068 1030685328 /nfs/dbraw/zinc/68/53/28/1030685328.db2.gz RABROTGIQUFKQM-UHFFFAOYSA-N 1 1 327.380 3.788 20 10 EHCDMO c1ccc2c(c1)[nH]c1c2C[N@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000179848802 1031814348 /nfs/dbraw/zinc/81/43/48/1031814348.db2.gz VCKBLBXKQRWJCX-UHFFFAOYSA-N 1 1 347.462 3.563 20 10 EHCDMO c1ccc2c(c1)[nH]c1c2C[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000179848802 1031814371 /nfs/dbraw/zinc/81/43/71/1031814371.db2.gz VCKBLBXKQRWJCX-UHFFFAOYSA-N 1 1 347.462 3.563 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138024 1032051479 /nfs/dbraw/zinc/05/14/79/1032051479.db2.gz CQTXVRVRKOJPAW-RDJZCZTQSA-N 1 1 328.431 3.704 20 10 EHCDMO CCC[N@H+](Cc1nnc(-c2ccccc2)n1C)Cc1ccccc1O ZINC000170779103 1033601936 /nfs/dbraw/zinc/60/19/36/1033601936.db2.gz SAYXUROAGJCOBY-UHFFFAOYSA-N 1 1 336.439 3.600 20 10 EHCDMO CCC[N@@H+](Cc1nnc(-c2ccccc2)n1C)Cc1ccccc1O ZINC000170779103 1033601945 /nfs/dbraw/zinc/60/19/45/1033601945.db2.gz SAYXUROAGJCOBY-UHFFFAOYSA-N 1 1 336.439 3.600 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](CCO)c2ccccc2)c1O ZINC000761201226 1034405066 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COc1ccc(N2CCC[N@@H+](Cc3ccc(C#N)cc3C)CC2)cc1 ZINC000186172102 1039306648 /nfs/dbraw/zinc/30/66/48/1039306648.db2.gz FXLLHIUDVGKPEM-UHFFFAOYSA-N 1 1 335.451 3.588 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(F)cc1C(=O)OC ZINC000728927010 1039499640 /nfs/dbraw/zinc/49/96/40/1039499640.db2.gz GCAXDOYISYXDKU-UHFFFAOYSA-N 1 1 331.387 3.730 20 10 EHCDMO Cc1cnc(CC[N@@H+](C)Cc2cccc(Br)c2O)s1 ZINC000093807276 1042542537 /nfs/dbraw/zinc/54/25/37/1042542537.db2.gz VTOQCGWSSDYRQK-UHFFFAOYSA-N 1 1 341.274 3.594 20 10 EHCDMO Cc1cnc(CC[N@H+](C)Cc2cccc(Br)c2O)s1 ZINC000093807276 1042542541 /nfs/dbraw/zinc/54/25/41/1042542541.db2.gz VTOQCGWSSDYRQK-UHFFFAOYSA-N 1 1 341.274 3.594 20 10 EHCDMO CC[C@@H]([NH2+][C@H](CC(=O)N(C)C)c1ccccc1)c1ccc(F)cc1O ZINC000796706282 1042861588 /nfs/dbraw/zinc/86/15/88/1042861588.db2.gz ZFUCDIRDJNVPTL-QZTJIDSGSA-N 1 1 344.430 3.792 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c(O)c1OC ZINC000893652530 1043685000 /nfs/dbraw/zinc/68/50/00/1043685000.db2.gz 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CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(OC)c(O)c2)cc1 ZINC000768207402 1133107421 /nfs/dbraw/zinc/10/74/21/1133107421.db2.gz HTLJIEBAKDSRDX-UHFFFAOYSA-N 1 1 328.456 3.879 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)CCOc2ccccc2Cl)c1O ZINC000768212474 1133113608 /nfs/dbraw/zinc/11/36/08/1133113608.db2.gz JZPRPFVCULZSPM-UHFFFAOYSA-N 1 1 335.831 3.955 20 10 EHCDMO c1ccc(C[C@@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000768226786 1133114713 /nfs/dbraw/zinc/11/47/13/1133114713.db2.gz CLSUWKOENSJOJI-QFIPXVFZSA-N 1 1 336.479 3.730 20 10 EHCDMO Cc1ccccc1C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000768252989 1133117209 /nfs/dbraw/zinc/11/72/09/1133117209.db2.gz TWLSFKLGMXCWBS-UHFFFAOYSA-N 1 1 336.479 3.996 20 10 EHCDMO c1cc2c(cc1CNC1CC[NH+](CC3CCCC3)CC1)CCCO2 ZINC001178412433 1133167555 /nfs/dbraw/zinc/16/75/55/1133167555.db2.gz RUZCLISIRUJSJI-UHFFFAOYSA-N 1 1 328.500 3.756 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)cc1F ZINC000768940036 1133206710 /nfs/dbraw/zinc/20/67/10/1133206710.db2.gz FXRRSHSSPRWVCM-QGZVFWFLSA-N 1 1 344.478 3.785 20 10 EHCDMO CCOc1ccc(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c(O)c1 ZINC000769148608 1133233844 /nfs/dbraw/zinc/23/38/44/1133233844.db2.gz OVACNUMFXCVMIQ-GOSISDBHSA-N 1 1 346.515 3.735 20 10 EHCDMO CN(C)c1cc(F)c(CNC[C@@H]2CC[N@H+]2C2CCCCC2)cc1F ZINC001179173030 1133234335 /nfs/dbraw/zinc/23/43/35/1133234335.db2.gz GJAFPKKUIFWZEV-INIZCTEOSA-N 1 1 337.458 3.527 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]C[C@@H]2CCN2C2CCCCC2)cc1F ZINC001179173030 1133234339 /nfs/dbraw/zinc/23/43/39/1133234339.db2.gz GJAFPKKUIFWZEV-INIZCTEOSA-N 1 1 337.458 3.527 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000773805841 1133236490 /nfs/dbraw/zinc/23/64/90/1133236490.db2.gz HJLKTLYSAZWTNX-NQIIRXRSSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000773805841 1133236496 /nfs/dbraw/zinc/23/64/96/1133236496.db2.gz HJLKTLYSAZWTNX-NQIIRXRSSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000773805841 1133236501 /nfs/dbraw/zinc/23/65/01/1133236501.db2.gz HJLKTLYSAZWTNX-NQIIRXRSSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000773805841 1133236506 /nfs/dbraw/zinc/23/65/06/1133236506.db2.gz HJLKTLYSAZWTNX-NQIIRXRSSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000773805841 1133236512 /nfs/dbraw/zinc/23/65/12/1133236512.db2.gz HJLKTLYSAZWTNX-NQIIRXRSSA-N 1 1 327.516 3.591 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2C[C@H](C)CC[C@H]2C)c1O ZINC000769445624 1133291760 /nfs/dbraw/zinc/29/17/60/1133291760.db2.gz JDBTTZHLJKPEHK-GHMZBOCLSA-N 1 1 328.250 3.784 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 ZINC000769540414 1133300191 /nfs/dbraw/zinc/30/01/91/1133300191.db2.gz OZUWEGKMVLNBIR-IERDGZPVSA-N 1 1 340.442 3.855 20 10 EHCDMO CCc1cccc(C[N@@H+](Cc2ccccc2)[C@H](CO)C(C)C)c1O ZINC001179931585 1133301272 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Cc1ccc(N2CC[N@@H+](Cc3cc(F)ccc3O)[C@@H](C)C2)cc1C ZINC001180167016 1133341668 /nfs/dbraw/zinc/34/16/68/1133341668.db2.gz YXQBVKMWJLBZHR-INIZCTEOSA-N 1 1 328.431 3.859 20 10 EHCDMO COCC[N@H+](Cc1ccc(F)cc1Cl)Cc1cc(F)ccc1O ZINC001180262548 1133353114 /nfs/dbraw/zinc/35/31/14/1133353114.db2.gz YVQZDEQWHJYANY-UHFFFAOYSA-N 1 1 341.785 3.972 20 10 EHCDMO COCC[N@@H+](Cc1ccc(F)cc1Cl)Cc1cc(F)ccc1O ZINC001180262548 1133353119 /nfs/dbraw/zinc/35/31/19/1133353119.db2.gz YVQZDEQWHJYANY-UHFFFAOYSA-N 1 1 341.785 3.972 20 10 EHCDMO O=C(c1cccc2ccccc21)N1CC[NH+](Cc2ccccc2O)CC1 ZINC000770508730 1133436126 /nfs/dbraw/zinc/43/61/26/1133436126.db2.gz GKRAIONYXMTZGS-UHFFFAOYSA-N 1 1 346.430 3.503 20 10 EHCDMO CCC[N@@H+](CCN1CCCCC1)Cc1cc(Cl)cc(OC)c1O ZINC001181687592 1133507760 /nfs/dbraw/zinc/50/77/60/1133507760.db2.gz NKGFISMMGQAKKU-UHFFFAOYSA-N 1 1 340.895 3.752 20 10 EHCDMO CCCN(CC[NH+]1CCCCC1)Cc1cc(Cl)cc(OC)c1O ZINC001181687592 1133507765 /nfs/dbraw/zinc/50/77/65/1133507765.db2.gz NKGFISMMGQAKKU-UHFFFAOYSA-N 1 1 340.895 3.752 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCc2nc3ccccc3n2C)C2CC2)cc1 ZINC000771792461 1133595768 /nfs/dbraw/zinc/59/57/68/1133595768.db2.gz ZMDQSPULVASVIV-UHFFFAOYSA-N 1 1 348.494 3.846 20 10 EHCDMO COCCSCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000785630593 1133734767 /nfs/dbraw/zinc/73/47/67/1133734767.db2.gz IAQKCTSTPQPQPA-UHFFFAOYSA-N 1 1 336.545 3.878 20 10 EHCDMO CCC(CC)C(=O)N1CC[NH+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001182998759 1133756414 /nfs/dbraw/zinc/75/64/14/1133756414.db2.gz CADQLYINCZONLM-UHFFFAOYSA-N 1 1 332.488 3.596 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1nnnn1C1CCCCC1 ZINC000786785574 1133902848 /nfs/dbraw/zinc/90/28/48/1133902848.db2.gz OGUIMOCHHDDCDV-HUUCEWRRSA-N 1 1 342.491 3.656 20 10 EHCDMO Cc1cccc(NCC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)n1 ZINC000788666441 1134159022 /nfs/dbraw/zinc/15/90/22/1134159022.db2.gz BZGCBUSOEDDMPF-LBPRGKRZSA-N 1 1 339.361 3.877 20 10 EHCDMO COc1cccc2c1C[N@H+](Cc1cc(Br)ccc1O)CC2 ZINC001203636025 1134198790 /nfs/dbraw/zinc/19/87/90/1134198790.db2.gz NGQZOMVRVQERPM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cccc2c1C[N@@H+](Cc1cc(Br)ccc1O)CC2 ZINC001203636025 1134198794 /nfs/dbraw/zinc/19/87/94/1134198794.db2.gz NGQZOMVRVQERPM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1c(O)c(C[NH2+]C(C)(C)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000775029012 1134230490 /nfs/dbraw/zinc/23/04/90/1134230490.db2.gz JXSMXKBDCCFKDF-UHFFFAOYSA-N 1 1 344.411 3.810 20 10 EHCDMO CCc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)cc1 ZINC000775035463 1134239455 /nfs/dbraw/zinc/23/94/55/1134239455.db2.gz ZXCUNTJMSIYPJB-UHFFFAOYSA-N 1 1 344.411 3.896 20 10 EHCDMO COc1ccccc1/C=C/C[NH2+]Cc1cccc(Br)c1O ZINC000775152512 1134396862 /nfs/dbraw/zinc/39/68/62/1134396862.db2.gz NIQZPDWQEDEKHJ-VMPITWQZSA-N 1 1 348.240 3.966 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1 ZINC000790715703 1134456981 /nfs/dbraw/zinc/45/69/81/1134456981.db2.gz SDURYTNFFYNZQY-GDBMZVCRSA-N 1 1 347.455 3.711 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@H]1COc2ccccc2O1 ZINC000790977744 1134494930 /nfs/dbraw/zinc/49/49/30/1134494930.db2.gz RVIPFRMQPYOUGQ-NSHDSACASA-N 1 1 337.778 3.504 20 10 EHCDMO COC1(C[NH2+]Cc2cc(C)cc(Br)c2O)CCCCC1 ZINC000775320271 1134624614 /nfs/dbraw/zinc/62/46/14/1134624614.db2.gz CIVAKKZVVHJTGC-UHFFFAOYSA-N 1 1 342.277 3.902 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCSCC[C@@H]2C)c1 ZINC000792195069 1134667299 /nfs/dbraw/zinc/66/72/99/1134667299.db2.gz CGBRMCPYSFUVJN-NSHDSACASA-N 1 1 330.291 3.791 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCSCC[C@@H]2C)c1 ZINC000792195069 1134667300 /nfs/dbraw/zinc/66/73/00/1134667300.db2.gz CGBRMCPYSFUVJN-NSHDSACASA-N 1 1 330.291 3.791 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(CC)cc3)C2)c1 ZINC000792190835 1134666499 /nfs/dbraw/zinc/66/64/99/1134666499.db2.gz VHOULALMOQMYDQ-OAQYLSRUSA-N 1 1 341.451 3.927 20 10 EHCDMO O=C1O[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CC12CCC2 ZINC000792231681 1134669818 /nfs/dbraw/zinc/66/98/18/1134669818.db2.gz MFWKHOFJKKLYSZ-KRWDZBQOSA-N 1 1 329.440 3.623 20 10 EHCDMO CC(C)[N@@H+](CCOC1CCSCC1)Cc1ccc(N(C)C)cc1 ZINC001190447348 1134702875 /nfs/dbraw/zinc/70/28/75/1134702875.db2.gz SVDBBHFVDBFDRL-UHFFFAOYSA-N 1 1 336.545 3.875 20 10 EHCDMO CC[C@H]1C[C@@H]([N@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)CCO1 ZINC001170227993 1134723610 /nfs/dbraw/zinc/72/36/10/1134723610.db2.gz RIBICLMPUSDLMC-GJZGRUSLSA-N 1 1 328.456 3.503 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2C[C@H](C)O[C@]3(CCOC3)C2)cc1 ZINC000793363393 1134910356 /nfs/dbraw/zinc/91/03/56/1134910356.db2.gz UDECBDHATUBOMM-GHTZIAJQSA-N 1 1 346.515 3.693 20 10 EHCDMO Cc1ccc(C[N@@H+](CCO)Cc2cc(-c3ccccc3)ccc2O)o1 ZINC000793366811 1134912972 /nfs/dbraw/zinc/91/29/72/1134912972.db2.gz UJVFALGYDCQUGO-UHFFFAOYSA-N 1 1 337.419 3.955 20 10 EHCDMO C[N@H+](Cc1ccccc1O)Cc1cncc(Br)c1Cl ZINC001250470496 1135015913 /nfs/dbraw/zinc/01/59/13/1135015913.db2.gz NJRDLCOQLJNTCU-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cncc(Br)c1Cl ZINC001250470496 1135015921 /nfs/dbraw/zinc/01/59/21/1135015921.db2.gz NJRDLCOQLJNTCU-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)c1O ZINC000775550149 1135060162 /nfs/dbraw/zinc/06/01/62/1135060162.db2.gz YGQKRYNIRFUAGB-KRWDZBQOSA-N 1 1 349.862 3.859 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+](CCO)C2CCCCC2)c1O ZINC000775632854 1135363005 /nfs/dbraw/zinc/36/30/05/1135363005.db2.gz AYRRANXHYHESRO-UHFFFAOYSA-N 1 1 342.277 3.590 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc3c(c2)OCCO3)c1O ZINC000775644014 1135392284 /nfs/dbraw/zinc/39/22/84/1135392284.db2.gz ZNZAHVMLFHSUCV-UHFFFAOYSA-N 1 1 333.815 3.757 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cccc(Br)c2)c1 ZINC000775648336 1135404665 /nfs/dbraw/zinc/40/46/65/1135404665.db2.gz DZBKEFVGYRJNLZ-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C)c1O ZINC000775698319 1135532682 /nfs/dbraw/zinc/53/26/82/1135532682.db2.gz OPJSKGUSNWXZFY-LBPRGKRZSA-N 1 1 342.867 3.699 20 10 EHCDMO C[N@@H+](CCCCCO)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000809655354 1135865688 /nfs/dbraw/zinc/86/56/88/1135865688.db2.gz BOPBLWMDLBFBHB-UHFFFAOYSA-N 1 1 338.495 3.844 20 10 EHCDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4cc(-c5ccccc5)ccc4O)[C@H]1[C@H]3C2 ZINC000809697374 1135868347 /nfs/dbraw/zinc/86/83/47/1135868347.db2.gz FVTHHVNFLBRKKF-QTOWHEFOSA-N 1 1 335.447 3.914 20 10 EHCDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc(Br)ccc1O ZINC000809701548 1135869990 /nfs/dbraw/zinc/86/99/90/1135869990.db2.gz GQXBJRNIRRIQAW-IUODEOHRSA-N 1 1 342.277 3.670 20 10 EHCDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000809711145 1135875902 /nfs/dbraw/zinc/87/59/02/1135875902.db2.gz LTHFLFFKHVRWOU-QGZVFWFLSA-N 1 1 327.424 3.753 20 10 EHCDMO OC[C@H]1C=C[C@@H]([N@@H+](Cc2cccs2)Cc2cc(F)ccc2O)C1 ZINC000809768836 1135880382 /nfs/dbraw/zinc/88/03/82/1135880382.db2.gz YEQKUSAETJNNCH-XJKSGUPXSA-N 1 1 333.428 3.532 20 10 EHCDMO C[C@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1cc(F)cc(F)c1O ZINC000810253249 1135949201 /nfs/dbraw/zinc/94/92/01/1135949201.db2.gz PSQZQFWDRHQISG-DYZYQPBXSA-N 1 1 339.407 3.871 20 10 EHCDMO Clc1cnn([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000811520748 1136098238 /nfs/dbraw/zinc/09/82/38/1136098238.db2.gz UJOCCNVBUROGGY-IBGZPJMESA-N 1 1 344.890 3.974 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c(O)c1 ZINC000811512141 1136102881 /nfs/dbraw/zinc/10/28/81/1136102881.db2.gz DWXQLQQRWMMQMU-OAQYLSRUSA-N 1 1 339.435 3.761 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cn(C4CCC4)nn3)cc2)CC1 ZINC000850128493 1136213070 /nfs/dbraw/zinc/21/30/70/1136213070.db2.gz CNTBUWCGBOHYAZ-UHFFFAOYSA-N 1 1 339.487 3.529 20 10 EHCDMO OC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(Cl)c1Cl ZINC000850402397 1136249875 /nfs/dbraw/zinc/24/98/75/1136249875.db2.gz IYZCUKIRBAAJBK-OAHLLOKOSA-N 1 1 338.234 3.752 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(N2CCOCC2)c(F)c1 ZINC000850511782 1136273959 /nfs/dbraw/zinc/27/39/59/1136273959.db2.gz NAIKXGMZLUTFQF-OLZOCXBDSA-N 1 1 335.448 3.531 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000850581080 1136292222 /nfs/dbraw/zinc/29/22/22/1136292222.db2.gz CXRUYMRDEOKKDH-CXAGYDPISA-N 1 1 332.463 3.791 20 10 EHCDMO Cc1cc(C[NH2+][C@@H](C(N)=O)c2ccccc2)c(C)n1-c1cccc(C)c1 ZINC000747855085 1136335307 /nfs/dbraw/zinc/33/53/07/1136335307.db2.gz ZROACFCNXAXHHI-OAQYLSRUSA-N 1 1 347.462 3.719 20 10 EHCDMO CSc1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109770215 1136339583 /nfs/dbraw/zinc/33/95/83/1136339583.db2.gz LNYHEFUWWFEBAP-ZDUSSCGKSA-N 1 1 330.453 3.573 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC(=O)Nc2ccccc2)cc1 ZINC000813733092 1136358464 /nfs/dbraw/zinc/35/84/64/1136358464.db2.gz HOWVHAMDXUZZQR-UHFFFAOYSA-N 1 1 339.483 3.993 20 10 EHCDMO CSc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000851716739 1136400771 /nfs/dbraw/zinc/40/07/71/1136400771.db2.gz QEWMPVCNYVQWRD-UHFFFAOYSA-N 1 1 342.508 3.877 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1 ZINC000814175703 1136410620 /nfs/dbraw/zinc/41/06/20/1136410620.db2.gz JPAZZXLGZAEAFS-DOTOQJQBSA-N 1 1 346.471 3.532 20 10 EHCDMO COC[C@H](C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1)OC ZINC000851880077 1136415733 /nfs/dbraw/zinc/41/57/33/1136415733.db2.gz SVUAQRJGZMHTKP-LPHOPBHVSA-N 1 1 329.440 3.617 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]C[C@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000814298439 1136437742 /nfs/dbraw/zinc/43/77/42/1136437742.db2.gz SZKALGGBFBOXHA-HSZRJFAPSA-N 1 1 349.522 3.722 20 10 EHCDMO CCC[N@@H+](CCC(=O)OCc1ccccc1)Cc1ccccc1O ZINC000776589857 1136452923 /nfs/dbraw/zinc/45/29/23/1136452923.db2.gz WMAPBKVOCLUQQM-UHFFFAOYSA-N 1 1 327.424 3.738 20 10 EHCDMO COC1CCN(c2ccc(C[NH2+][C@@H](C)c3cscn3)cc2)CC1 ZINC000852417288 1136454753 /nfs/dbraw/zinc/45/47/53/1136454753.db2.gz ROJNNQQYBYAQOU-AWEZNQCLSA-N 1 1 331.485 3.609 20 10 EHCDMO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC000854225164 1136599584 /nfs/dbraw/zinc/59/95/84/1136599584.db2.gz XEFPJPMWSJZZAK-GDIGMMSISA-N 1 1 328.431 3.636 20 10 EHCDMO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1cccc(C(F)(F)F)c1O ZINC000815555442 1136609815 /nfs/dbraw/zinc/60/98/15/1136609815.db2.gz ZPZPYMXAUDWWAJ-NSHDSACASA-N 1 1 335.329 3.910 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000815593554 1136615907 /nfs/dbraw/zinc/61/59/07/1136615907.db2.gz PXJQIYDONMFSMZ-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO CC(C)[C@H]1CC(=O)N(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000113238871 1136683585 /nfs/dbraw/zinc/68/35/85/1136683585.db2.gz MNBCZAWBKCFYHO-IBGZPJMESA-N 1 1 343.515 3.571 20 10 EHCDMO CC(C)[C@H]1CC(=O)N(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000113238871 1136683589 /nfs/dbraw/zinc/68/35/89/1136683589.db2.gz MNBCZAWBKCFYHO-IBGZPJMESA-N 1 1 343.515 3.571 20 10 EHCDMO CC(=O)N1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)c2ccccc21 ZINC000816559070 1136736570 /nfs/dbraw/zinc/73/65/70/1136736570.db2.gz WFJMNBRGKKYQBY-INIZCTEOSA-N 1 1 348.805 3.772 20 10 EHCDMO CC[C@@H]1C[N@H+](Cc2ccc(N3CCC(OC)CC3)cc2)C[C@H](CC)O1 ZINC000817280364 1136790911 /nfs/dbraw/zinc/79/09/11/1136790911.db2.gz DEZUMMCAJMURRA-BGYRXZFFSA-N 1 1 346.515 3.691 20 10 EHCDMO COc1ccc2c(c1)OC(C)(C)C[N@H+](Cc1cccc(OC)c1O)C2 ZINC000817418588 1136807280 /nfs/dbraw/zinc/80/72/80/1136807280.db2.gz XZGDHMDDNIGLTR-UHFFFAOYSA-N 1 1 343.423 3.583 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000817938745 1136847938 /nfs/dbraw/zinc/84/79/38/1136847938.db2.gz RFHIWOCSRTUEIC-QZTJIDSGSA-N 1 1 345.487 3.718 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Br)ccc1[O-] ZINC000817976815 1136854123 /nfs/dbraw/zinc/85/41/23/1136854123.db2.gz UYMUZNPYXPPWTH-RISCZKNCSA-N 1 1 329.282 3.713 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cn(C(C)C)nn2)c(C)n1-c1cccc(C)c1 ZINC000858292615 1136955554 /nfs/dbraw/zinc/95/55/54/1136955554.db2.gz BQNDVIGKKDGIAD-UHFFFAOYSA-N 1 1 337.471 3.865 20 10 EHCDMO CC[C@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1ccc(F)cc1O ZINC000858451984 1136969107 /nfs/dbraw/zinc/96/91/07/1136969107.db2.gz FUWUDRDKHACKHE-LBPRGKRZSA-N 1 1 331.313 3.525 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1ccc(F)cc1O ZINC000858449954 1136969266 /nfs/dbraw/zinc/96/92/66/1136969266.db2.gz WLFAJQFLMNSHSY-GXTWGEPZSA-N 1 1 331.313 3.572 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC(F)(F)C[C@@H]3C)cc2)CC1 ZINC000859839053 1137033999 /nfs/dbraw/zinc/03/39/99/1137033999.db2.gz ULZQMXCMOKVXPD-HNNXBMFYSA-N 1 1 338.442 3.921 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1F ZINC000822529323 1137062476 /nfs/dbraw/zinc/06/24/76/1137062476.db2.gz CEGDKDBEISCYEQ-IBGZPJMESA-N 1 1 332.463 3.673 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc2cccnc2o1)C[C@H]1CCCO1 ZINC000823386746 1137097490 /nfs/dbraw/zinc/09/74/90/1137097490.db2.gz LMMTVRPACDYPND-QGZVFWFLSA-N 1 1 338.407 3.715 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)Cc2cn[nH]c2)cc1 ZINC000823452556 1137100300 /nfs/dbraw/zinc/10/03/00/1137100300.db2.gz CFPWYHNBNRXKSK-UHFFFAOYSA-N 1 1 326.469 3.740 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc4cccnc4o3)CC2)cc1 ZINC000823418828 1137100800 /nfs/dbraw/zinc/10/08/00/1137100800.db2.gz KHMLBJQQOOVREI-UHFFFAOYSA-N 1 1 337.423 3.549 20 10 EHCDMO CCCO[C@H]1CCC[N@@H+](Cc2c(O)cccc2Br)CC1 ZINC000862242926 1137134578 /nfs/dbraw/zinc/13/45/78/1137134578.db2.gz UQDLFTMBAYHGIO-ZDUSSCGKSA-N 1 1 342.277 3.936 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@H](CO)CC2)cc1 ZINC000824438967 1137137802 /nfs/dbraw/zinc/13/78/02/1137137802.db2.gz DROFQZJXLMXVLM-SFHVURJKSA-N 1 1 344.524 3.979 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c1 ZINC000824690415 1137148534 /nfs/dbraw/zinc/14/85/34/1137148534.db2.gz FIERUXVVTIKFPX-KRWDZBQOSA-N 1 1 335.831 3.610 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000824825955 1137155409 /nfs/dbraw/zinc/15/54/09/1137155409.db2.gz UPRUFZGMMXKMSM-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO Cc1cc(O)c(CNc2cccc(C[NH+]3CCOCC3)c2)cc1Cl ZINC000825003206 1137159741 /nfs/dbraw/zinc/15/97/41/1137159741.db2.gz QHSWBDHVNUSNFP-UHFFFAOYSA-N 1 1 346.858 3.798 20 10 EHCDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3c(O)cccc3OC)C2)c1 ZINC000825289710 1137171844 /nfs/dbraw/zinc/17/18/44/1137171844.db2.gz DWHOYNGHOIKQJM-WKILWMFISA-N 1 1 327.424 3.787 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCO[C@@H](CCF)C1)CCCC3 ZINC000863316430 1137180758 /nfs/dbraw/zinc/18/07/58/1137180758.db2.gz DSOFILCLKGZJPA-ZDUSSCGKSA-N 1 1 333.403 3.578 20 10 EHCDMO CC(C)(C)c1ncc(/C=C\C(=O)N2CC[NH2+]Cc3ccccc32)s1 ZINC000844163878 1137203119 /nfs/dbraw/zinc/20/31/19/1137203119.db2.gz MCDDEEZIEJNQSA-HJWRWDBZSA-N 1 1 341.480 3.590 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cc2n(n1)CCCC2)C1CCCC1 ZINC000844297051 1137209710 /nfs/dbraw/zinc/20/97/10/1137209710.db2.gz MDFKTJOPUQMTTP-UHFFFAOYSA-N 1 1 325.456 3.870 20 10 EHCDMO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000844385960 1137216235 /nfs/dbraw/zinc/21/62/35/1137216235.db2.gz LCGWUMOKGIDRNW-GOSISDBHSA-N 1 1 346.515 3.691 20 10 EHCDMO C[C@H](O)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1F ZINC000846015660 1137325956 /nfs/dbraw/zinc/32/59/56/1137325956.db2.gz ZDDAFBYDQAOXNI-XXFAHNHDSA-N 1 1 327.758 3.536 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@H]1CCc3cc(F)c(F)cc3C1)CCC2 ZINC001171496262 1137491809 /nfs/dbraw/zinc/49/18/09/1137491809.db2.gz NXWDDVROGXYFKN-INIZCTEOSA-N 1 1 345.389 3.682 20 10 EHCDMO COCC[N@@H+](Cc1scnc1C)Cc1cc(Cl)c(C)cc1O ZINC000825720264 1137612663 /nfs/dbraw/zinc/61/26/63/1137612663.db2.gz CVZSAXJLCXJDNQ-UHFFFAOYSA-N 1 1 340.876 3.768 20 10 EHCDMO COc1cc(C[N@@H+](CCO)Cc2ccc(C)o2)c(O)c(C(C)(C)C)c1 ZINC000825752966 1137626098 /nfs/dbraw/zinc/62/60/98/1137626098.db2.gz KXIFRICWEDOLOH-UHFFFAOYSA-N 1 1 347.455 3.594 20 10 EHCDMO CO[C@@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000876511517 1137654397 /nfs/dbraw/zinc/65/43/97/1137654397.db2.gz LEHBTDBKJTUTQL-NRFANRHFSA-N 1 1 346.515 3.550 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc2nccnc2c1)C[C@H]1CCCO1 ZINC000876532084 1137654653 /nfs/dbraw/zinc/65/46/53/1137654653.db2.gz XVQPIQODDQJRFL-GOSISDBHSA-N 1 1 349.434 3.517 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc(OCC(F)(F)F)c1 ZINC000882891924 1137836974 /nfs/dbraw/zinc/83/69/74/1137836974.db2.gz INNFERZNPZCHPJ-UHFFFAOYSA-N 1 1 347.283 3.901 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CCOCC1 ZINC000882997567 1137840994 /nfs/dbraw/zinc/84/09/94/1137840994.db2.gz VHJLOFPCMLTVJI-UHFFFAOYSA-N 1 1 337.341 3.605 20 10 EHCDMO COc1ccc([C@H](OC)[C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000883081689 1137843755 /nfs/dbraw/zinc/84/37/55/1137843755.db2.gz LXTSSKNJQRELGJ-BBATYDOGSA-N 1 1 337.366 3.545 20 10 EHCDMO CC[C@H](CCC(F)(F)F)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883291080 1137852942 /nfs/dbraw/zinc/85/29/42/1137852942.db2.gz RJNNDRQGTGORGO-MRXNPFEDSA-N 1 1 343.437 3.649 20 10 EHCDMO C[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000282913610 1137948821 /nfs/dbraw/zinc/94/88/21/1137948821.db2.gz XLTIQZZBOLSCAQ-MRXNPFEDSA-N 1 1 341.503 3.874 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(C(=O)N2CCCC2)cc1)c1c(O)cccc1F ZINC000886514021 1138087607 /nfs/dbraw/zinc/08/76/07/1138087607.db2.gz CHQSFXFJDXPXPO-AWEZNQCLSA-N 1 1 342.414 3.618 20 10 EHCDMO C[C@H]([NH2+][C@@H](Cc1nccn1C)c1ccccc1)c1c(O)cccc1F ZINC000886535172 1138092252 /nfs/dbraw/zinc/09/22/52/1138092252.db2.gz VXDWANWLRPDGSE-YOEHRIQHSA-N 1 1 339.414 3.899 20 10 EHCDMO COc1ccc(OC(F)F)c(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886538772 1138092817 /nfs/dbraw/zinc/09/28/17/1138092817.db2.gz NRQDONUBTOBFRJ-JTQLQIEISA-N 1 1 341.329 3.992 20 10 EHCDMO CCCOc1ccc(C[N@@H+]2CCO[C@H](c3nc(C)cs3)C2)c(O)c1 ZINC000092790204 1138232046 /nfs/dbraw/zinc/23/20/46/1138232046.db2.gz CSZPLPBZDMYTTF-KRWDZBQOSA-N 1 1 348.468 3.519 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCO[C@H](c3nc(C)cs3)C2)c(O)c1 ZINC000092790204 1138232047 /nfs/dbraw/zinc/23/20/47/1138232047.db2.gz CSZPLPBZDMYTTF-KRWDZBQOSA-N 1 1 348.468 3.519 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1O ZINC000092968751 1138232792 /nfs/dbraw/zinc/23/27/92/1138232792.db2.gz KHRVCQHYNJBXJK-INIZCTEOSA-N 1 1 341.407 3.509 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H](C)c2nncn2C)cc1 ZINC000264231219 1138449145 /nfs/dbraw/zinc/44/91/45/1138449145.db2.gz BDSKTNGEQHWZBP-QGZVFWFLSA-N 1 1 349.482 3.692 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)cc1OC ZINC000179683225 1139775210 /nfs/dbraw/zinc/77/52/10/1139775210.db2.gz LNGMQFXPGKERSS-NSHDSACASA-N 1 1 337.366 3.881 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1C ZINC000180282499 1139824692 /nfs/dbraw/zinc/82/46/92/1139824692.db2.gz QYAFAPOMJRUYGZ-WNSKOXEYSA-N 1 1 331.481 3.939 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1ccc(F)cc1O ZINC000185111766 1140136787 /nfs/dbraw/zinc/13/67/87/1140136787.db2.gz UNYCBBHWTWRKNM-AWEZNQCLSA-N 1 1 342.414 3.899 20 10 EHCDMO COc1cccc(N2CC[C@H](C[NH2+][C@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185312434 1140144622 /nfs/dbraw/zinc/14/46/22/1140144622.db2.gz WFSLNGQUABXDQX-HUUCEWRRSA-N 1 1 344.430 3.717 20 10 EHCDMO COc1cccc(N2CC[C@H](C[NH2+][C@@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185312412 1140144692 /nfs/dbraw/zinc/14/46/92/1140144692.db2.gz WFSLNGQUABXDQX-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccc(N(C)C)cc1 ZINC000186810912 1140222432 /nfs/dbraw/zinc/22/24/32/1140222432.db2.gz GPVVFMMNUDAKRM-AWEZNQCLSA-N 1 1 331.460 3.907 20 10 EHCDMO C[C@@H]([NH2+]CCCNC(=O)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000193014147 1140559615 /nfs/dbraw/zinc/55/96/15/1140559615.db2.gz WAUCIQMELUMXQC-SNVBAGLBSA-N 1 1 345.270 3.656 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Br)ccc2O)s1 ZINC000274285392 1141493265 /nfs/dbraw/zinc/49/32/65/1141493265.db2.gz ZEQGBBGGJMXSMM-HTQZYQBOSA-N 1 1 342.262 3.726 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccccc1-c1nn[nH]n1)C1CCCC1 ZINC000738400838 598620994 /nfs/dbraw/zinc/62/09/94/598620994.db2.gz LOARMRGLHKVNCU-UHFFFAOYSA-N 1 1 349.438 3.517 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccccc3Cl)CC2)c(OC)c1 ZINC001203388462 1016366780 /nfs/dbraw/zinc/36/67/80/1016366780.db2.gz XGBCFQDXFJCCOX-UHFFFAOYSA-N 1 1 346.858 3.679 20 10 EHCDMO COc1cccc(CNC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1O ZINC000377618638 1018073044 /nfs/dbraw/zinc/07/30/44/1018073044.db2.gz BWUHMKCGCKOJFC-YJBOKZPZSA-N 1 1 332.488 3.534 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCSC3(CCCCC3)C2)cc1OC ZINC000160370646 1018621014 /nfs/dbraw/zinc/62/10/14/1018621014.db2.gz PFUKZOVRFFKTQF-UHFFFAOYSA-N 1 1 337.485 3.661 20 10 EHCDMO COc1cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c(O)cc1C ZINC000160406268 1018734376 /nfs/dbraw/zinc/73/43/76/1018734376.db2.gz JDAUUORGPPDJIS-ACJLOTCBSA-N 1 1 333.453 3.733 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1O ZINC000091891078 1032854969 /nfs/dbraw/zinc/85/49/69/1032854969.db2.gz OUPJWZVKHFJSLD-CVEARBPZSA-N 1 1 347.480 3.941 20 10 EHCDMO Cc1cnc(Cl)c(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000891468690 1021701866 /nfs/dbraw/zinc/70/18/66/1021701866.db2.gz VUBLLSQBKUYAHH-QGZVFWFLSA-N 1 1 346.858 3.930 20 10 EHCDMO Cc1cnc(Cl)c(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000891468690 1021701887 /nfs/dbraw/zinc/70/18/87/1021701887.db2.gz VUBLLSQBKUYAHH-QGZVFWFLSA-N 1 1 346.858 3.930 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H](C)c2ncnn2C)cc1 ZINC000276795847 1022952271 /nfs/dbraw/zinc/95/22/71/1022952271.db2.gz YMEDWBCPTABDLU-KRWDZBQOSA-N 1 1 349.482 3.692 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCCCn2cccn2)C2CC2)cc1 ZINC000729542360 1024535804 /nfs/dbraw/zinc/53/58/04/1024535804.db2.gz GWESQVLFIFZSTG-UHFFFAOYSA-N 1 1 326.488 3.784 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCCC[C@@H]2c2nccn2CC)c1O ZINC000281040406 1024587137 /nfs/dbraw/zinc/58/71/37/1024587137.db2.gz GTZMCLOMIBXFQP-MRXNPFEDSA-N 1 1 329.444 3.735 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCC[C@@H]2c2nccn2CC)c1O ZINC000281040406 1024587139 /nfs/dbraw/zinc/58/71/39/1024587139.db2.gz GTZMCLOMIBXFQP-MRXNPFEDSA-N 1 1 329.444 3.735 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895582759 1024644272 /nfs/dbraw/zinc/64/42/72/1024644272.db2.gz LUBRGFBSCFTJHT-SNVBAGLBSA-N 1 1 339.258 3.601 20 10 EHCDMO C[C@@H]1COCC[N@H+]1Cc1c(O)ccc2cc(Br)ccc21 ZINC000025480318 1025075339 /nfs/dbraw/zinc/07/53/39/1025075339.db2.gz ORMRLCIZWDBZPD-LLVKDONJSA-N 1 1 336.229 3.529 20 10 EHCDMO CCC[N@@H+](Cc1nc(-c2ccsc2)no1)Cc1ccccc1O ZINC000109327311 1025705190 /nfs/dbraw/zinc/70/51/90/1025705190.db2.gz UMQMADGEFMYBQL-UHFFFAOYSA-N 1 1 329.425 3.916 20 10 EHCDMO Cc1cc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc(C)[nH+]1 ZINC000301456900 1026812968 /nfs/dbraw/zinc/81/29/68/1026812968.db2.gz HVMIMEHYPYXDCZ-CQSZACIVSA-N 1 1 348.397 3.776 20 10 EHCDMO COCC[C@H]([NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O)c1ccc(C)o1 ZINC000273384701 1027406346 /nfs/dbraw/zinc/40/63/46/1027406346.db2.gz CQRHLCZFOCJOSY-BBRMVZONSA-N 1 1 347.411 3.509 20 10 EHCDMO CC[C@H]([NH2+]CCc1ccc(OC)c(OC)c1)c1ccc(F)cc1O ZINC000796662779 1028808981 /nfs/dbraw/zinc/80/89/81/1028808981.db2.gz HUOOPVCGZRXEDK-INIZCTEOSA-N 1 1 333.403 3.832 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1cn(-c2ccccc2)nn1 ZINC000090450121 1030115160 /nfs/dbraw/zinc/11/51/60/1030115160.db2.gz VTVKSFPNPJDWAX-HZPDHXFCSA-N 1 1 335.455 3.745 20 10 EHCDMO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000278556094 1031368608 /nfs/dbraw/zinc/36/86/08/1031368608.db2.gz ARSYWWOSNXRDJW-HNNXBMFYSA-N 1 1 330.384 3.940 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](Cc1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000796664114 1031717135 /nfs/dbraw/zinc/71/71/35/1031717135.db2.gz UPYCRNIYTSZORA-MJGOQNOKSA-N 1 1 330.447 3.745 20 10 EHCDMO CC(=O)Nc1cccc2c1CC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC000179530566 1031784346 /nfs/dbraw/zinc/78/43/46/1031784346.db2.gz GBKCJNYNKCSNFR-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000179670345 1031799042 /nfs/dbraw/zinc/79/90/42/1031799042.db2.gz ACBKYQWGAPVEOZ-AWEZNQCLSA-N 1 1 338.407 3.922 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000195133555 1032047358 /nfs/dbraw/zinc/04/73/58/1032047358.db2.gz ZFRAFUZPLGEOIB-SJLPKXTDSA-N 1 1 340.467 3.574 20 10 EHCDMO C[N@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)cc(Cl)c3[O-])CC[C@H]21 ZINC000228183235 1034636873 /nfs/dbraw/zinc/63/68/73/1034636873.db2.gz QNAVUQFBUXIXJC-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CCC[C@H]2C[N@H+](Cc3cc(Cl)cc(Cl)c3[O-])CC[C@H]21 ZINC000228183235 1034636883 /nfs/dbraw/zinc/63/68/83/1034636883.db2.gz QNAVUQFBUXIXJC-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CCC[C@H]2C[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])CC[C@H]21 ZINC000228183235 1034636893 /nfs/dbraw/zinc/63/68/93/1034636893.db2.gz QNAVUQFBUXIXJC-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccc(F)cc1O ZINC000363855815 1038698529 /nfs/dbraw/zinc/69/85/29/1038698529.db2.gz BFMLMBSAXHSADQ-CYBMUJFWSA-N 1 1 325.387 3.783 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1O ZINC000323758675 1038920970 /nfs/dbraw/zinc/92/09/70/1038920970.db2.gz UWNKHEVQMRLVAJ-WBMJQRKESA-N 1 1 339.863 3.764 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)c1O ZINC000323758675 1038920985 /nfs/dbraw/zinc/92/09/85/1038920985.db2.gz UWNKHEVQMRLVAJ-WBMJQRKESA-N 1 1 339.863 3.764 20 10 EHCDMO Cn1ccc([C@@H]2CCC[N@@H+](Cc3cc(C(C)(C)C)cc(O)c3O)C2)n1 ZINC000905724418 1039060749 /nfs/dbraw/zinc/06/07/49/1039060749.db2.gz UXKXUMQEQKWERW-CQSZACIVSA-N 1 1 343.471 3.508 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(F)cc1O ZINC000398116718 1041055690 /nfs/dbraw/zinc/05/56/90/1041055690.db2.gz PJSHEZVCZMAJAH-RVKKMQEKSA-N 1 1 328.431 3.845 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1O ZINC000093704344 1042431310 /nfs/dbraw/zinc/43/13/10/1042431310.db2.gz FKBVWZJMWSQEMW-GOSISDBHSA-N 1 1 326.440 3.867 20 10 EHCDMO CC[C@H]([NH2+][C@@H](Cc1ccccc1)CN(C)C)c1ccc(F)cc1O ZINC000796703167 1042509192 /nfs/dbraw/zinc/50/91/92/1042509192.db2.gz SWCQBXFJODLAAC-HKUYNNGSSA-N 1 1 330.447 3.745 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](O)COc1c(C)cccc1C)c1ccc(F)cc1O ZINC000796702962 1042515630 /nfs/dbraw/zinc/51/56/30/1042515630.db2.gz FLJUGRWCFSXYIX-WMZOPIPTSA-N 1 1 347.430 3.629 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(-n2cncn2)cc1 ZINC000184884719 1126707149 /nfs/dbraw/zinc/70/71/49/1126707149.db2.gz GZXZMLDCBLERBZ-STQMWFEESA-N 1 1 326.375 3.524 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2ccccc2SC)ccc1[N+](=O)[O-] ZINC000282154189 1127737863 /nfs/dbraw/zinc/73/78/63/1127737863.db2.gz CWZQGJYVDMAUIY-NSHDSACASA-N 1 1 348.424 3.882 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 ZINC000765855172 1128604744 /nfs/dbraw/zinc/60/47/44/1128604744.db2.gz VDFNFWMEVTWSKD-UONOGXRCSA-N 1 1 331.485 3.700 20 10 EHCDMO C[C@@H]1CCCC[C@H]1OCC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000915360691 1121359013 /nfs/dbraw/zinc/35/90/13/1121359013.db2.gz JXAKUIXKYPFVON-WIYYLYMNSA-N 1 1 346.515 3.550 20 10 EHCDMO Cc1ccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)[nH+]c1 ZINC000916840188 1122366057 /nfs/dbraw/zinc/36/60/57/1122366057.db2.gz ZAPMQRZZKMXRLJ-UHFFFAOYSA-N 1 1 326.400 3.901 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H](O)c2cccc(F)c2)C2CC2)cc1 ZINC000917014029 1122438998 /nfs/dbraw/zinc/43/89/98/1122438998.db2.gz MZXGCLHWBXKTFK-HXUWFJFHSA-N 1 1 328.431 3.590 20 10 EHCDMO COc1ccc(OCC[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000917074177 1122470452 /nfs/dbraw/zinc/47/04/52/1122470452.db2.gz SFHFHKORHZJENM-UHFFFAOYSA-N 1 1 340.467 3.805 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCO[C@@H]3CCCC[C@H]3C)CC2)cc1 ZINC000917088359 1122485464 /nfs/dbraw/zinc/48/54/64/1122485464.db2.gz RORKHKDQUNTYLY-WIYYLYMNSA-N 1 1 346.515 3.803 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000154670006 1122780358 /nfs/dbraw/zinc/78/03/58/1122780358.db2.gz CAFBWIJDBRCADX-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO COc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1O ZINC000154712795 1122801105 /nfs/dbraw/zinc/80/11/05/1122801105.db2.gz LHANYVNBLXOVED-UHFFFAOYSA-N 1 1 339.391 3.902 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccccc2F)cc1 ZINC000155191197 1123307823 /nfs/dbraw/zinc/30/78/23/1123307823.db2.gz XFRKILFYZXVCMM-UHFFFAOYSA-N 1 1 338.430 3.914 20 10 EHCDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000179764088 1123851258 /nfs/dbraw/zinc/85/12/58/1123851258.db2.gz LXXUIHIBHHIZQY-OXQOHEQNSA-N 1 1 340.467 3.872 20 10 EHCDMO CC(C)[N@@H+](C)CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000181583802 1124958102 /nfs/dbraw/zinc/95/81/02/1124958102.db2.gz QPSXGJFHYUUGCZ-QGZVFWFLSA-N 1 1 340.467 3.822 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCS[C@H](C)[C@@H]2C)c1O ZINC000735668112 1131370861 /nfs/dbraw/zinc/37/08/61/1131370861.db2.gz PACHGXOVVGUEOJ-QWHCGFSZSA-N 1 1 345.464 3.658 20 10 EHCDMO CCc1noc([C@@H]2CC[C@H]([NH2+]Cc3c(O)ccc(Cl)c3F)C2)n1 ZINC000922866057 1129694938 /nfs/dbraw/zinc/69/49/38/1129694938.db2.gz ZAHBHYAVHDLHRF-ZJUUUORDSA-N 1 1 339.798 3.556 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1ccc(F)cc1O ZINC000700742695 1130066494 /nfs/dbraw/zinc/06/64/94/1130066494.db2.gz NVZXZIBAQCOBNI-TYNCELHUSA-N 1 1 338.423 3.580 20 10 EHCDMO CCc1cc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)on1 ZINC000766134743 1130382836 /nfs/dbraw/zinc/38/28/36/1130382836.db2.gz HHDOGJXIJHCWIM-ZDUSSCGKSA-N 1 1 349.862 3.578 20 10 EHCDMO O=C(C[N@H+](Cc1ccccc1O)C1CCCC1)NC1CCCCC1 ZINC000731846454 1130849493 /nfs/dbraw/zinc/84/94/93/1130849493.db2.gz ZSVVHXVCWDZYRM-UHFFFAOYSA-N 1 1 330.472 3.586 20 10 EHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)C2=CC(=O)CS2)cc1 ZINC000731869203 1130856481 /nfs/dbraw/zinc/85/64/81/1130856481.db2.gz BQYPDNZBLBLVFR-AWEZNQCLSA-N 1 1 344.480 3.758 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@H](C(=O)OC)C2)c(O)c(C(C)(C)C)c1 ZINC000738055416 1131461916 /nfs/dbraw/zinc/46/19/16/1131461916.db2.gz GYYSJLMXOTYXAR-HNNXBMFYSA-N 1 1 333.472 3.637 20 10 EHCDMO C[C@H]1SCC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1c1ccccc1 ZINC000738259150 1131465059 /nfs/dbraw/zinc/46/50/59/1131465059.db2.gz SVYJEHFQQUDBNT-BFUOFWGJSA-N 1 1 343.448 3.800 20 10 EHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000738284896 1131465672 /nfs/dbraw/zinc/46/56/72/1131465672.db2.gz IZYIQCMPBBTVJC-MRXNPFEDSA-N 1 1 334.419 3.939 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c(C)n1-c1cccc(C)c1 ZINC000741720758 1131637085 /nfs/dbraw/zinc/63/70/85/1131637085.db2.gz WQDUINNJDXNXCF-IBGZPJMESA-N 1 1 339.483 3.569 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOC3(CCCCC3)C2)c1 ZINC000742165601 1131691794 /nfs/dbraw/zinc/69/17/94/1131691794.db2.gz IFEARNXELLBTGX-UHFFFAOYSA-N 1 1 333.472 3.930 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)C[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000743401540 1131913305 /nfs/dbraw/zinc/91/33/05/1131913305.db2.gz BUSNNVNTLLLPQU-HXUWFJFHSA-N 1 1 338.495 3.963 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000743401540 1131913309 /nfs/dbraw/zinc/91/33/09/1131913309.db2.gz BUSNNVNTLLLPQU-HXUWFJFHSA-N 1 1 338.495 3.963 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)N1CCCC[C@H]1CC ZINC000743869860 1131996091 /nfs/dbraw/zinc/99/60/91/1131996091.db2.gz CVINOIIRBJTOHZ-FUHWJXTLSA-N 1 1 332.488 3.784 20 10 EHCDMO CCOC(=O)C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001173654434 1132123503 /nfs/dbraw/zinc/12/35/03/1132123503.db2.gz RYOLKAQGHNELFZ-ICSRJNTNSA-N 1 1 344.499 3.841 20 10 EHCDMO CCOC(=O)C[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C1CCC1 ZINC001169073420 1132652312 /nfs/dbraw/zinc/65/23/12/1132652312.db2.gz ZABSDUNMNXEGAG-UHFFFAOYSA-N 1 1 344.499 3.903 20 10 EHCDMO CCOC(=O)C[N@@H+](Cc1ccc(N2CCCCC2)c(C)c1)C1CCC1 ZINC001169073420 1132652316 /nfs/dbraw/zinc/65/23/16/1132652316.db2.gz ZABSDUNMNXEGAG-UHFFFAOYSA-N 1 1 344.499 3.903 20 10 EHCDMO COc1cc(CNCCC[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001177133556 1133033763 /nfs/dbraw/zinc/03/37/63/1133033763.db2.gz ZAOULOLPAUTQOF-UHFFFAOYSA-N 1 1 334.504 3.664 20 10 EHCDMO COc1cc(C[NH2+]CCCN2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001177133556 1133033770 /nfs/dbraw/zinc/03/37/70/1133033770.db2.gz ZAOULOLPAUTQOF-UHFFFAOYSA-N 1 1 334.504 3.664 20 10 EHCDMO CCc1cc(C[N@H+]2CCS[C@H]3COCC[C@H]32)c(O)c(C(C)(C)C)c1 ZINC000767783291 1133053839 /nfs/dbraw/zinc/05/38/39/1133053839.db2.gz TZTDUJCSYYCWLU-MSOLQXFVSA-N 1 1 349.540 3.958 20 10 EHCDMO CN(C)c1ncc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000768134669 1133100338 /nfs/dbraw/zinc/10/03/38/1133100338.db2.gz SRIRAFLMKAKXKT-UHFFFAOYSA-N 1 1 340.471 3.583 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)c1C ZINC000768179608 1133108809 /nfs/dbraw/zinc/10/88/09/1133108809.db2.gz HEUBUDOEAUQZCM-UHFFFAOYSA-N 1 1 343.446 3.579 20 10 EHCDMO Cc1cccc(NC(=O)C[N@H+](C)Cc2ccc(N(C)C)c(F)c2)c1C ZINC000768179608 1133108811 /nfs/dbraw/zinc/10/88/11/1133108811.db2.gz HEUBUDOEAUQZCM-UHFFFAOYSA-N 1 1 343.446 3.579 20 10 EHCDMO c1coc(CN2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)c1 ZINC000768214007 1133113293 /nfs/dbraw/zinc/11/32/93/1133113293.db2.gz DUQCQZOIMPQKLB-UHFFFAOYSA-N 1 1 339.483 3.588 20 10 EHCDMO Fc1cc(C[N@@H+](Cc2ccccc2)C2CC2)ccc1N1CCOCC1 ZINC000768227704 1133115678 /nfs/dbraw/zinc/11/56/78/1133115678.db2.gz FGEYNAUYEPOZAI-UHFFFAOYSA-N 1 1 340.442 3.827 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000768244262 1133120104 /nfs/dbraw/zinc/12/01/04/1133120104.db2.gz HUGPNINEQSLSOA-AWEZNQCLSA-N 1 1 338.407 3.922 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N(C)C)nc1 ZINC000768357491 1133129534 /nfs/dbraw/zinc/12/95/34/1133129534.db2.gz LPZRZJHNFCQODU-UHFFFAOYSA-N 1 1 326.488 3.624 20 10 EHCDMO C[C@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CN1Cc1ccccc1 ZINC001178109941 1133132588 /nfs/dbraw/zinc/13/25/88/1133132588.db2.gz YVGZEMHJUSXZJB-ZFWWWQNUSA-N 1 1 348.849 3.937 20 10 EHCDMO CCc1ccc(C[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C2CC2)cc1 ZINC000768439159 1133138217 /nfs/dbraw/zinc/13/82/17/1133138217.db2.gz IMOBSFKHMCKQMB-HXUWFJFHSA-N 1 1 339.435 3.545 20 10 EHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OC[C@H]3O)c1C ZINC000768448794 1133140328 /nfs/dbraw/zinc/14/03/28/1133140328.db2.gz XNRCWRFHTOBNLN-AZUAARDMSA-N 1 1 339.435 3.772 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc(OC)c(OC)c2)cc1 ZINC000773733779 1133147498 /nfs/dbraw/zinc/14/74/98/1133147498.db2.gz MOCWOBIYFFAWHH-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO Cc1cc(C[N@H+]2CCOC3(CCOCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000768910593 1133201954 /nfs/dbraw/zinc/20/19/54/1133201954.db2.gz AECLPFXYZFPRMO-UHFFFAOYSA-N 1 1 347.499 3.770 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCOCC2CCCC2)c1 ZINC001178868772 1133205539 /nfs/dbraw/zinc/20/55/39/1133205539.db2.gz VHPOMLXVSVDYEA-UHFFFAOYSA-N 1 1 342.277 3.760 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)C[C@@H]2CCCO2)cc1F ZINC000769045979 1133218157 /nfs/dbraw/zinc/21/81/57/1133218157.db2.gz KRVLLJVNJOBOOD-KRWDZBQOSA-N 1 1 332.419 3.666 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)cc1F ZINC000769045979 1133218161 /nfs/dbraw/zinc/21/81/61/1133218161.db2.gz KRVLLJVNJOBOOD-KRWDZBQOSA-N 1 1 332.419 3.666 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(F)cc(F)c3)CC2)cc1 ZINC000768998987 1133219089 /nfs/dbraw/zinc/21/90/89/1133219089.db2.gz RONHTOQZXNECKA-UHFFFAOYSA-N 1 1 332.394 3.686 20 10 EHCDMO Cc1c2ccccc2n(C)c1CN[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001179193931 1133236924 /nfs/dbraw/zinc/23/69/24/1133236924.db2.gz NBBTURWVDNABBK-KRWDZBQOSA-N 1 1 325.500 3.983 20 10 EHCDMO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCN(C2CCCCC2)C1 ZINC001179193931 1133236931 /nfs/dbraw/zinc/23/69/31/1133236931.db2.gz NBBTURWVDNABBK-KRWDZBQOSA-N 1 1 325.500 3.983 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H](CCC(N)=O)C2)cc1 ZINC000769188223 1133241847 /nfs/dbraw/zinc/24/18/47/1133241847.db2.gz GBZPLRIIADAAAV-GOSISDBHSA-N 1 1 345.531 3.791 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@H](c3ccc(OC)cc3)C2)c(O)c1 ZINC000769236653 1133247684 /nfs/dbraw/zinc/24/76/84/1133247684.db2.gz BVPYXGYLQVSFRZ-INIZCTEOSA-N 1 1 327.424 3.789 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CCC(C)(C)CO2)c1 ZINC001179453559 1133253453 /nfs/dbraw/zinc/25/34/53/1133253453.db2.gz LUWLFUBCSFJJCW-ZDUSSCGKSA-N 1 1 342.277 3.758 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1 ZINC000769317589 1133261028 /nfs/dbraw/zinc/26/10/28/1133261028.db2.gz UFIVIPDHFBLRRC-QGZVFWFLSA-N 1 1 341.407 3.857 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)c1 ZINC000769332158 1133265011 /nfs/dbraw/zinc/26/50/11/1133265011.db2.gz JYSCBQPZMQZKGS-GOSISDBHSA-N 1 1 349.377 3.876 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H](O)C(F)(F)F)cc1F ZINC000769380572 1133273077 /nfs/dbraw/zinc/27/30/77/1133273077.db2.gz GQHHKMMCHVWSEO-HZPDHXFCSA-N 1 1 348.384 3.560 20 10 EHCDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769426101 1133282717 /nfs/dbraw/zinc/28/27/17/1133282717.db2.gz SFOBZGPVYXRJOA-MRXNPFEDSA-N 1 1 340.442 3.782 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000769541425 1133300214 /nfs/dbraw/zinc/30/02/14/1133300214.db2.gz AJHUQVOSAKYQNU-HXUWFJFHSA-N 1 1 325.452 3.924 20 10 EHCDMO CCc1cccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C(C)C)c1O ZINC001179931584 1133301439 /nfs/dbraw/zinc/30/14/39/1133301439.db2.gz OUIWVIKBYHMLGP-FQEVSTJZSA-N 1 1 327.468 3.974 20 10 EHCDMO CCOc1ccc(C[N@H+](Cc2ccccc2)C[C@@H](O)CC)c(O)c1 ZINC000769499256 1133302870 /nfs/dbraw/zinc/30/28/70/1133302870.db2.gz QFVUZZRBCSAHFB-SFHVURJKSA-N 1 1 329.440 3.564 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCCc3c2cnn3C)cc1F ZINC000769538739 1133311705 /nfs/dbraw/zinc/31/17/05/1133311705.db2.gz VXISRCGBHHEJKL-GOSISDBHSA-N 1 1 344.478 3.915 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[S@](=O)C(CC)(CC)C2)cc1 ZINC000769557635 1133314911 /nfs/dbraw/zinc/31/49/11/1133314911.db2.gz RASNTJFTKSCAQI-QHCPKHFHSA-N 1 1 336.545 3.656 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[S@](=O)C(CC)(CC)C2)cc1 ZINC000769557635 1133314914 /nfs/dbraw/zinc/31/49/14/1133314914.db2.gz RASNTJFTKSCAQI-QHCPKHFHSA-N 1 1 336.545 3.656 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c(O)c1 ZINC000769563762 1133315303 /nfs/dbraw/zinc/31/53/03/1133315303.db2.gz PNASZYNARHEMLV-SHACYNPGSA-N 1 1 347.480 3.721 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000770326678 1133411349 /nfs/dbraw/zinc/41/13/49/1133411349.db2.gz QKVYMLUEBFWXBG-YJBOKZPZSA-N 1 1 345.439 3.862 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@](OC)(C(F)(F)F)C2)cc1 ZINC000773889517 1133438960 /nfs/dbraw/zinc/43/89/60/1133438960.db2.gz WLVGTTZQSWNZEO-MRXNPFEDSA-N 1 1 330.394 3.686 20 10 EHCDMO Cn1cc(CC[NH2+]Cc2cc(F)c(F)cc2O)c2ccc(F)cc21 ZINC001181102485 1133451682 /nfs/dbraw/zinc/45/16/82/1133451682.db2.gz NWPYFPAXRYHGNS-UHFFFAOYSA-N 1 1 334.341 3.634 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC001182202463 1133591396 /nfs/dbraw/zinc/59/13/96/1133591396.db2.gz BBHYAXKJRNVLFW-FQEVSTJZSA-N 1 1 332.488 3.615 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000771935179 1133616642 /nfs/dbraw/zinc/61/66/42/1133616642.db2.gz MWVCWXQEYIPCMR-VURMDHGXSA-N 1 1 325.412 3.806 20 10 EHCDMO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163576 1133626167 /nfs/dbraw/zinc/62/61/67/1133626167.db2.gz RZLHKKJBVPVLOL-KOUNCHBCSA-N 1 1 348.490 3.907 20 10 EHCDMO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163576 1133626171 /nfs/dbraw/zinc/62/61/71/1133626171.db2.gz RZLHKKJBVPVLOL-KOUNCHBCSA-N 1 1 348.490 3.907 20 10 EHCDMO C[C@@H]1CN(Cc2ccc(Cl)cc2O)CC[N@H+]1Cc1ccccc1 ZINC001182344966 1133638791 /nfs/dbraw/zinc/63/87/91/1133638791.db2.gz LPJFURHDLVDYKX-OAHLLOKOSA-N 1 1 330.859 3.752 20 10 EHCDMO C[C@@H]([NH2+]CCOc1ncccc1F)c1cc(Cl)c(Cl)cc1O ZINC000774267993 1133650874 /nfs/dbraw/zinc/65/08/74/1133650874.db2.gz BAEMEGSWQRIWKM-SECBINFHSA-N 1 1 345.201 3.963 20 10 EHCDMO CO[C@@H](C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C(F)(F)F ZINC000774291187 1133657440 /nfs/dbraw/zinc/65/74/40/1133657440.db2.gz DDCIPIFGONIBEV-KBUNVGBDSA-N 1 1 332.149 3.927 20 10 EHCDMO CCOC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000774355774 1133669589 /nfs/dbraw/zinc/66/95/89/1133669589.db2.gz MDVWNSBLOMPXIJ-UWVGGRQHSA-N 1 1 347.242 3.580 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c1 ZINC001182520057 1133690921 /nfs/dbraw/zinc/69/09/21/1133690921.db2.gz CWXGLXXYWOIOTE-NRFANRHFSA-N 1 1 325.452 3.781 20 10 EHCDMO CCC[N@@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)[C@@H]1CCN(C)C1 ZINC001182534618 1133698221 /nfs/dbraw/zinc/69/82/21/1133698221.db2.gz XNANVUXENOWDOH-MRXNPFEDSA-N 1 1 343.437 3.688 20 10 EHCDMO CCCN(Cc1ccc(N(C)C)cc1C(F)(F)F)[C@@H]1CC[N@H+](C)C1 ZINC001182534618 1133698225 /nfs/dbraw/zinc/69/82/25/1133698225.db2.gz XNANVUXENOWDOH-MRXNPFEDSA-N 1 1 343.437 3.688 20 10 EHCDMO CCCN(Cc1ccc(N(C)C)cc1C(F)(F)F)[C@@H]1CC[N@@H+](C)C1 ZINC001182534618 1133698227 /nfs/dbraw/zinc/69/82/27/1133698227.db2.gz XNANVUXENOWDOH-MRXNPFEDSA-N 1 1 343.437 3.688 20 10 EHCDMO COC(=O)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)C1CCCCC1 ZINC001183742322 1133852104 /nfs/dbraw/zinc/85/21/04/1133852104.db2.gz ZVJHPNMZHIXJSH-CYBMUJFWSA-N 1 1 343.826 3.644 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1O ZINC000774706400 1133886649 /nfs/dbraw/zinc/88/66/49/1133886649.db2.gz UYOASTFVXJPJHY-NRFANRHFSA-N 1 1 339.435 3.731 20 10 EHCDMO C[NH+]1CCC2(CC[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)CC1 ZINC001203582069 1133890183 /nfs/dbraw/zinc/89/01/83/1133890183.db2.gz PCLFNHUUAZHFNL-UHFFFAOYSA-N 1 1 329.271 3.617 20 10 EHCDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)[C@@H]1C ZINC000787239738 1133983116 /nfs/dbraw/zinc/98/31/16/1133983116.db2.gz CBDSZXKJQUAFKT-OCCSQVGLSA-N 1 1 339.391 3.675 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@H]1CCC2(CCCC2)O1 ZINC000788018291 1134064664 /nfs/dbraw/zinc/06/46/64/1134064664.db2.gz AEMSQGGCHICTDT-RTBURBONSA-N 1 1 345.483 3.865 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000774884265 1134091801 /nfs/dbraw/zinc/09/18/01/1134091801.db2.gz JMBWFJJOLKBGBI-GOSISDBHSA-N 1 1 332.400 3.631 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000774884265 1134091807 /nfs/dbraw/zinc/09/18/07/1134091807.db2.gz JMBWFJJOLKBGBI-GOSISDBHSA-N 1 1 332.400 3.631 20 10 EHCDMO COc1c(O)c(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774884314 1134092546 /nfs/dbraw/zinc/09/25/46/1134092546.db2.gz KJVCCHPSFONVGR-BBRMVZONSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774884314 1134092553 /nfs/dbraw/zinc/09/25/53/1134092553.db2.gz KJVCCHPSFONVGR-BBRMVZONSA-N 1 1 342.395 3.687 20 10 EHCDMO CC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000788257777 1134101530 /nfs/dbraw/zinc/10/15/30/1134101530.db2.gz QATZHYWLMKEGOK-CYBMUJFWSA-N 1 1 328.243 3.716 20 10 EHCDMO Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788584680 1134147678 /nfs/dbraw/zinc/14/76/78/1134147678.db2.gz PILAFMGNADRSQP-SECBINFHSA-N 1 1 327.350 3.612 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@H]2COCc3cccc(Cl)c32)cc1F ZINC000788584726 1134148023 /nfs/dbraw/zinc/14/80/23/1134148023.db2.gz PXCQCCLGIFZLOJ-INIZCTEOSA-N 1 1 334.822 3.906 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1cccc(C(F)(F)F)c1O ZINC000788671664 1134159853 /nfs/dbraw/zinc/15/98/53/1134159853.db2.gz YMANOSJMYKIDBI-TVQRCGJNSA-N 1 1 325.334 3.862 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@]23CCCN(C(=O)OC(C)(C)C)C3)c1O ZINC000788841644 1134181760 /nfs/dbraw/zinc/18/17/60/1134181760.db2.gz VUYGJERQOBGVMZ-FQEVSTJZSA-N 1 1 346.471 3.676 20 10 EHCDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000775027793 1134228983 /nfs/dbraw/zinc/22/89/83/1134228983.db2.gz ISHNUBKRVRJXKO-SFHVURJKSA-N 1 1 330.384 3.724 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000775061104 1134274949 /nfs/dbraw/zinc/27/49/49/1134274949.db2.gz RWNKLABSFYBXKP-HNNXBMFYSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000775061104 1134274956 /nfs/dbraw/zinc/27/49/56/1134274956.db2.gz RWNKLABSFYBXKP-HNNXBMFYSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000775061095 1134274995 /nfs/dbraw/zinc/27/49/95/1134274995.db2.gz RUCWWWGGUVAFAQ-OAHLLOKOSA-N 1 1 342.395 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000775061095 1134275005 /nfs/dbraw/zinc/27/50/05/1134275005.db2.gz RUCWWWGGUVAFAQ-OAHLLOKOSA-N 1 1 342.395 3.607 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@H](COc2ccccc2)C1 ZINC000790467310 1134427057 /nfs/dbraw/zinc/42/70/57/1134427057.db2.gz OARFJWFKASOBCY-IBGZPJMESA-N 1 1 349.430 3.825 20 10 EHCDMO CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790954499 1134484918 /nfs/dbraw/zinc/48/49/18/1134484918.db2.gz UJZGFVUSSCWIGC-AWEZNQCLSA-N 1 1 325.815 3.586 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCN(c2ccccc2)C1 ZINC000790964843 1134486437 /nfs/dbraw/zinc/48/64/37/1134486437.db2.gz OEGUQKSKDDCRLF-CYBMUJFWSA-N 1 1 334.822 3.943 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCSCC[C@@H]2C)c1O ZINC000792195005 1134667453 /nfs/dbraw/zinc/66/74/53/1134667453.db2.gz BAPLIPGWCAPPBF-NSHDSACASA-N 1 1 330.291 3.791 20 10 EHCDMO CCO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792761405 1134786734 /nfs/dbraw/zinc/78/67/34/1134786734.db2.gz MKECWNVVHCUEGY-OAHLLOKOSA-N 1 1 330.394 3.772 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCCO2)c(C(F)(F)F)c1 ZINC000792791189 1134790214 /nfs/dbraw/zinc/79/02/14/1134790214.db2.gz FDVNDTQRJVBXHJ-HNNXBMFYSA-N 1 1 330.394 3.772 20 10 EHCDMO Oc1ccccc1C[N@@H+]1CCOc2c(Br)cccc2C1 ZINC000793227321 1134878612 /nfs/dbraw/zinc/87/86/12/1134878612.db2.gz RIKHEVBRJDCCKK-UHFFFAOYSA-N 1 1 334.213 3.549 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCOc2c(Br)cccc2C1 ZINC000793227321 1134878617 /nfs/dbraw/zinc/87/86/17/1134878617.db2.gz RIKHEVBRJDCCKK-UHFFFAOYSA-N 1 1 334.213 3.549 20 10 EHCDMO C[C@H](CCNC(=O)OC(C)(C)C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000793598736 1134966943 /nfs/dbraw/zinc/96/69/43/1134966943.db2.gz CJIGPUVXCYLTQY-SNVBAGLBSA-N 1 1 346.830 3.578 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)NC(=O)OC(C)(C)C)c1O ZINC000775653629 1135420101 /nfs/dbraw/zinc/42/01/01/1135420101.db2.gz KQTYVLYWGRDGBH-NVXWUHKLSA-N 1 1 348.487 3.968 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCc3ccc(O)cc3C2)c1O ZINC000775655709 1135428135 /nfs/dbraw/zinc/42/81/35/1135428135.db2.gz JYGUENUEHYURDF-UHFFFAOYSA-N 1 1 348.240 3.727 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCc3ccc(O)cc3C2)c1O ZINC000775655709 1135428137 /nfs/dbraw/zinc/42/81/37/1135428137.db2.gz JYGUENUEHYURDF-UHFFFAOYSA-N 1 1 348.240 3.727 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000775666947 1135451461 /nfs/dbraw/zinc/45/14/61/1135451461.db2.gz AVTRMUJHYGMLJD-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000775666947 1135451464 /nfs/dbraw/zinc/45/14/64/1135451464.db2.gz AVTRMUJHYGMLJD-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000775666947 1135451465 /nfs/dbraw/zinc/45/14/65/1135451465.db2.gz AVTRMUJHYGMLJD-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO C[N@H+]1CCCC[C@@H]1CCC(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000806666635 1135482655 /nfs/dbraw/zinc/48/26/55/1135482655.db2.gz PUYASOWJDPITLY-LJQANCHMSA-N 1 1 343.515 3.558 20 10 EHCDMO COCCC[N@@H+](CCc1ccc(OC)cc1)Cc1cccc(C)c1O ZINC000775703690 1135536689 /nfs/dbraw/zinc/53/66/89/1135536689.db2.gz VNKAVCIMEJHZEZ-UHFFFAOYSA-N 1 1 343.467 3.790 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701886 1135539162 /nfs/dbraw/zinc/53/91/62/1135539162.db2.gz OHUVFLGSJSFSFS-SLYNCCJLSA-N 1 1 327.516 3.591 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701886 1135539165 /nfs/dbraw/zinc/53/91/65/1135539165.db2.gz OHUVFLGSJSFSFS-SLYNCCJLSA-N 1 1 327.516 3.591 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1O ZINC000775740352 1135598650 /nfs/dbraw/zinc/59/86/50/1135598650.db2.gz VGXGBWKSPJOHQP-KSSFIOAISA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1O ZINC000775740352 1135598651 /nfs/dbraw/zinc/59/86/51/1135598651.db2.gz VGXGBWKSPJOHQP-KSSFIOAISA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1O ZINC000775740352 1135598654 /nfs/dbraw/zinc/59/86/54/1135598654.db2.gz VGXGBWKSPJOHQP-KSSFIOAISA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1O ZINC000775740352 1135598658 /nfs/dbraw/zinc/59/86/58/1135598658.db2.gz VGXGBWKSPJOHQP-KSSFIOAISA-N 1 1 334.891 3.803 20 10 EHCDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000747465816 1135631149 /nfs/dbraw/zinc/63/11/49/1135631149.db2.gz BFFWHIAUNOHHPT-GDBMZVCRSA-N 1 1 325.408 3.574 20 10 EHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cn(-c3ccccc3)nn2)c1O ZINC000808707058 1135717383 /nfs/dbraw/zinc/71/73/83/1135717383.db2.gz ZLBJJNWHJHGNCC-CYBMUJFWSA-N 1 1 342.830 3.786 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1F ZINC000809767401 1135879646 /nfs/dbraw/zinc/87/96/46/1135879646.db2.gz JYVJMLLHKBIOFR-HKUYNNGSSA-N 1 1 333.495 3.588 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1F ZINC000809767401 1135879649 /nfs/dbraw/zinc/87/96/49/1135879649.db2.gz JYVJMLLHKBIOFR-HKUYNNGSSA-N 1 1 333.495 3.588 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CCn1ccccc1=O)Cc1ccccc1O ZINC000776006965 1135919365 /nfs/dbraw/zinc/91/93/65/1135919365.db2.gz DSHGSEPYIUVSNR-SFHVURJKSA-N 1 1 348.446 3.817 20 10 EHCDMO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc(N2CCCC2)n1 ZINC000810251372 1135948748 /nfs/dbraw/zinc/94/87/48/1135948748.db2.gz RAQDYEYYDSXQCQ-CQSZACIVSA-N 1 1 329.419 3.686 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H](CO)c2cccc(Cl)c2Cl)cc1 ZINC000850402518 1136250013 /nfs/dbraw/zinc/25/00/13/1136250013.db2.gz NABMPRYUKKTNOG-INIZCTEOSA-N 1 1 339.266 3.883 20 10 EHCDMO C[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cc(Br)c(F)cc1O ZINC000850524569 1136277292 /nfs/dbraw/zinc/27/72/92/1136277292.db2.gz HAVVEXJSBJCXMQ-UWVGGRQHSA-N 1 1 344.224 3.656 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1c(F)cccc1F ZINC000850565119 1136286920 /nfs/dbraw/zinc/28/69/20/1136286920.db2.gz ANKNDIRVXWPJSD-CQSZACIVSA-N 1 1 346.421 3.777 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](O)c1cc(F)c(F)c(F)c1)c1ccc(F)cc1O ZINC000850580534 1136292325 /nfs/dbraw/zinc/29/23/25/1136292325.db2.gz OFZYKMIASQCJMX-GOEBONIOSA-N 1 1 343.320 3.723 20 10 EHCDMO CC[C@H](CC(F)F)C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000851733337 1136402258 /nfs/dbraw/zinc/40/22/58/1136402258.db2.gz RPQFWDKBJIEXGW-OAHLLOKOSA-N 1 1 326.431 3.889 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)Cc2occc2C)c1O ZINC000814174277 1136410533 /nfs/dbraw/zinc/41/05/33/1136410533.db2.gz BQTJMYBHMYYBNU-UHFFFAOYSA-N 1 1 340.217 3.697 20 10 EHCDMO Cc1cc(C[N@@H+](C[C@H](O)c2ccc(F)cc2)C2CC2)ccc1N(C)C ZINC000815057469 1136541231 /nfs/dbraw/zinc/54/12/31/1136541231.db2.gz UFMVUSPDNYMZLG-NRFANRHFSA-N 1 1 342.458 3.898 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@@H](CC(F)(F)F)C1 ZINC000853611866 1136549610 /nfs/dbraw/zinc/54/96/10/1136549610.db2.gz YTVHOXXNBFGHCJ-ZDUSSCGKSA-N 1 1 325.330 3.699 20 10 EHCDMO Cc1cc(C[N@@H+]2CCC[C@H](CC(=O)OC(C)C)C2)ccc1N(C)C ZINC000815092603 1136549742 /nfs/dbraw/zinc/54/97/42/1136549742.db2.gz MCMZUCJDMKXIGW-QGZVFWFLSA-N 1 1 332.488 3.615 20 10 EHCDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815099208 1136556304 /nfs/dbraw/zinc/55/63/04/1136556304.db2.gz RWQWTOGUNRCBNU-MRXNPFEDSA-N 1 1 330.394 3.604 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2c(F)cc(F)cc2F)ccc1OC ZINC000815152583 1136557998 /nfs/dbraw/zinc/55/79/98/1136557998.db2.gz RJYMKVNJRKVTHP-UHFFFAOYSA-N 1 1 339.357 3.939 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815580121 1136614043 /nfs/dbraw/zinc/61/40/43/1136614043.db2.gz CNTHTBLQDGQGBK-GXTWGEPZSA-N 1 1 339.357 3.665 20 10 EHCDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)[nH]n1 ZINC000815597050 1136616907 /nfs/dbraw/zinc/61/69/07/1136616907.db2.gz LJFLUYZPNSMSDG-KOLCDFICSA-N 1 1 327.350 3.724 20 10 EHCDMO CCOC(=O)CC[N@H+](Cc1ccc2ccccc2c1O)CC1CC1 ZINC000816497158 1136725482 /nfs/dbraw/zinc/72/54/82/1136725482.db2.gz OOBFLUWQTWIFAK-UHFFFAOYSA-N 1 1 327.424 3.711 20 10 EHCDMO Oc1c(C[N@@H+]2CCO[C@H](COc3ccccc3)C2)ccc2ccccc21 ZINC000816591002 1136735072 /nfs/dbraw/zinc/73/50/72/1136735072.db2.gz QWFFTWIQXJRKMQ-FQEVSTJZSA-N 1 1 349.430 3.825 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@H](COc3ccccc3)C2)ccc2ccccc21 ZINC000816591002 1136735074 /nfs/dbraw/zinc/73/50/74/1136735074.db2.gz QWFFTWIQXJRKMQ-FQEVSTJZSA-N 1 1 349.430 3.825 20 10 EHCDMO [O-]c1c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc2ccccc21 ZINC000816560701 1136736735 /nfs/dbraw/zinc/73/67/35/1136736735.db2.gz XPRLRWZMJKWFFX-UHFFFAOYSA-N 1 1 347.462 3.947 20 10 EHCDMO Oc1c(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)ccc2ccccc21 ZINC000816560295 1136736859 /nfs/dbraw/zinc/73/68/59/1136736859.db2.gz KTESDBSWQAWYOC-OAQYLSRUSA-N 1 1 337.394 3.778 20 10 EHCDMO COCC[C@H](Cc1ccco1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816567590 1136738111 /nfs/dbraw/zinc/73/81/11/1136738111.db2.gz GMRVNMGLCXKCDI-GFCCVEGCSA-N 1 1 327.783 3.515 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000816619425 1136742619 /nfs/dbraw/zinc/74/26/19/1136742619.db2.gz GIRJYDWTARFAKP-HNNXBMFYSA-N 1 1 342.395 3.689 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000816619425 1136742621 /nfs/dbraw/zinc/74/26/21/1136742621.db2.gz GIRJYDWTARFAKP-HNNXBMFYSA-N 1 1 342.395 3.689 20 10 EHCDMO C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643260 1136743687 /nfs/dbraw/zinc/74/36/87/1136743687.db2.gz ZJVQPIVQTYWILA-MRXNPFEDSA-N 1 1 329.271 3.617 20 10 EHCDMO C[N@H+]1CCC[C@@]2(CC[NH+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643260 1136743690 /nfs/dbraw/zinc/74/36/90/1136743690.db2.gz ZJVQPIVQTYWILA-MRXNPFEDSA-N 1 1 329.271 3.617 20 10 EHCDMO C[NH+]1CCC[C@@]2(CC[N@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643260 1136743693 /nfs/dbraw/zinc/74/36/93/1136743693.db2.gz ZJVQPIVQTYWILA-MRXNPFEDSA-N 1 1 329.271 3.617 20 10 EHCDMO C[NH+]1CCC[C@@]2(CC[N@@H+](Cc3cc(Cl)cc(Cl)c3[O-])C2)C1 ZINC000816643260 1136743696 /nfs/dbraw/zinc/74/36/96/1136743696.db2.gz ZJVQPIVQTYWILA-MRXNPFEDSA-N 1 1 329.271 3.617 20 10 EHCDMO FC(F)(F)C[C@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000817413050 1136806122 /nfs/dbraw/zinc/80/61/22/1136806122.db2.gz RRCHTENJYQHFMF-MRXNPFEDSA-N 1 1 342.405 3.688 20 10 EHCDMO CSc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938017 1136847718 /nfs/dbraw/zinc/84/77/18/1136847718.db2.gz BOGPCMRMHQVKKL-LIRRHRJNSA-N 1 1 329.513 3.825 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817938729 1136847888 /nfs/dbraw/zinc/84/78/88/1136847888.db2.gz QZILMPSVNLKVNX-RBUKOAKNSA-N 1 1 329.875 3.683 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000817939237 1136848533 /nfs/dbraw/zinc/84/85/33/1136848533.db2.gz APOJVDIZNMQSKS-PMACEKPBSA-N 1 1 327.447 3.632 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817966457 1136853340 /nfs/dbraw/zinc/85/33/40/1136853340.db2.gz OGKFQMAFQVVSPA-ZBFHGGJFSA-N 1 1 341.293 3.585 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@](C)(C(=O)OC(C)(C)C)C2)ccc1N(C)C ZINC001170892458 1136867697 /nfs/dbraw/zinc/86/76/97/1136867697.db2.gz XCBHERIMASBYNW-FQEVSTJZSA-N 1 1 332.488 3.615 20 10 EHCDMO CC(C)CCNC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000857758567 1136905413 /nfs/dbraw/zinc/90/54/13/1136905413.db2.gz KXFZSUMTUNPGOS-SFHVURJKSA-N 1 1 345.531 3.660 20 10 EHCDMO COC[C@H]([NH2+]Cc1c(O)cccc1Br)c1ccc(C)o1 ZINC000858147894 1136944134 /nfs/dbraw/zinc/94/41/34/1136944134.db2.gz CXZABJHHQVZGOR-ZDUSSCGKSA-N 1 1 340.217 3.533 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491176 1136972890 /nfs/dbraw/zinc/97/28/90/1136972890.db2.gz ZRDNGFAIMUXSIX-CHWSQXEVSA-N 1 1 330.394 3.794 20 10 EHCDMO CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000858513007 1136975219 /nfs/dbraw/zinc/97/52/19/1136975219.db2.gz HSYNBBYTDXYEOP-NSHDSACASA-N 1 1 329.387 3.901 20 10 EHCDMO C[C@H]([NH2+]CC[C@@H](O)COCc1ccccc1)c1ccc(Cl)cc1O ZINC000858595592 1136981495 /nfs/dbraw/zinc/98/14/95/1136981495.db2.gz ROPYKTPZUWHGJN-WMLDXEAASA-N 1 1 349.858 3.664 20 10 EHCDMO COc1nccnc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000823375302 1137096978 /nfs/dbraw/zinc/09/69/78/1137096978.db2.gz JTNYIRBSUYAYEZ-UHFFFAOYSA-N 1 1 327.428 3.526 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)C(=O)NC(C)(C)CC)cc1 ZINC000862023659 1137127168 /nfs/dbraw/zinc/12/71/68/1137127168.db2.gz FSAFDSWURVSPLY-INIZCTEOSA-N 1 1 333.520 3.658 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)C[C@@H](O)C2CC2)cc1 ZINC000824389960 1137136676 /nfs/dbraw/zinc/13/66/76/1137136676.db2.gz XGMNVITWQJQCRM-LJQANCHMSA-N 1 1 330.497 3.587 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000862366258 1137140559 /nfs/dbraw/zinc/14/05/59/1137140559.db2.gz GMJSPWSGDWRNKO-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1F ZINC000862384317 1137141491 /nfs/dbraw/zinc/14/14/91/1137141491.db2.gz VAUFDWHJMDCHQV-POZUXBRTSA-N 1 1 338.442 3.546 20 10 EHCDMO CCn1cc(C[N@H+](Cc2cc(F)c(N(C)C)cc2F)C(C)C)cn1 ZINC000862402512 1137142769 /nfs/dbraw/zinc/14/27/69/1137142769.db2.gz INCCIZXIPRTGJK-UHFFFAOYSA-N 1 1 336.430 3.658 20 10 EHCDMO CCn1cc(C[N@@H+](Cc2cc(F)c(N(C)C)cc2F)C(C)C)cn1 ZINC000862402512 1137142770 /nfs/dbraw/zinc/14/27/70/1137142770.db2.gz INCCIZXIPRTGJK-UHFFFAOYSA-N 1 1 336.430 3.658 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473539 1137146063 /nfs/dbraw/zinc/14/60/63/1137146063.db2.gz VAXLTXZOQVANCA-MNOVXSKESA-N 1 1 328.275 3.625 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@@H]1C ZINC000824821052 1137153995 /nfs/dbraw/zinc/15/39/95/1137153995.db2.gz SSQFNDZHRCPZKR-BLLLJJGKSA-N 1 1 330.394 3.628 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@](C)(c3cccc(F)c3)C2)cc1OC ZINC000844718074 1137247654 /nfs/dbraw/zinc/24/76/54/1137247654.db2.gz LDZAIDPGLPFBIZ-HXUWFJFHSA-N 1 1 345.414 3.712 20 10 EHCDMO C[N@H+](CCc1ccccc1)Cc1cc(Br)c(F)cc1O ZINC001144299447 1137268622 /nfs/dbraw/zinc/26/86/22/1137268622.db2.gz XAWITGFXNOXKGK-UHFFFAOYSA-N 1 1 338.220 3.968 20 10 EHCDMO C[N@@H+](CCc1ccccc1)Cc1cc(Br)c(F)cc1O ZINC001144299447 1137268623 /nfs/dbraw/zinc/26/86/23/1137268623.db2.gz XAWITGFXNOXKGK-UHFFFAOYSA-N 1 1 338.220 3.968 20 10 EHCDMO CC[N@@H+](Cc1ccc(OCC(F)(F)F)nc1)Cc1ccccc1O ZINC001144356305 1137277933 /nfs/dbraw/zinc/27/79/33/1137277933.db2.gz NFCOSAJJWIKGTB-UHFFFAOYSA-N 1 1 340.345 3.750 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)c(OC)cc1F ZINC000845906875 1137319536 /nfs/dbraw/zinc/31/95/36/1137319536.db2.gz NEXWDFJJOWETJI-UHFFFAOYSA-N 1 1 333.403 3.961 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000845973322 1137322609 /nfs/dbraw/zinc/32/26/09/1137322609.db2.gz YZUQNXNJBNRMDQ-SECBINFHSA-N 1 1 325.767 3.750 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@](O)(c3ccc(Cl)cc3)C2)c1 ZINC000846010571 1137325795 /nfs/dbraw/zinc/32/57/95/1137325795.db2.gz FQYVEPBDDMCHOP-LJQANCHMSA-N 1 1 347.842 3.538 20 10 EHCDMO C[C@H](O)[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1F ZINC000846015654 1137326147 /nfs/dbraw/zinc/32/61/47/1137326147.db2.gz ZDDAFBYDQAOXNI-FVMDXXJSSA-N 1 1 327.758 3.536 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000846052192 1137330738 /nfs/dbraw/zinc/33/07/38/1137330738.db2.gz MDZFFFYLQIZUQA-QGZVFWFLSA-N 1 1 347.459 3.586 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@@]3(CCCOC3)C2)cc1C(C)C ZINC000794903636 1137332662 /nfs/dbraw/zinc/33/26/62/1137332662.db2.gz VCXPGKDLHAEYIU-UZLBHIALSA-N 1 1 333.472 3.594 20 10 EHCDMO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1ccccc1F ZINC000846182901 1137340217 /nfs/dbraw/zinc/34/02/17/1137340217.db2.gz LGEBBSCVXAKHAU-YNHOBRIKSA-N 1 1 325.330 3.582 20 10 EHCDMO Cc1cc(C(=O)N[C@H]2CCC[N@H+](C)C2)c(C)n1-c1ccc(Cl)cc1 ZINC001144808419 1137351432 /nfs/dbraw/zinc/35/14/32/1137351432.db2.gz VHVAIEQQRDQHFS-INIZCTEOSA-N 1 1 345.874 3.572 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000866407880 1137352487 /nfs/dbraw/zinc/35/24/87/1137352487.db2.gz YOVSKOIWVGBGLA-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1ccc(F)cc1O ZINC000866423112 1137353476 /nfs/dbraw/zinc/35/34/76/1137353476.db2.gz NARHMBUZRZMMIJ-SFHVURJKSA-N 1 1 345.414 3.992 20 10 EHCDMO CC1(C)C[C@@H](NCc2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001171982677 1137526490 /nfs/dbraw/zinc/52/64/90/1137526490.db2.gz JOVHMRMSPWZVPE-SFHVURJKSA-N 1 1 340.467 3.631 20 10 EHCDMO COCC(C)(C)CC[NH2+]Cc1cc(C)cc(Br)c1O ZINC000873153070 1137591529 /nfs/dbraw/zinc/59/15/29/1137591529.db2.gz XBFDDWIXLAFYLY-UHFFFAOYSA-N 1 1 330.266 3.615 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1Cl ZINC000825752450 1137624922 /nfs/dbraw/zinc/62/49/22/1137624922.db2.gz AWLOQQVQACJIEM-GLJUWKHASA-N 1 1 339.863 3.512 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC4C[C@@H]5CC3C[C@H](C4)C5)cc2)CC1 ZINC000876635072 1137657746 /nfs/dbraw/zinc/65/77/46/1137657746.db2.gz LEQAIXSUNUQSCB-FUUYNRHESA-N 1 1 340.511 3.658 20 10 EHCDMO Cc1[nH+]cc(CN(Cc2ccco2)Cc2ccc(N(C)C)cc2)n1C ZINC000825903693 1137661670 /nfs/dbraw/zinc/66/16/70/1137661670.db2.gz OMIRBQLAYYKBOP-UHFFFAOYSA-N 1 1 338.455 3.590 20 10 EHCDMO CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(F)c(F)c2[O-])c1 ZINC000876980299 1137666785 /nfs/dbraw/zinc/66/67/85/1137666785.db2.gz CPGQSNMQSVCEEV-UHFFFAOYSA-N 1 1 334.410 3.800 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@]2(C)CCCO)c(O)c(C(C)(C)C)c1 ZINC000825928039 1137667441 /nfs/dbraw/zinc/66/74/41/1137667441.db2.gz KYAHDFAYWSSONZ-HXUWFJFHSA-N 1 1 335.488 3.825 20 10 EHCDMO OC1CCN(c2ccc(C[N@@H+](CC3CC3)CC3CCC3)cc2)CC1 ZINC000877493683 1137678368 /nfs/dbraw/zinc/67/83/68/1137678368.db2.gz OSEKKMZKKANEIU-UHFFFAOYSA-N 1 1 328.500 3.660 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)c(O)c1 ZINC000877498064 1137678773 /nfs/dbraw/zinc/67/87/73/1137678773.db2.gz JPXYPDDKMFDQCP-QGZVFWFLSA-N 1 1 325.456 3.613 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C3CCC3)cc2)CC1 ZINC000877607908 1137682659 /nfs/dbraw/zinc/68/26/59/1137682659.db2.gz JGTAUTMNOXQIFT-OAQYLSRUSA-N 1 1 328.500 3.802 20 10 EHCDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccc(F)cc1 ZINC000877665672 1137684868 /nfs/dbraw/zinc/68/48/68/1137684868.db2.gz DMTHIPWSSWVPMZ-SFHVURJKSA-N 1 1 348.374 3.863 20 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/nfs/dbraw/zinc/84/53/02/1137845302.db2.gz NVHYQKUHHBOGNW-CQSZACIVSA-N 1 1 347.283 3.512 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1OCCc2sccc21 ZINC000883127541 1137845586 /nfs/dbraw/zinc/84/55/86/1137845586.db2.gz XUYGECCHPIURSW-JDNHERCYSA-N 1 1 325.380 3.524 20 10 EHCDMO C[C@H]([NH2+]C[C@H](CO)Cc1ccoc1)c1cccc(C(F)(F)F)c1O ZINC000883276201 1137851985 /nfs/dbraw/zinc/85/19/85/1137851985.db2.gz HOOYOXVXKZEADF-WCQYABFASA-N 1 1 343.345 3.506 20 10 EHCDMO Oc1cccc2c1[C@@H](Nc1ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc1)CC2 ZINC000883347514 1137856571 /nfs/dbraw/zinc/85/65/71/1137856571.db2.gz UEHXKNRJGSDZTK-UXHICEINSA-N 1 1 349.478 3.776 20 10 EHCDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cs1 ZINC000109761961 1137897218 /nfs/dbraw/zinc/89/72/18/1137897218.db2.gz ZNZXUWIUMAKLLV-OAHLLOKOSA-N 1 1 348.424 3.543 20 10 EHCDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)cs1 ZINC000109761961 1137897219 /nfs/dbraw/zinc/89/72/19/1137897219.db2.gz ZNZXUWIUMAKLLV-OAHLLOKOSA-N 1 1 348.424 3.543 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H]([C@@H]4CCCO4)C3)c2c1 ZINC000884483267 1137960974 /nfs/dbraw/zinc/96/09/74/1137960974.db2.gz QMETYIMRDDAYTA-YWZLYKJASA-N 1 1 327.424 3.555 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1c(O)cccc1F ZINC000886512273 1138087230 /nfs/dbraw/zinc/08/72/30/1138087230.db2.gz BEYBTDNNDSVQIM-SNVBAGLBSA-N 1 1 337.778 3.807 20 10 EHCDMO COc1ccccc1N1CC[C@H](C[NH2+][C@@H](C)c2c(O)cccc2F)C1 ZINC000886519360 1138089103 /nfs/dbraw/zinc/08/91/03/1138089103.db2.gz TWUUEMOCPMDCQD-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO COC(=O)CC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886545129 1138094091 /nfs/dbraw/zinc/09/40/91/1138094091.db2.gz HJJAOCMTZHZQLO-XJKSGUPXSA-N 1 1 331.387 3.876 20 10 EHCDMO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1c(O)cccc1F ZINC000886615450 1138102437 /nfs/dbraw/zinc/10/24/37/1138102437.db2.gz GQQRZFXNDNFTRB-JTQLQIEISA-N 1 1 328.309 3.838 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1c(O)cccc1F ZINC000886644757 1138105415 /nfs/dbraw/zinc/10/54/15/1138105415.db2.gz JYDWKNCGKQQYLB-TZOQJCELSA-N 1 1 337.341 3.990 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000826534449 1138195433 /nfs/dbraw/zinc/19/54/33/1138195433.db2.gz GLGKTBKDRVZWTI-OAHLLOKOSA-N 1 1 340.261 3.688 20 10 EHCDMO CCOc1cccc(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)c1O ZINC000092436664 1138228036 /nfs/dbraw/zinc/22/80/36/1138228036.db2.gz AAJLWANVVJOEQT-QGZVFWFLSA-N 1 1 331.412 3.565 20 10 EHCDMO COc1cccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1O ZINC000121875275 1138251709 /nfs/dbraw/zinc/25/17/09/1138251709.db2.gz LNHMIRDPCKZZFA-UHFFFAOYSA-N 1 1 336.775 3.594 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1O ZINC000121875275 1138251711 /nfs/dbraw/zinc/25/17/11/1138251711.db2.gz LNHMIRDPCKZZFA-UHFFFAOYSA-N 1 1 336.775 3.594 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc(COC)o2)c1 ZINC000137071117 1138831697 /nfs/dbraw/zinc/83/16/97/1138831697.db2.gz RSTUSSNGYUYGIF-KRWDZBQOSA-N 1 1 331.412 3.867 20 10 EHCDMO Cn1cc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)c(C(F)(F)F)n1 ZINC000138041278 1138885157 /nfs/dbraw/zinc/88/51/57/1138885157.db2.gz ZPVNFCMXUHIKFC-UHFFFAOYSA-N 1 1 349.356 3.930 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCCN(CC(F)(F)F)CC1 ZINC000151787458 1139056683 /nfs/dbraw/zinc/05/66/83/1139056683.db2.gz SOJZLYLZAYAUIA-UHFFFAOYSA-N 1 1 338.373 3.615 20 10 EHCDMO CC(=O)c1cc(F)cc(C[NH2+][C@@H](COCC(C)C)c2ccco2)c1O ZINC000184196579 1140086796 /nfs/dbraw/zinc/08/67/96/1140086796.db2.gz VAWDWEWKFIHVMV-KRWDZBQOSA-N 1 1 349.402 3.830 20 10 EHCDMO C[N@@H+](Cc1ccccc1N1CCOCC1)Cc1c(O)cccc1Cl ZINC000271034179 1141297626 /nfs/dbraw/zinc/29/76/26/1141297626.db2.gz JSJLBKAPEWLZFP-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1OC ZINC000271072415 1141304648 /nfs/dbraw/zinc/30/46/48/1141304648.db2.gz FQCPLDHVIBZNPL-CQSZACIVSA-N 1 1 331.387 3.538 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)c(O)c1 ZINC000271274379 1141337265 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CC1(C)C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC[C@H]1O ZINC000275996585 1020144889 /nfs/dbraw/zinc/14/48/89/1020144889.db2.gz OIBOQCLZOHIVBK-HXUWFJFHSA-N 1 1 341.451 3.564 20 10 EHCDMO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc(C)cc(OC)c1O ZINC000894643954 1022659745 /nfs/dbraw/zinc/65/97/45/1022659745.db2.gz JAFRYQYMLBQVHE-MRXNPFEDSA-N 1 1 329.444 3.653 20 10 EHCDMO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC000894643954 1022659746 /nfs/dbraw/zinc/65/97/46/1022659746.db2.gz JAFRYQYMLBQVHE-MRXNPFEDSA-N 1 1 329.444 3.653 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3C)C2)c(O)c1OC ZINC000891870549 1023155763 /nfs/dbraw/zinc/15/57/63/1023155763.db2.gz CLVOSKKCVMHQGL-HNNXBMFYSA-N 1 1 327.424 3.707 20 10 EHCDMO Oc1ccccc1C[N@@H+](C1CCCC1)[C@H]1CCC2(C[C@H]1F)OCCO2 ZINC000892011944 1024329325 /nfs/dbraw/zinc/32/93/25/1024329325.db2.gz IONOIEMSWSOIJX-MSOLQXFVSA-N 1 1 349.446 3.771 20 10 EHCDMO Cn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c(C2CC2)n1 ZINC000892011747 1024343680 /nfs/dbraw/zinc/34/36/80/1024343680.db2.gz 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CCOc1ccc(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c(O)c1 ZINC000770350934 1133419171 /nfs/dbraw/zinc/41/91/71/1133419171.db2.gz QRAMLNFVMSKUDN-VBKZILBWSA-N 1 1 327.424 3.615 20 10 EHCDMO COC(=O)CCC[N@@H+](Cc1ccccc1)Cc1cc(C)ccc1O ZINC000770353421 1133420572 /nfs/dbraw/zinc/42/05/72/1133420572.db2.gz ZYGMRCQINJCFAU-UHFFFAOYSA-N 1 1 327.424 3.656 20 10 EHCDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001181234579 1133472607 /nfs/dbraw/zinc/47/26/07/1133472607.db2.gz MEGPOGXPFAUNOR-GIWCCYDRSA-N 1 1 344.499 3.677 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nc(-c2cccnc2)no1 ZINC000774486716 1133689104 /nfs/dbraw/zinc/68/91/04/1133689104.db2.gz YHQFVNINCZVEBU-KBPBESRZSA-N 1 1 337.427 3.609 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCN(C2CCCCC2)C1=O)c1ccc(F)cc1O ZINC000785572387 1133728835 /nfs/dbraw/zinc/72/88/35/1133728835.db2.gz ZVMPHGLFDCPOMM-SUMWQHHRSA-N 1 1 334.435 3.506 20 10 EHCDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(O)cccc1OC ZINC000787330898 1133989524 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3.800 20 10 EHCDMO C[C@@](O)(C[NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(Cl)c1 ZINC000790990076 1134489330 /nfs/dbraw/zinc/48/93/30/1134489330.db2.gz IICYNJZPKKLHIR-MRXNPFEDSA-N 1 1 344.213 3.835 20 10 EHCDMO CCC[C@]1(COC)CCC[N@@H+]1Cc1cccc(Br)c1O ZINC000775203483 1134512590 /nfs/dbraw/zinc/51/25/90/1134512590.db2.gz LDEJQETZEVIPLV-MRXNPFEDSA-N 1 1 342.277 3.936 20 10 EHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cccc(Br)c1O ZINC000775203483 1134512596 /nfs/dbraw/zinc/51/25/96/1134512596.db2.gz LDEJQETZEVIPLV-MRXNPFEDSA-N 1 1 342.277 3.936 20 10 EHCDMO CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1cc(Br)c(F)cc1[O-] ZINC000756396212 1134630689 /nfs/dbraw/zinc/63/06/89/1134630689.db2.gz HQPRDELKWKINPB-LLVKDONJSA-N 1 1 347.272 3.675 20 10 EHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@H]1OCCc2ccccc21 ZINC000792167381 1134661106 /nfs/dbraw/zinc/66/11/06/1134661106.db2.gz RGRXSVCDFCHTHV-QGZVFWFLSA-N 1 1 335.806 3.931 20 10 EHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@H]1OCCc2ccccc21 ZINC000792167381 1134661107 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EHCDMO CN(C)c1ccc(CN[C@H]2CCC[C@@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002793 1134837336 /nfs/dbraw/zinc/83/73/36/1134837336.db2.gz BWOBXWKYKPAFCE-LSDHHAIUSA-N 1 1 343.437 3.734 20 10 EHCDMO CN(C)c1ccc(CN[C@@H]2CCC[C@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002779 1134837441 /nfs/dbraw/zinc/83/74/41/1134837441.db2.gz BWOBXWKYKPAFCE-CABCVRRESA-N 1 1 343.437 3.734 20 10 EHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cccc(Br)c1O ZINC000793231324 1134879764 /nfs/dbraw/zinc/87/97/64/1134879764.db2.gz MILXBZJZAWJAQO-WCBMZHEXSA-N 1 1 338.167 3.927 20 10 EHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cccc(Br)c1O ZINC000793231324 1134879770 /nfs/dbraw/zinc/87/97/70/1134879770.db2.gz MILXBZJZAWJAQO-WCBMZHEXSA-N 1 1 338.167 3.927 20 10 EHCDMO COC1(C[NH2+]Cc2cccc(Br)c2O)CCC(C)CC1 ZINC000793290795 1134895911 /nfs/dbraw/zinc/89/59/11/1134895911.db2.gz HNSNRDBKPDHSFE-UHFFFAOYSA-N 1 1 342.277 3.840 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCCN(c3ccc(F)c(F)c3)CC2)c1 ZINC000793606371 1134969154 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OC[C@]1(Cc2ccccc2)CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000812780244 1136246913 /nfs/dbraw/zinc/24/69/13/1136246913.db2.gz XQIHSISODCTJKT-FQEVSTJZSA-N 1 1 345.870 3.863 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccc(N2CCCCC2)cc1 ZINC000850498888 1136272075 /nfs/dbraw/zinc/27/20/75/1136272075.db2.gz FGMLYYPLDHLZSS-VKJFTORMSA-N 1 1 325.460 3.625 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000813791964 1136362722 /nfs/dbraw/zinc/36/27/22/1136362722.db2.gz MUTKCGLVPZTOHA-NSHDSACASA-N 1 1 338.785 3.692 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239247 1136520677 /nfs/dbraw/zinc/52/06/77/1136520677.db2.gz CVASQHFETAXGTJ-MJGOQNOKSA-N 1 1 329.532 3.915 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000853239247 1136520681 /nfs/dbraw/zinc/52/06/81/1136520681.db2.gz CVASQHFETAXGTJ-MJGOQNOKSA-N 1 1 329.532 3.915 20 10 EHCDMO Cc1sc2nc([C@H](C)[N@H+](C)Cc3ccccc3O)nc(N)c2c1C ZINC000111235085 1136524767 /nfs/dbraw/zinc/52/47/67/1136524767.db2.gz XUHNGHNFSZFECN-NSHDSACASA-N 1 1 342.468 3.789 20 10 EHCDMO Cc1sc2nc([C@H](C)[N@@H+](C)Cc3ccccc3O)nc(N)c2c1C ZINC000111235085 1136524769 /nfs/dbraw/zinc/52/47/69/1136524769.db2.gz XUHNGHNFSZFECN-NSHDSACASA-N 1 1 342.468 3.789 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(=O)oc2cc3c(cc12)CCC3 ZINC000111236129 1136525234 /nfs/dbraw/zinc/52/52/34/1136525234.db2.gz ULGPGDWLXRJZNH-UHFFFAOYSA-N 1 1 335.403 3.619 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@H]1c1ccco1)[C@@H](O)CO2 ZINC000853538698 1136542073 /nfs/dbraw/zinc/54/20/73/1136542073.db2.gz JFGGTWAPCGCYHQ-QFBILLFUSA-N 1 1 341.407 3.528 20 10 EHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)cc1F ZINC000853562346 1136544220 /nfs/dbraw/zinc/54/42/20/1136544220.db2.gz LUZAHBKQFSVJPY-OAHLLOKOSA-N 1 1 345.370 3.606 20 10 EHCDMO CCc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)nc1 ZINC000815069902 1136546712 /nfs/dbraw/zinc/54/67/12/1136546712.db2.gz HYKHXIRQRRWVCJ-LJQANCHMSA-N 1 1 326.440 3.531 20 10 EHCDMO Oc1ccc2cc(Br)ccc2c1C[N@H+]1CCC2(COC2)C1 ZINC000853595806 1136547784 /nfs/dbraw/zinc/54/77/84/1136547784.db2.gz XMMKVPBSYGFTOF-UHFFFAOYSA-N 1 1 348.240 3.530 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@H](CC(F)(F)F)C1 ZINC000853611865 1136549781 /nfs/dbraw/zinc/54/97/81/1136549781.db2.gz YTVHOXXNBFGHCJ-CYBMUJFWSA-N 1 1 325.330 3.699 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000816494331 1136724437 /nfs/dbraw/zinc/72/44/37/1136724437.db2.gz HGCOCKVZMBQSID-AWEZNQCLSA-N 1 1 326.843 3.635 20 10 EHCDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816499500 1136727700 /nfs/dbraw/zinc/72/77/00/1136727700.db2.gz RXOQIEYSJWLQGB-MRXNPFEDSA-N 1 1 340.467 3.530 20 10 EHCDMO Cc1nc2ccccc2n1CC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816530742 1136730780 /nfs/dbraw/zinc/73/07/80/1136730780.db2.gz SWYLZDZHQGXPRX-UHFFFAOYSA-N 1 1 333.794 3.633 20 10 EHCDMO Oc1c(C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)ccc2ccccc21 ZINC000816522248 1136732942 /nfs/dbraw/zinc/73/29/42/1136732942.db2.gz QIKLMIHVZSSURM-KRWDZBQOSA-N 1 1 348.450 3.921 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCN(Cc2ccccc2)C1 ZINC000816529369 1136734113 /nfs/dbraw/zinc/73/41/13/1136734113.db2.gz QGWGHLLLDFOGRR-OAHLLOKOSA-N 1 1 334.822 3.549 20 10 EHCDMO Oc1c(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)ccc2ccccc21 ZINC000816609322 1136741070 /nfs/dbraw/zinc/74/10/70/1136741070.db2.gz XTBVSJRTMNMZQD-QGZVFWFLSA-N 1 1 339.357 3.825 20 10 EHCDMO COCCC[N@@H+](Cc1ccncc1)Cc1ccc2ccccc2c1O ZINC000816610372 1136741185 /nfs/dbraw/zinc/74/11/85/1136741185.db2.gz IMHGVEYHAQYTJW-UHFFFAOYSA-N 1 1 336.435 3.979 20 10 EHCDMO CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000817957438 1136851615 /nfs/dbraw/zinc/85/16/15/1136851615.db2.gz CIBQRCJHSQVBKL-GXSJLCMTSA-N 1 1 349.700 3.832 20 10 EHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000817938994 1136848484 /nfs/dbraw/zinc/84/84/84/1136848484.db2.gz XFNHMXJURIIHCN-GUYCJALGSA-N 1 1 349.425 3.705 20 10 EHCDMO CC[C@H]([NH2+]CCC[NH2+]C(C)C)c1cc(Br)ccc1[O-] ZINC000817953613 1136850866 /nfs/dbraw/zinc/85/08/66/1136850866.db2.gz PMHMTVVNIWBFGM-AWEZNQCLSA-N 1 1 329.282 3.584 20 10 EHCDMO Nc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000817956937 1136851565 /nfs/dbraw/zinc/85/15/65/1136851565.db2.gz GGKMPKZGYNUHBV-DKUWSORSSA-N 1 1 335.495 3.597 20 10 EHCDMO CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817966455 1136853293 /nfs/dbraw/zinc/85/32/93/1136853293.db2.gz OGKFQMAFQVVSPA-GOEBONIOSA-N 1 1 341.293 3.585 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1[O-] ZINC000817975386 1136854428 /nfs/dbraw/zinc/85/44/28/1136854428.db2.gz MNSJWTPKRCWXOY-AVGNSLFASA-N 1 1 341.293 3.570 20 10 EHCDMO C[C@H]([NH2+]C[C@@]1(C)COc2ccccc2O1)c1cc(F)cc(F)c1O ZINC000858447879 1136968763 /nfs/dbraw/zinc/96/87/63/1136968763.db2.gz XSAZDWVNSNQZCX-VOJFVSQTSA-N 1 1 335.350 3.551 20 10 EHCDMO COC(=O)C1=CC[C@H]([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858471849 1136971011 /nfs/dbraw/zinc/97/10/11/1136971011.db2.gz FLHLXORWIYDGRI-SCZZXKLOSA-N 1 1 330.211 3.611 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491177 1136972831 /nfs/dbraw/zinc/97/28/31/1136972831.db2.gz ZRDNGFAIMUXSIX-OLZOCXBDSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491178 1136973020 /nfs/dbraw/zinc/97/30/20/1136973020.db2.gz ZRDNGFAIMUXSIX-QWHCGFSZSA-N 1 1 330.394 3.794 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H](O)c1ccc(F)cc1 ZINC000822179759 1137051724 /nfs/dbraw/zinc/05/17/24/1137051724.db2.gz CNOOQCSYEKIZBB-OAQYLSRUSA-N 1 1 342.458 3.981 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822529283 1137062564 /nfs/dbraw/zinc/06/25/64/1137062564.db2.gz BVYOJZOYHPTQHH-HXUWFJFHSA-N 1 1 328.500 3.842 20 10 EHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CCN1C ZINC000823955397 1137119225 /nfs/dbraw/zinc/11/92/25/1137119225.db2.gz KPYBWLVWBULAAF-WMZOPIPTSA-N 1 1 343.540 3.957 20 10 EHCDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CCN1C ZINC000823955395 1137119238 /nfs/dbraw/zinc/11/92/38/1137119238.db2.gz KPYBWLVWBULAAF-FUHWJXTLSA-N 1 1 343.540 3.957 20 10 EHCDMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000824120197 1137125008 /nfs/dbraw/zinc/12/50/08/1137125008.db2.gz UYICZAXGVYXTES-SJLPKXTDSA-N 1 1 344.524 3.977 20 10 EHCDMO CC[C@H](COCC(F)(F)F)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824554640 1137142541 /nfs/dbraw/zinc/14/25/41/1137142541.db2.gz JKJFFIXSCSZUEM-SECBINFHSA-N 1 1 329.721 3.632 20 10 EHCDMO CSC[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862374567 1137141279 /nfs/dbraw/zinc/14/12/79/1137141279.db2.gz NYEPYSQWEJEIDI-LLVKDONJSA-N 1 1 330.291 3.730 20 10 EHCDMO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000862433242 1137144287 /nfs/dbraw/zinc/14/42/87/1137144287.db2.gz UGLRNXLCSRGEFR-UHFFFAOYSA-N 1 1 340.471 3.506 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3c(O)cccc3Cl)CC2)nn1 ZINC000824737799 1137149379 /nfs/dbraw/zinc/14/93/79/1137149379.db2.gz DNWCLHWXKHPGON-UHFFFAOYSA-N 1 1 346.862 3.897 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)c(OC(F)(F)F)c1 ZINC001144055576 1137235484 /nfs/dbraw/zinc/23/54/84/1137235484.db2.gz GDSSTAGTYXFOBV-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO CC[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccc(C)cc1O ZINC000794815705 1137263931 /nfs/dbraw/zinc/26/39/31/1137263931.db2.gz KYBCGRXJXNMIDI-INIZCTEOSA-N 1 1 340.402 3.866 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](c2ccccc2F)[C@H](C)O)ccc1OC ZINC000846018562 1137326365 /nfs/dbraw/zinc/32/63/65/1137326365.db2.gz UNSCMMUSORTJKY-VBKZILBWSA-N 1 1 347.430 3.583 20 10 EHCDMO COc1ccc(Cl)c2c1C[C@@H]([N@H+]1CCc3cccc(O)c3C1)CC2 ZINC001171326162 1137420427 /nfs/dbraw/zinc/42/04/27/1137420427.db2.gz KHJUDNSAXBMAOD-AWEZNQCLSA-N 1 1 343.854 3.970 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000282788604 1137451582 /nfs/dbraw/zinc/45/15/82/1137451582.db2.gz QYJSEILYYJWRFO-AWEZNQCLSA-N 1 1 345.874 3.958 20 10 EHCDMO CC[C@@H](C)OCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172340727 1137552566 /nfs/dbraw/zinc/55/25/66/1137552566.db2.gz KVSJAVSMKQAPBX-ZWKOTPCHSA-N 1 1 334.504 3.549 20 10 EHCDMO CCOc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c(O)c1 ZINC000873175554 1137592533 /nfs/dbraw/zinc/59/25/33/1137592533.db2.gz LDAAYIHTADMGNS-UHFFFAOYSA-N 1 1 330.428 3.584 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1[O-] ZINC000873246112 1137595231 /nfs/dbraw/zinc/59/52/31/1137595231.db2.gz WYTIIOGWHJPLER-WCQYABFASA-N 1 1 341.293 3.584 20 10 EHCDMO Cn1ncc2cc(C[N@@H+](C)Cc3ccc(N4CCCCC4)cc3)cnc21 ZINC000876511936 1137654361 /nfs/dbraw/zinc/65/43/61/1137654361.db2.gz XINLEAWRZBYJIF-UHFFFAOYSA-N 1 1 349.482 3.591 20 10 EHCDMO CC[N@@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccc(N(C)C)cc1 ZINC000876521985 1137654510 /nfs/dbraw/zinc/65/45/10/1137654510.db2.gz DAFQEHLRJCGHAZ-UHFFFAOYSA-N 1 1 325.412 3.622 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1C)Cc1c(C)cccc1O ZINC000876767831 1137660825 /nfs/dbraw/zinc/66/08/25/1137660825.db2.gz CWTWFYQLCYBZQK-UHFFFAOYSA-N 1 1 326.440 3.778 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000825903858 1137661605 /nfs/dbraw/zinc/66/16/05/1137661605.db2.gz USURIGJZTZQRAJ-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000825903858 1137661606 /nfs/dbraw/zinc/66/16/06/1137661606.db2.gz USURIGJZTZQRAJ-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc(F)c(F)c2[O-])CC1 ZINC000877037774 1137668453 /nfs/dbraw/zinc/66/84/53/1137668453.db2.gz CAODWHNZRZZILI-AWEZNQCLSA-N 1 1 346.421 3.986 20 10 EHCDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC000877192042 1137672619 /nfs/dbraw/zinc/67/26/19/1137672619.db2.gz IURDAOBRMVSAQO-UTKZUKDTSA-N 1 1 328.500 3.660 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000877498195 1137678720 /nfs/dbraw/zinc/67/87/20/1137678720.db2.gz NJWNXWVABWXLMM-INIZCTEOSA-N 1 1 325.456 3.613 20 10 EHCDMO CCCOc1ccc(C[NH2+]C(C)(C)c2nc(C)cc(=O)[nH]2)cc1C ZINC000877648267 1137684282 /nfs/dbraw/zinc/68/42/82/1137684282.db2.gz NVSPQEASUPPVSX-UHFFFAOYSA-N 1 1 329.444 3.613 20 10 EHCDMO COc1cccc(O)c1C[N@@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000877783700 1137689736 /nfs/dbraw/zinc/68/97/36/1137689736.db2.gz DHZOYZTZMPYBCW-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000877783700 1137689737 /nfs/dbraw/zinc/68/97/37/1137689737.db2.gz DHZOYZTZMPYBCW-AWEZNQCLSA-N 1 1 329.444 3.627 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1nc(CC2CC2)no1)C1CCCC1 ZINC000878103445 1137702439 /nfs/dbraw/zinc/70/24/39/1137702439.db2.gz KVONTSWJESJXJP-UHFFFAOYSA-N 1 1 327.428 3.673 20 10 EHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(C(=O)OC)co1 ZINC000878565296 1137720408 /nfs/dbraw/zinc/72/04/08/1137720408.db2.gz IODINMPDOCQXAY-ZDUSSCGKSA-N 1 1 332.400 3.530 20 10 EHCDMO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccc(N(C)C)c(C)c2)no1 ZINC000879681642 1137755258 /nfs/dbraw/zinc/75/52/58/1137755258.db2.gz DQYKUTHHHKWFPI-AYHJJNSGSA-N 1 1 340.471 3.663 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](c3nccs3)C2)c1O ZINC000880316882 1137774812 /nfs/dbraw/zinc/77/48/12/1137774812.db2.gz INHGNDGIAIBFIP-LLVKDONJSA-N 1 1 336.844 3.694 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000882939315 1137838997 /nfs/dbraw/zinc/83/89/97/1137838997.db2.gz WABZCPKUKYDBKL-DLBZAZTESA-N 1 1 337.341 3.819 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c(C)n1 ZINC000187243785 1137839465 /nfs/dbraw/zinc/83/94/65/1137839465.db2.gz OIEJOEGLRUHOAD-LJQANCHMSA-N 1 1 326.440 3.585 20 10 EHCDMO Cc1ccc(OC(F)F)c(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000883037583 1137842397 /nfs/dbraw/zinc/84/23/97/1137842397.db2.gz CXOHDDWQUOFKOD-UHFFFAOYSA-N 1 1 329.293 3.870 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(N(C)C)nc2ccccc12)c1c(O)cccc1F ZINC000886535013 1138092154 /nfs/dbraw/zinc/09/21/54/1138092154.db2.gz SXYFFPHXTHZIIB-CYBMUJFWSA-N 1 1 339.414 3.996 20 10 EHCDMO Cc1ccc(O)c([C@H](C)[NH2+]Cc2nc(Cc3ccccc3F)no2)c1 ZINC000886714169 1138123625 /nfs/dbraw/zinc/12/36/25/1138123625.db2.gz CYXHDFSDXSMIGE-ZDUSSCGKSA-N 1 1 341.386 3.664 20 10 EHCDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)n1 ZINC000091832255 1138222070 /nfs/dbraw/zinc/22/20/70/1138222070.db2.gz LYXXILPZRWOJTE-GOSISDBHSA-N 1 1 340.471 3.748 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3ccccc3OC)C2)c1O ZINC000093593268 1138238453 /nfs/dbraw/zinc/23/84/53/1138238453.db2.gz OENDFUKCUGXZAZ-OAHLLOKOSA-N 1 1 327.424 3.789 20 10 EHCDMO CCOc1cccc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1O ZINC000093768901 1138240864 /nfs/dbraw/zinc/24/08/64/1138240864.db2.gz XOMOSLRVTQXHCE-GUYCJALGSA-N 1 1 333.453 3.814 20 10 EHCDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093888736 1138242861 /nfs/dbraw/zinc/24/28/61/1138242861.db2.gz LDCSIGRMXJRHKM-WNSKOXEYSA-N 1 1 330.497 3.683 20 10 EHCDMO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(OC)c(OC)c2)c1O ZINC000124667739 1138292310 /nfs/dbraw/zinc/29/23/10/1138292310.db2.gz DNXCXVRTDZLYDZ-MRXNPFEDSA-N 1 1 343.423 3.755 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)NCc2ccccc2O)cc1)C(C)C ZINC000263649370 1138335860 /nfs/dbraw/zinc/33/58/60/1138335860.db2.gz DGGCYQIDMNYNJB-UHFFFAOYSA-N 1 1 326.440 3.553 20 10 EHCDMO COc1cccc(-c2noc([C@H](C)[NH2+]Cc3cc(C)ccc3O)n2)c1 ZINC000174659220 1139433728 /nfs/dbraw/zinc/43/37/28/1139433728.db2.gz SGQHKIDGFMJEGR-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C(F)(F)F)cs2)c1 ZINC000182456823 1139973277 /nfs/dbraw/zinc/97/32/77/1139973277.db2.gz JLPXTMPJQJQELP-MRVPVSSYSA-N 1 1 332.347 3.727 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)cc(OC)c1O ZINC000184700143 1140116397 /nfs/dbraw/zinc/11/63/97/1140116397.db2.gz UFBCTJAYPQHUBF-UHFFFAOYSA-N 1 1 326.849 3.575 20 10 EHCDMO C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000185356195 1140146541 /nfs/dbraw/zinc/14/65/41/1140146541.db2.gz SDKOESBPAPHRCF-GFCCVEGCSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H](c1ccncc1)N1CCC([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000186152362 1140189092 /nfs/dbraw/zinc/18/90/92/1140189092.db2.gz PGBYNFYZGGCTOK-LSDHHAIUSA-N 1 1 343.446 3.803 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1O ZINC000271135356 1141313410 /nfs/dbraw/zinc/31/34/10/1141313410.db2.gz SLZYCKGCHDHZNR-KRWDZBQOSA-N 1 1 337.423 3.625 20 10 EHCDMO CC1([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)OCCO1 ZINC000183238049 1125481791 /nfs/dbraw/zinc/48/17/91/1125481791.db2.gz ZBIFCLQOXWKSQC-LJQANCHMSA-N 1 1 344.499 3.652 20 10 EHCDMO COc1ccc2c(c1)C[C@H]([N@@H+](C)Cc1ccc(N3CCCC3)cc1)C2 ZINC001168280058 1032836231 /nfs/dbraw/zinc/83/62/31/1032836231.db2.gz LRCPLYMGTOLKIK-OAQYLSRUSA-N 1 1 336.479 3.895 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@H](CCO)c2ccco2)c(C(F)(F)F)c1 ZINC000280063773 1020020270 /nfs/dbraw/zinc/02/02/70/1020020270.db2.gz YPAXJTFVWQORDX-OAHLLOKOSA-N 1 1 342.361 3.578 20 10 EHCDMO CC[C@H]([NH2+]C1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(C)cc1O ZINC000280265789 1020234506 /nfs/dbraw/zinc/23/45/06/1020234506.db2.gz XNXRHJHSBMZYFS-ZCNNSNEGSA-N 1 1 346.515 3.509 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCC[C@@]1(O)C(F)(F)F ZINC001140338010 1020519381 /nfs/dbraw/zinc/51/93/81/1020519381.db2.gz QSGPCLZQYCAMDT-YGRLFVJLSA-N 1 1 337.769 3.571 20 10 EHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c(OC)c2O)cc1 ZINC000891398355 1020909260 /nfs/dbraw/zinc/90/92/60/1020909260.db2.gz VICHAWDZHWAGHU-KRWDZBQOSA-N 1 1 343.423 3.755 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)[C@H](O)C(F)F ZINC000834875870 1020988461 /nfs/dbraw/zinc/98/84/61/1020988461.db2.gz UXWZKSTUNMKYET-HUABCPSTSA-N 1 1 328.186 3.754 20 10 EHCDMO CO[C@@H]1C[C@@H]([NH2+]Cc2cc(C)cc(Br)c2O)C12CCC2 ZINC000839182941 1021769492 /nfs/dbraw/zinc/76/94/92/1021769492.db2.gz SAGOHCLSGWAOKT-ZIAGYGMSSA-N 1 1 340.261 3.510 20 10 EHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000157827996 1033036315 /nfs/dbraw/zinc/03/63/15/1033036315.db2.gz CHXOAMXPOVOFOS-CQSZACIVSA-N 1 1 334.460 3.917 20 10 EHCDMO CN(C)c1nc(C(F)(F)F)ccc1C[N@@H+](C)Cc1ccccc1O ZINC000891713695 1022440088 /nfs/dbraw/zinc/44/00/88/1022440088.db2.gz KGUKCEUMVBWXPL-UHFFFAOYSA-N 1 1 339.361 3.504 20 10 EHCDMO C[N@H+](CCc1cccc(C(F)(F)F)n1)Cc1cc(F)c(F)cc1O ZINC001142508807 1033059596 /nfs/dbraw/zinc/05/95/96/1033059596.db2.gz MDAQOWLZRKEPNX-UHFFFAOYSA-N 1 1 346.299 3.759 20 10 EHCDMO C[N@@H+](CCc1cccc(C(F)(F)F)n1)Cc1cc(F)c(F)cc1O ZINC001142508807 1033059615 /nfs/dbraw/zinc/05/96/15/1033059615.db2.gz MDAQOWLZRKEPNX-UHFFFAOYSA-N 1 1 346.299 3.759 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H](C)c2nnc(C)[nH]2)cc1 ZINC000894771577 1022866595 /nfs/dbraw/zinc/86/65/95/1022866595.db2.gz NXYSOIFLHCSDCD-INIZCTEOSA-N 1 1 349.482 3.990 20 10 EHCDMO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(OC)c2O)[nH]1 ZINC000277069120 1023735710 /nfs/dbraw/zinc/73/57/10/1023735710.db2.gz DUUAJJYNPQVQJA-NXEZZACHSA-N 1 1 338.839 3.537 20 10 EHCDMO CC[C@@H]([NH2+]CCCC[NH+](C)C)c1cc(Br)ccc1[O-] ZINC000045663484 1026176397 /nfs/dbraw/zinc/17/63/97/1026176397.db2.gz RTBAOSXAJISQBB-CQSZACIVSA-N 1 1 329.282 3.537 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(OC)c2)c1 ZINC000273426682 1027422351 /nfs/dbraw/zinc/42/23/51/1027422351.db2.gz ULEZLOZYVSWCFD-OLZOCXBDSA-N 1 1 329.396 3.599 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1 ZINC000245944506 1029503349 /nfs/dbraw/zinc/50/33/49/1029503349.db2.gz VKZUDOVWSMKTGT-YLJYHZDGSA-N 1 1 345.414 3.628 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(C3CCC3)cc2)ccc1[N+](=O)[O-] ZINC000278351443 1030329750 /nfs/dbraw/zinc/32/97/50/1030329750.db2.gz IPGRRNUSPQVFEG-UHFFFAOYSA-N 1 1 342.395 3.866 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)cc1OC ZINC000160179296 1030583156 /nfs/dbraw/zinc/58/31/56/1030583156.db2.gz FGAFOUHVNJAFRT-CQSZACIVSA-N 1 1 348.468 3.684 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000195136714 1032049397 /nfs/dbraw/zinc/04/93/97/1032049397.db2.gz TVTGWUHIIANSEE-RDJZCZTQSA-N 1 1 328.431 3.704 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138061 1032051654 /nfs/dbraw/zinc/05/16/54/1032051654.db2.gz CQTXVRVRKOJPAW-NVXWUHKLSA-N 1 1 328.431 3.704 20 10 EHCDMO CC[N@@H+](Cc1cnc(C)s1)Cc1cc(Br)ccc1O ZINC000174425143 1033930939 /nfs/dbraw/zinc/93/09/39/1033930939.db2.gz CYVGFDRZQOLCQN-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)n1 ZINC000171859152 1034671399 /nfs/dbraw/zinc/67/13/99/1034671399.db2.gz APXXMAITNXQBAQ-UHFFFAOYSA-N 1 1 325.456 3.713 20 10 EHCDMO C[C@H]([NH2+]C[C@H](c1c(F)cccc1F)N(C)C)c1ccc(F)cc1O ZINC000185458764 1039114350 /nfs/dbraw/zinc/11/43/50/1039114350.db2.gz RTMZBWKUJHPCSN-MEDUHNTESA-N 1 1 338.373 3.763 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)c2ccc([S@@](C)=O)cc2)c1O ZINC000894085540 1040043046 /nfs/dbraw/zinc/04/30/46/1040043046.db2.gz PENZMSONISHOHM-JBEBIEQOSA-N 1 1 347.480 3.640 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CC2CC(O)C2)cc1 ZINC000297065466 1040785639 /nfs/dbraw/zinc/78/56/39/1040785639.db2.gz ZEYSGIQXZHSNAD-UHFFFAOYSA-N 1 1 330.497 3.587 20 10 EHCDMO COCC[N@H+](Cc1cccc(Br)c1O)C1CCCC1 ZINC000768582975 1133160222 /nfs/dbraw/zinc/16/02/22/1133160222.db2.gz SRCFXLGVOAEHCN-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO COCC[N@@H+](Cc1cccc(Br)c1O)C1CCCC1 ZINC000768582975 1133160224 /nfs/dbraw/zinc/16/02/24/1133160224.db2.gz SRCFXLGVOAEHCN-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO CC[C@H]([NH2+]Cc1cnn(CC(F)(F)F)c1)c1ccc(F)cc1O ZINC000796797840 1042179017 /nfs/dbraw/zinc/17/90/17/1042179017.db2.gz OJENTEZKYSXSDZ-ZDUSSCGKSA-N 1 1 331.313 3.531 20 10 EHCDMO COc1ccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c(O)c1OC ZINC000893475054 1042217091 /nfs/dbraw/zinc/21/70/91/1042217091.db2.gz HWDCHLVDGFSJNB-ZYHUDNBSSA-N 1 1 333.350 3.572 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)sc1C ZINC000279679299 1044405684 /nfs/dbraw/zinc/40/56/84/1044405684.db2.gz OMXPRYCXYFVIPS-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@H+]2Cc2cc(C)ccc2O)sc1C ZINC000279679299 1044405693 /nfs/dbraw/zinc/40/56/93/1044405693.db2.gz OMXPRYCXYFVIPS-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO C[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185075142 1126750951 /nfs/dbraw/zinc/75/09/51/1126750951.db2.gz CVDGNWLEPSKPRW-OAHLLOKOSA-N 1 1 328.500 3.796 20 10 EHCDMO CC[C@H]1CN(c2ccccc2)CC[N@H+]1Cc1cc(OC)ccc1O ZINC000764678920 1127519807 /nfs/dbraw/zinc/51/98/07/1127519807.db2.gz OWBDXUXMAUDCDS-KRWDZBQOSA-N 1 1 326.440 3.502 20 10 EHCDMO c1ccc([C@@H](CN2CCCCC2)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001649060880 1128081191 /nfs/dbraw/zinc/08/11/91/1128081191.db2.gz SQBVAOCOHGZGKN-OAQYLSRUSA-N 1 1 336.479 3.938 20 10 EHCDMO C[C@H](CN[C@H](C)c1ccc(N2CCCCC2)c(F)c1)[N@H+](C)C1CC1 ZINC000765807130 1128414464 /nfs/dbraw/zinc/41/44/64/1128414464.db2.gz XJGMOTHTOARAQK-HZPDHXFCSA-N 1 1 333.495 3.949 20 10 EHCDMO C[C@H](CN[C@H](C)c1ccc(N2CCCCC2)c(F)c1)[N@@H+](C)C1CC1 ZINC000765807130 1128414465 /nfs/dbraw/zinc/41/44/65/1128414465.db2.gz XJGMOTHTOARAQK-HZPDHXFCSA-N 1 1 333.495 3.949 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ccn(C)n2)cc1 ZINC000765792383 1128369684 /nfs/dbraw/zinc/36/96/84/1128369684.db2.gz USCZPWCDYVOHRJ-UHFFFAOYSA-N 1 1 334.467 3.736 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCN1CC(F)(F)F ZINC000762508534 1121333297 /nfs/dbraw/zinc/33/32/97/1121333297.db2.gz OSDDMIQKSMOUAA-ZDUSSCGKSA-N 1 1 338.373 3.614 20 10 EHCDMO CCC[N@@H+](CCC(=O)Nc1ccccc1F)Cc1ccccc1O ZINC000171668221 1121367061 /nfs/dbraw/zinc/36/70/61/1121367061.db2.gz UYKVTFAIEPOKPH-UHFFFAOYSA-N 1 1 330.403 3.772 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1COc2ccccc2O1 ZINC000917074649 1122471272 /nfs/dbraw/zinc/47/12/72/1122471272.db2.gz FIXWVUYBMINOAO-IBGZPJMESA-N 1 1 340.467 3.803 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCOc3ccccc3C)CC2)cc1 ZINC000917089981 1122487827 /nfs/dbraw/zinc/48/78/27/1122487827.db2.gz RGTZSNLBWKAOFR-UHFFFAOYSA-N 1 1 340.467 3.595 20 10 EHCDMO CC(C)c1nc(CC[N@@H+](C)Cc2cccc(C(C)(C)C)c2O)no1 ZINC001143104215 1129064428 /nfs/dbraw/zinc/06/44/28/1129064428.db2.gz QRUYGCGEERUOMW-UHFFFAOYSA-N 1 1 331.460 3.871 20 10 EHCDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000917417946 1122595493 /nfs/dbraw/zinc/59/54/93/1122595493.db2.gz OSFAPIWQXZCNLQ-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO Cc1ccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000917417946 1122595494 /nfs/dbraw/zinc/59/54/94/1122595494.db2.gz OSFAPIWQXZCNLQ-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO CC(C)Nc1cc[nH+]c(NCc2cc(Cl)c3cccnc3c2O)n1 ZINC001168524780 1123129497 /nfs/dbraw/zinc/12/94/97/1123129497.db2.gz WYKKGJGMPDSLEM-UHFFFAOYSA-N 1 1 343.818 3.816 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000179581790 1123798837 /nfs/dbraw/zinc/79/88/37/1123798837.db2.gz QXQIMNOAQIBDGB-QGZVFWFLSA-N 1 1 337.341 3.985 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cc(OC)ccc2OC)c1 ZINC000179609272 1123806235 /nfs/dbraw/zinc/80/62/35/1123806235.db2.gz IBIHPMUAMGRMOU-SFHVURJKSA-N 1 1 343.423 3.755 20 10 EHCDMO C[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@H]1CCSC1 ZINC000182986469 1125417861 /nfs/dbraw/zinc/41/78/61/1125417861.db2.gz WMUFLQJKKUIZEB-KRWDZBQOSA-N 1 1 329.465 3.909 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922881816 1129704175 /nfs/dbraw/zinc/70/41/75/1129704175.db2.gz SEMSQFOTRTWNKG-AWEZNQCLSA-N 1 1 333.229 3.717 20 10 EHCDMO CCCC[N@@H+](Cc1ccc(-n2ccnc2)nc1)Cc1ccccc1O ZINC000282424356 1129776948 /nfs/dbraw/zinc/77/69/48/1129776948.db2.gz JQXFLHUXZNVYGQ-UHFFFAOYSA-N 1 1 336.439 3.775 20 10 EHCDMO O=C(C[N@H+](Cc1ccccc1O)C1CCCC1)N1CCCCCC1 ZINC000732204771 1130900581 /nfs/dbraw/zinc/90/05/81/1130900581.db2.gz RKXTWSRLLNQMNH-UHFFFAOYSA-N 1 1 330.472 3.539 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](N3CCCCC3=O)C2)cc1C(C)C ZINC000732797862 1130957221 /nfs/dbraw/zinc/95/72/21/1130957221.db2.gz KNJUDTMYYYCBRY-SFHVURJKSA-N 1 1 344.499 3.801 20 10 EHCDMO 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/nfs/dbraw/zinc/10/29/67/1136102967.db2.gz IMDLOAJBICMXHF-OAQYLSRUSA-N 1 1 339.435 3.761 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000811512203 1136103271 /nfs/dbraw/zinc/10/32/71/1136103271.db2.gz HFMDJTQKFTZBRZ-NRFANRHFSA-N 1 1 339.435 3.761 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000811781520 1136134756 /nfs/dbraw/zinc/13/47/56/1136134756.db2.gz CZIKASCPWMLRJX-GOSISDBHSA-N 1 1 345.446 3.577 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](n3cccn3)C1)oc1ccccc12 ZINC000812295167 1136195924 /nfs/dbraw/zinc/19/59/24/1136195924.db2.gz XGTXGNZMNRAILL-HNNXBMFYSA-N 1 1 333.391 3.935 20 10 EHCDMO OC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccc(F)cc1F ZINC000850409943 1136252079 /nfs/dbraw/zinc/25/20/79/1136252079.db2.gz DJLLMTJCWMKBSZ-HXUWFJFHSA-N 1 1 346.421 3.778 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000850572907 1136289516 /nfs/dbraw/zinc/28/95/16/1136289516.db2.gz QOCZXMHEDBLHID-CABCVRRESA-N 1 1 330.451 3.961 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@H]1CCc3cc(F)cc(F)c3C1)CCC2 ZINC001170707285 1136336748 /nfs/dbraw/zinc/33/67/48/1136336748.db2.gz TTYYWCOYVDZHFK-INIZCTEOSA-N 1 1 345.389 3.682 20 10 EHCDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccccc1O ZINC000109771003 1136339908 /nfs/dbraw/zinc/33/99/08/1136339908.db2.gz UIWJPMFXICBFAW-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccccc1O ZINC000109771003 1136339910 /nfs/dbraw/zinc/33/99/10/1136339910.db2.gz UIWJPMFXICBFAW-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO Cc1ccoc1C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000813884001 1136372531 /nfs/dbraw/zinc/37/25/31/1136372531.db2.gz ZDMURHJTLXNULG-CQSZACIVSA-N 1 1 334.847 3.929 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1O ZINC000814177310 1136411786 /nfs/dbraw/zinc/41/17/86/1136411786.db2.gz ZLPFVCDELKVSNT-DOTOQJQBSA-N 1 1 346.471 3.532 20 10 EHCDMO CC1(C)OC[C@H](CC[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000851841189 1136412863 /nfs/dbraw/zinc/41/28/63/1136412863.db2.gz NUQVOWRSIBINDK-KRWDZBQOSA-N 1 1 331.412 3.529 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOCc1ccccc1)C[C@@H]1CCCO1 ZINC000851841696 1136413350 /nfs/dbraw/zinc/41/33/50/1136413350.db2.gz WRUXQMQGXGRMCY-FQEVSTJZSA-N 1 1 341.451 3.590 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](c3ccccc3)C2)cc1OC ZINC000814225189 1136424975 /nfs/dbraw/zinc/42/49/75/1136424975.db2.gz FDYQOZRFHMDUTM-INIZCTEOSA-N 1 1 327.424 3.789 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@H](CCF)C3)cc2)CC1 ZINC000852531665 1136462710 /nfs/dbraw/zinc/46/27/10/1136462710.db2.gz SUNWJMBGEWBAIL-QGZVFWFLSA-N 1 1 334.479 3.873 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c1O ZINC000852594308 1136469295 /nfs/dbraw/zinc/46/92/95/1136469295.db2.gz BGHDJTRXNZFKTI-KSSFIOAISA-N 1 1 335.419 3.515 20 10 EHCDMO C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)Cc1ccccc1O ZINC000111236033 1136524798 /nfs/dbraw/zinc/52/47/98/1136524798.db2.gz GMXQBOJXPPHOOV-UONOGXRCSA-N 1 1 346.858 3.743 20 10 EHCDMO Cc1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)ccc1N(C)C ZINC000815075949 1136547045 /nfs/dbraw/zinc/54/70/45/1136547045.db2.gz PEJCRCHEUOKPSG-UHFFFAOYSA-N 1 1 325.412 3.528 20 10 EHCDMO Cc1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)ccc1N(C)C ZINC000815075949 1136547048 /nfs/dbraw/zinc/54/70/48/1136547048.db2.gz PEJCRCHEUOKPSG-UHFFFAOYSA-N 1 1 325.412 3.528 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074187 1136547245 /nfs/dbraw/zinc/54/72/45/1136547245.db2.gz LDUONBXRLRHGPX-GHTZIAJQSA-N 1 1 327.516 3.510 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074187 1136547246 /nfs/dbraw/zinc/54/72/46/1136547246.db2.gz LDUONBXRLRHGPX-GHTZIAJQSA-N 1 1 327.516 3.510 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1O ZINC000111996229 1136595412 /nfs/dbraw/zinc/59/54/12/1136595412.db2.gz RNJIMPWOPKMMOO-UHFFFAOYSA-N 1 1 337.423 3.527 20 10 EHCDMO COCC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000815627687 1136621297 /nfs/dbraw/zinc/62/12/97/1136621297.db2.gz GUWCDKNUNDENRD-LBPRGKRZSA-N 1 1 347.377 3.505 20 10 EHCDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(Br)cn2)c(O)c1 ZINC000815634300 1136621811 /nfs/dbraw/zinc/62/18/11/1136621811.db2.gz ICEWLFZKUNBOQC-WDEREUQCSA-N 1 1 336.233 3.665 20 10 EHCDMO CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000815633468 1136622019 /nfs/dbraw/zinc/62/20/19/1136622019.db2.gz OQBREGDNZZWRAT-MNOVXSKESA-N 1 1 347.286 3.902 20 10 EHCDMO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1c(O)ccc2ccncc21 ZINC000776777099 1136664303 /nfs/dbraw/zinc/66/43/03/1136664303.db2.gz QCQKWKYLWMKUIW-UHFFFAOYSA-N 1 1 332.325 3.990 20 10 EHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000816491467 1136724255 /nfs/dbraw/zinc/72/42/55/1136724255.db2.gz MUIFZNAIKMHKLI-SNVBAGLBSA-N 1 1 341.732 3.728 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000816499234 1136727570 /nfs/dbraw/zinc/72/75/70/1136727570.db2.gz JMRCDHCOGNOMCB-AWEZNQCLSA-N 1 1 326.843 3.635 20 10 EHCDMO C[N@H+](Cc1nc(-c2cccnc2)no1)Cc1ccc2ccccc2c1O ZINC000816510193 1136728611 /nfs/dbraw/zinc/72/86/11/1136728611.db2.gz OVHMXXXKETVSCU-UHFFFAOYSA-N 1 1 346.390 3.622 20 10 EHCDMO C[N@@H+](Cc1nc(-c2cccnc2)no1)Cc1ccc2ccccc2c1O ZINC000816510193 1136728613 /nfs/dbraw/zinc/72/86/13/1136728613.db2.gz OVHMXXXKETVSCU-UHFFFAOYSA-N 1 1 346.390 3.622 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCN1CC(F)F ZINC000816516657 1136730331 /nfs/dbraw/zinc/73/03/31/1136730331.db2.gz MHMGXMPSAIONHP-MRXNPFEDSA-N 1 1 334.410 3.707 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(NC(N)=O)cc1 ZINC000816549380 1136732348 /nfs/dbraw/zinc/73/23/48/1136732348.db2.gz MHKAYQDAWXFLPK-SECBINFHSA-N 1 1 337.782 3.526 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](Cn1cccn1)c1ccccc1 ZINC000816553388 1136735787 /nfs/dbraw/zinc/73/57/87/1136735787.db2.gz UBPGVFJTBFRRHL-QGZVFWFLSA-N 1 1 345.805 3.912 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cncc(Cl)c1)C[C@@H]1CCCO1 ZINC000856730480 1136803959 /nfs/dbraw/zinc/80/39/59/1136803959.db2.gz CYYLKCPOIDPQKW-KRWDZBQOSA-N 1 1 332.831 3.622 20 10 EHCDMO COC1([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CCOCC1 ZINC000817588088 1136826410 /nfs/dbraw/zinc/82/64/10/1136826410.db2.gz LOJGEJYTNNNHKZ-WDEREUQCSA-N 1 1 348.270 3.934 20 10 EHCDMO C[C@H](C[C@H]1CCCCC[NH2+]1)NCc1ccc(N2CCSCC2)cc1 ZINC000817887626 1136841546 /nfs/dbraw/zinc/84/15/46/1136841546.db2.gz AVMIKPKROQRPRF-IEBWSBKVSA-N 1 1 347.572 3.640 20 10 EHCDMO CC(C)C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817941422 1136848583 /nfs/dbraw/zinc/84/85/83/1136848583.db2.gz JSFUBQRLUPXXIC-AZUAARDMSA-N 1 1 326.488 3.524 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1nccc2ccccc21 ZINC000817942548 1136849224 /nfs/dbraw/zinc/84/92/24/1136849224.db2.gz PMRZCFNXMZKWSQ-QRWLVFNGSA-N 1 1 334.467 3.651 20 10 EHCDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858135836 1136942690 /nfs/dbraw/zinc/94/26/90/1136942690.db2.gz DUSTWCFJHCRTSP-MRXNPFEDSA-N 1 1 348.393 3.653 20 10 EHCDMO CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000858513004 1136975302 /nfs/dbraw/zinc/97/53/02/1136975302.db2.gz HSYNBBYTDXYEOP-LLVKDONJSA-N 1 1 329.387 3.901 20 10 EHCDMO COc1ccc([C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C2CC2)cn1 ZINC000858605839 1136982287 /nfs/dbraw/zinc/98/22/87/1136982287.db2.gz ZTGPVYZFPNBLHH-DYZYQPBXSA-N 1 1 334.366 3.876 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CC2(C)COC2)c(C)n1-c1ccc(C)cc1 ZINC000859565462 1137020221 /nfs/dbraw/zinc/02/02/21/1137020221.db2.gz KHJDEZOUWBQFEJ-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CC2(C)COC2)c(C)n1-c1ccc(C)cc1 ZINC000859565462 1137020223 /nfs/dbraw/zinc/02/02/23/1137020223.db2.gz KHJDEZOUWBQFEJ-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000862398594 1137142814 /nfs/dbraw/zinc/14/28/14/1137142814.db2.gz MTBOOEFKFWCCSE-DOMZBBRYSA-N 1 1 340.261 3.546 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000862484776 1137146678 /nfs/dbraw/zinc/14/66/78/1137146678.db2.gz AXHFVMLEBRMZJK-ZBFHGGJFSA-N 1 1 349.471 3.591 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1O ZINC000824696981 1137147315 /nfs/dbraw/zinc/14/73/15/1137147315.db2.gz WXJVMCKVEGRIOB-ARFHVFGLSA-N 1 1 339.863 3.570 20 10 EHCDMO Oc1c(C[N@H+]2CCc3nc(C4CC4)ncc3C2)ccc2ccccc21 ZINC000862507345 1137147514 /nfs/dbraw/zinc/14/75/14/1137147514.db2.gz ARAQELIHCSGSQN-UHFFFAOYSA-N 1 1 331.419 3.771 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824952459 1137159295 /nfs/dbraw/zinc/15/92/95/1137159295.db2.gz AVJCACDRFZJKHG-BLLLJJGKSA-N 1 1 336.794 3.590 20 10 EHCDMO Cc1ccc2c(C[N@H+](C)Cc3ccc(N4CCOCC4)cc3)c[nH]c2c1 ZINC001136973449 1137161181 /nfs/dbraw/zinc/16/11/81/1137161181.db2.gz ZELRVMCPAZONNN-UHFFFAOYSA-N 1 1 349.478 3.945 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)c2nccn21 ZINC000825017501 1137162212 /nfs/dbraw/zinc/16/22/12/1137162212.db2.gz STPLUARTCFZWRJ-IAQYHMDHSA-N 1 1 338.377 3.764 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)C2CCN(CCC(F)(F)F)CC2)cc1C ZINC000825332015 1137173216 /nfs/dbraw/zinc/17/32/16/1137173216.db2.gz PZJZLIYTUBAZKA-UHFFFAOYSA-N 1 1 344.421 3.858 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCO[C@H](CCF)C1)CCCC3 ZINC000863316423 1137180667 /nfs/dbraw/zinc/18/06/67/1137180667.db2.gz DSOFILCLKGZJPA-CYBMUJFWSA-N 1 1 333.403 3.578 20 10 EHCDMO COc1cc(C[N@H+]2C[C@@H](C)O[C@H](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794653247 1137223705 /nfs/dbraw/zinc/22/37/05/1137223705.db2.gz LKEOOJVHTFQAQS-ACJLOTCBSA-N 1 1 333.472 3.698 20 10 EHCDMO CCn1ncnc1C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000794836524 1137276539 /nfs/dbraw/zinc/27/65/39/1137276539.db2.gz OUYAJXXKRUZEDD-INIZCTEOSA-N 1 1 327.476 3.529 20 10 EHCDMO Cc1cn(CC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c(C)[nH+]1 ZINC000865360857 1137277872 /nfs/dbraw/zinc/27/78/72/1137277872.db2.gz FWXGLMYPHNJNKB-UHFFFAOYSA-N 1 1 342.830 3.839 20 10 EHCDMO Cc1ccnc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1Br ZINC000865465723 1137286375 /nfs/dbraw/zinc/28/63/75/1137286375.db2.gz IGSMRHXQWZHLLW-UHFFFAOYSA-N 1 1 348.288 3.817 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2c1CCC2 ZINC000845964806 1137324129 /nfs/dbraw/zinc/32/41/29/1137324129.db2.gz KXUYLNXELWXMHQ-UHFFFAOYSA-N 1 1 332.241 3.933 20 10 EHCDMO CO[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(C)cc(Br)c1O ZINC000846056906 1137331238 /nfs/dbraw/zinc/33/12/38/1137331238.db2.gz RRIINPUEWVLXHS-ZIAGYGMSSA-N 1 1 328.250 3.510 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]CC[C@@H](C)N(C)Cc2ccccc2)c1O ZINC000846144587 1137339080 /nfs/dbraw/zinc/33/90/80/1137339080.db2.gz IAXZTHGPZILSFL-IAGOWNOFSA-N 1 1 342.483 3.962 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCn2nccc21)c1cccc(C(F)(F)F)c1O ZINC000866633519 1137371478 /nfs/dbraw/zinc/37/14/78/1137371478.db2.gz JEHRSWZVVNKSPP-MFKMUULPSA-N 1 1 325.334 3.793 20 10 EHCDMO C[C@H](NC(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000868103632 1137397218 /nfs/dbraw/zinc/39/72/18/1137397218.db2.gz SANWHAUBQPQFSA-BBWFWOEESA-N 1 1 347.503 3.511 20 10 EHCDMO CCOC(=O)C1(C)CCC([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001171956871 1137518879 /nfs/dbraw/zinc/51/88/79/1137518879.db2.gz SMXLJPOIMYHENI-UHFFFAOYSA-N 1 1 332.488 3.696 20 10 EHCDMO Fc1ccc2c(cc[nH+]c2NCc2ccc(N3CCOCC3)cc2)c1 ZINC000825627653 1137585437 /nfs/dbraw/zinc/58/54/37/1137585437.db2.gz OOSCGDRJXAIHEX-UHFFFAOYSA-N 1 1 337.398 3.823 20 10 EHCDMO CCOc1cccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c1O ZINC000873175972 1137592564 /nfs/dbraw/zinc/59/25/64/1137592564.db2.gz YRXWWZJLNVGVOT-UHFFFAOYSA-N 1 1 330.428 3.584 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(N)cc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000873288584 1137596417 /nfs/dbraw/zinc/59/64/17/1137596417.db2.gz IWHJJGIBRJBJTP-SECBINFHSA-N 1 1 328.309 3.983 20 10 EHCDMO COc1ccc(N2CCC([NH2+][C@H](CCN(C)C)C(C)(C)C)CC2)cc1 ZINC000125918941 1137650049 /nfs/dbraw/zinc/65/00/49/1137650049.db2.gz LJPUKTFLKVQTNW-HXUWFJFHSA-N 1 1 347.547 3.620 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)c1[O-] ZINC000125917460 1137650115 /nfs/dbraw/zinc/65/01/15/1137650115.db2.gz YBZMEVGVXQTNII-LBPRGKRZSA-N 1 1 331.387 3.503 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)c1O ZINC000125917460 1137650116 /nfs/dbraw/zinc/65/01/16/1137650116.db2.gz YBZMEVGVXQTNII-LBPRGKRZSA-N 1 1 331.387 3.503 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)c1O ZINC000125917460 1137650117 /nfs/dbraw/zinc/65/01/17/1137650117.db2.gz YBZMEVGVXQTNII-LBPRGKRZSA-N 1 1 331.387 3.503 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccccc1C ZINC000876580558 1137656118 /nfs/dbraw/zinc/65/61/18/1137656118.db2.gz NIQATPCGLPDNPI-UHFFFAOYSA-N 1 1 338.495 3.978 20 10 EHCDMO COCCC[N@@H+](Cc1ccncc1)Cc1cc(Cl)c(C)cc1O ZINC000825915910 1137664206 /nfs/dbraw/zinc/66/42/06/1137664206.db2.gz DJOLXVWUFWZCOQ-UHFFFAOYSA-N 1 1 334.847 3.788 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@@H]2CCCC[C@@H]21 ZINC000877194098 1137672595 /nfs/dbraw/zinc/67/25/95/1137672595.db2.gz ZKLFJAMNYZZIKE-MAODMQOUSA-N 1 1 328.500 3.658 20 10 EHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)c1C ZINC000877543590 1137680605 /nfs/dbraw/zinc/68/06/05/1137680605.db2.gz IPQQEKQBTZNIFD-UHFFFAOYSA-N 1 1 338.495 3.897 20 10 EHCDMO CC(=O)Nc1cccc2c1C[N@@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000877683450 1137685650 /nfs/dbraw/zinc/68/56/50/1137685650.db2.gz XLRUDMZSXXUVEJ-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO C[C@@H]1C[C@H](C[N@H+]2Cc3cccc(O)c3C2)CCN1C(=O)OC(C)(C)C ZINC000877703149 1137686489 /nfs/dbraw/zinc/68/64/89/1137686489.db2.gz TWSOZQUYTYGKMX-HUUCEWRRSA-N 1 1 346.471 3.743 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000883003560 1137841267 /nfs/dbraw/zinc/84/12/67/1137841267.db2.gz VNEGDNDVXRBDPH-SFHVURJKSA-N 1 1 333.378 3.928 20 10 EHCDMO COc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c(C)c1OC ZINC000883120354 1137845267 /nfs/dbraw/zinc/84/52/67/1137845267.db2.gz APOARGRXQRSIPG-NSHDSACASA-N 1 1 337.366 3.847 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000883117157 1137845354 /nfs/dbraw/zinc/84/53/54/1137845354.db2.gz RVTOINGPMAYNEI-UHFFFAOYSA-N 1 1 336.357 3.700 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000883289561 1137852800 /nfs/dbraw/zinc/85/28/00/1137852800.db2.gz SJWQVDDTGSITHW-OAHLLOKOSA-N 1 1 345.437 3.567 20 10 EHCDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000101904743 1137871930 /nfs/dbraw/zinc/87/19/30/1137871930.db2.gz DKLRYVOHNMWPEU-MRXNPFEDSA-N 1 1 340.467 3.530 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]([C@H]4CCCO4)C3)c2c1 ZINC000884483264 1137960993 /nfs/dbraw/zinc/96/09/93/1137960993.db2.gz QMETYIMRDDAYTA-FOIQADDNSA-N 1 1 327.424 3.555 20 10 EHCDMO C[C@@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1c(O)cccc1F ZINC000886502692 1138085077 /nfs/dbraw/zinc/08/50/77/1138085077.db2.gz KOVFHZMFHIDQAX-OAHLLOKOSA-N 1 1 329.415 3.930 20 10 EHCDMO COc1cc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc(OC)c1OC ZINC000886504139 1138085292 /nfs/dbraw/zinc/08/52/92/1138085292.db2.gz SPIRTBBKVDPJSN-VXGBXAGGSA-N 1 1 349.402 3.969 20 10 EHCDMO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886505356 1138085647 /nfs/dbraw/zinc/08/56/47/1138085647.db2.gz XRCNKYHXNTXLMB-KBPBESRZSA-N 1 1 344.430 3.910 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1c(O)cccc1F ZINC000886508672 1138086475 /nfs/dbraw/zinc/08/64/75/1138086475.db2.gz JTRGLUYHDTUNNH-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO COC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(F)c(F)c1 ZINC000886562114 1138097669 /nfs/dbraw/zinc/09/76/69/1138097669.db2.gz QQYGOAWRVAXDKC-MEBBXXQBSA-N 1 1 325.330 3.848 20 10 EHCDMO COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)c3c(O)cccc3F)C2)cc1 ZINC000886627972 1138103627 /nfs/dbraw/zinc/10/36/27/1138103627.db2.gz BTBMBPKBUQSATG-CABCVRRESA-N 1 1 344.430 3.717 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccc(Cl)n1)C[C@@H]1CCCO1 ZINC000072629265 1138106669 /nfs/dbraw/zinc/10/66/69/1138106669.db2.gz HHHNBRFVWUCHCD-INIZCTEOSA-N 1 1 332.831 3.622 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)cc1 ZINC000092706571 1138230640 /nfs/dbraw/zinc/23/06/40/1138230640.db2.gz CMGGILHNYFOBTR-LJQANCHMSA-N 1 1 345.531 3.517 20 10 EHCDMO COCCOCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179643157 1139771126 /nfs/dbraw/zinc/77/11/26/1139771126.db2.gz RLQQWCAKCVKRAV-QGZVFWFLSA-N 1 1 329.440 3.618 20 10 EHCDMO COc1cc(O)c(C[N@H+](Cc2cccc(O)c2)CC2CC2)cc1OC ZINC000179917612 1139792718 /nfs/dbraw/zinc/79/27/18/1139792718.db2.gz XMSNZCJXSNWJTQ-UHFFFAOYSA-N 1 1 343.423 3.527 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1C ZINC000180282521 1139824818 /nfs/dbraw/zinc/82/48/18/1139824818.db2.gz QYAFAPOMJRUYGZ-CMJOXMDJSA-N 1 1 331.481 3.939 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000180802148 1139863943 /nfs/dbraw/zinc/86/39/43/1139863943.db2.gz ARTWNPKSEDXEBJ-CQSZACIVSA-N 1 1 339.361 3.753 20 10 EHCDMO C[C@@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1ccc(F)cc1O ZINC000185048979 1140133996 /nfs/dbraw/zinc/13/39/96/1140133996.db2.gz SESSLUPXBKLLLT-RDTXWAMCSA-N 1 1 342.414 3.546 20 10 EHCDMO Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)c3ccc(F)cc3O)cn2)n1 ZINC000185057929 1140134761 /nfs/dbraw/zinc/13/47/61/1140134761.db2.gz SLRFLGDSVTVSAA-CQSZACIVSA-N 1 1 340.402 3.580 20 10 EHCDMO COc1ccccc1N1CC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000185269288 1140142669 /nfs/dbraw/zinc/14/26/69/1140142669.db2.gz PWOPPGBRNZQFRZ-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1O ZINC000271259295 1141334885 /nfs/dbraw/zinc/33/48/85/1141334885.db2.gz GTGDDNWIYLJGBC-ZWKOTPCHSA-N 1 1 345.414 3.628 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000274171255 1141481381 /nfs/dbraw/zinc/48/13/81/1141481381.db2.gz BBWWOOLBZYQZSE-NSHDSACASA-N 1 1 335.350 3.967 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(Br)ccc2O)s1 ZINC000274285400 1141493308 /nfs/dbraw/zinc/49/33/08/1141493308.db2.gz ZEQGBBGGJMXSMM-YUMQZZPRSA-N 1 1 342.262 3.726 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(Br)ccc2O)s1 ZINC000274285395 1141493521 /nfs/dbraw/zinc/49/35/21/1141493521.db2.gz ZEQGBBGGJMXSMM-JGVFFNPUSA-N 1 1 342.262 3.726 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cc1OC ZINC000160223647 1014519672 /nfs/dbraw/zinc/51/96/72/1014519672.db2.gz BCCHLPJNBAPYPP-ZFWWWQNUSA-N 1 1 345.414 3.927 20 10 EHCDMO C[C@H](N[C@H](c1nccn1C)c1cccc(F)c1)c1ccc(F)cc1[O-] ZINC000184959475 1032346340 /nfs/dbraw/zinc/34/63/40/1032346340.db2.gz INDUUJQCBVOZPF-SGTLLEGYSA-N 1 1 343.377 3.844 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3cccs3)C1)CCCC2 ZINC000160413256 1018755213 /nfs/dbraw/zinc/75/52/13/1018755213.db2.gz WJKNUEWPWPORCO-SFHVURJKSA-N 1 1 329.465 3.906 20 10 EHCDMO Cc1ccc2c(NCc3ccc(N4CCN(C)CC4)cc3)cc[nH+]c2c1 ZINC001167437177 1020158833 /nfs/dbraw/zinc/15/88/33/1020158833.db2.gz NYZMYWWVBHLGEK-UHFFFAOYSA-N 1 1 346.478 3.907 20 10 EHCDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000183174162 1020516110 /nfs/dbraw/zinc/51/61/10/1020516110.db2.gz OTOLFCZUQYZEQC-INIZCTEOSA-N 1 1 328.431 3.855 20 10 EHCDMO CCOC(=O)N[C@@H](C[NH2+][C@H](CC)c1ccc(F)cc1O)CC(C)C ZINC000796677207 1021370490 /nfs/dbraw/zinc/37/04/90/1021370490.db2.gz AYIGKJIANSDWIG-GDBMZVCRSA-N 1 1 340.439 3.733 20 10 EHCDMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000897624521 1033010646 /nfs/dbraw/zinc/01/06/46/1033010646.db2.gz NELGJNBORHHKBC-UHFFFAOYSA-N 1 1 338.495 3.897 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c(O)c1OC ZINC000894455266 1022314047 /nfs/dbraw/zinc/31/40/47/1022314047.db2.gz BQVSKBAQZPQJGW-UHFFFAOYSA-N 1 1 343.423 3.527 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c(O)c1OC ZINC000894977947 1022327082 /nfs/dbraw/zinc/32/70/82/1022327082.db2.gz WMDNLKIDPKVGCQ-NSHDSACASA-N 1 1 333.350 3.574 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@H](C)c1cccc(O)c1 ZINC000891714287 1022444921 /nfs/dbraw/zinc/44/49/21/1022444921.db2.gz UZQGSEOQNNAZEE-CYBMUJFWSA-N 1 1 331.412 3.698 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1O ZINC000164497607 1022928736 /nfs/dbraw/zinc/92/87/36/1022928736.db2.gz JLSNHNVSAGRJSH-DYVFJYSZSA-N 1 1 333.453 3.733 20 10 EHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(OC)c2O)[nH]1 ZINC000277069135 1023735687 /nfs/dbraw/zinc/73/56/87/1023735687.db2.gz DUUAJJYNPQVQJA-VHSXEESVSA-N 1 1 338.839 3.537 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1NC(C)=O ZINC000156848774 1024631488 /nfs/dbraw/zinc/63/14/88/1024631488.db2.gz LXDSNDOHIDUREM-UHFFFAOYSA-N 1 1 325.456 3.733 20 10 EHCDMO Cc1ccc(CNc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c(O)c1 ZINC000895647575 1024678840 /nfs/dbraw/zinc/67/88/40/1024678840.db2.gz QRPMBRTXIMEUEO-FQEVSTJZSA-N 1 1 337.467 3.597 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(OCC(F)(F)F)c(F)c1 ZINC000896636556 1025789851 /nfs/dbraw/zinc/78/98/51/1025789851.db2.gz FLTSJGPNCNZRHX-UHFFFAOYSA-N 1 1 347.283 3.901 20 10 EHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273569466 1027496908 /nfs/dbraw/zinc/49/69/08/1027496908.db2.gz KHNODVZWQHDQPS-AWEZNQCLSA-N 1 1 343.427 3.603 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccc(F)cc1[O-] ZINC000359872325 1027864396 /nfs/dbraw/zinc/86/43/96/1027864396.db2.gz OSMCEVXXPSLTOJ-DKICVRJWSA-N 1 1 328.431 3.875 20 10 EHCDMO CCOCc1cc(CNC[C@@H]2CC[N@@H+]2C2CCCCC2)ccc1OC ZINC000527753299 1031208603 /nfs/dbraw/zinc/20/86/03/1031208603.db2.gz TZJXCJNMBUJFEN-FQEVSTJZSA-N 1 1 346.515 3.728 20 10 EHCDMO CCOCc1cc(CNC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1OC ZINC000527753299 1031208619 /nfs/dbraw/zinc/20/86/19/1031208619.db2.gz TZJXCJNMBUJFEN-FQEVSTJZSA-N 1 1 346.515 3.728 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](Cc1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000796664115 1031717000 /nfs/dbraw/zinc/71/70/00/1031717000.db2.gz UPYCRNIYTSZORA-PKOBYXMFSA-N 1 1 330.447 3.745 20 10 EHCDMO Cc1cc(C[N@H+](C)[C@H]2CCN(C)[C@@H](C)C2)ccc1N1CCCCC1 ZINC000827972823 1031915763 /nfs/dbraw/zinc/91/57/63/1031915763.db2.gz COCXHWWVIYZVJF-ICSRJNTNSA-N 1 1 329.532 3.900 20 10 EHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(OC)c2O)C12CCC2 ZINC000761202517 1034410814 /nfs/dbraw/zinc/41/08/14/1034410814.db2.gz FQWUMLSICLHVJB-CVEARBPZSA-N 1 1 339.863 3.834 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1O ZINC000761202082 1034412716 /nfs/dbraw/zinc/41/27/16/1034412716.db2.gz KNIGIWDTDZWXJP-MRXNPFEDSA-N 1 1 339.863 3.978 20 10 EHCDMO CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000171936976 1034723875 /nfs/dbraw/zinc/72/38/75/1034723875.db2.gz CQZTZJRIADRIIE-QGZVFWFLSA-N 1 1 340.467 3.650 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccccc1-n1ccnc1 ZINC000190862422 1036284240 /nfs/dbraw/zinc/28/42/40/1036284240.db2.gz SWYFXTFIMUAEOV-UHFFFAOYSA-N 1 1 331.778 3.660 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000363854548 1038689377 /nfs/dbraw/zinc/68/93/77/1038689377.db2.gz MDVNIRIVFTZXAP-TUAOUCFPSA-N 1 1 329.271 3.976 20 10 EHCDMO Cc1nc([C@H]2CC[N@@H+](Cc3cc4oc5ccccc5c4cc3O)C2)no1 ZINC000905685718 1039039676 /nfs/dbraw/zinc/03/96/76/1039039676.db2.gz UXXXDXZKJJZZBK-ZDUSSCGKSA-N 1 1 349.390 3.973 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC000905733467 1039067925 /nfs/dbraw/zinc/06/79/25/1039067925.db2.gz HOUWLHKYQZHYRX-AWEZNQCLSA-N 1 1 339.464 3.852 20 10 EHCDMO COC(=O)C[N@H+](CCC1=CCCCC1)Cc1cc(Cl)ccc1O ZINC001167739323 1039127284 /nfs/dbraw/zinc/12/72/84/1039127284.db2.gz BZXCFSZYYAUXCP-UHFFFAOYSA-N 1 1 337.847 3.911 20 10 EHCDMO COC(=O)C[N@@H+](CCC1=CCCCC1)Cc1cc(Cl)ccc1O ZINC001167739323 1039127296 /nfs/dbraw/zinc/12/72/96/1039127296.db2.gz BZXCFSZYYAUXCP-UHFFFAOYSA-N 1 1 337.847 3.911 20 10 EHCDMO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000924709735 1039616521 /nfs/dbraw/zinc/61/65/21/1039616521.db2.gz ZEPUBEXZTMXTBY-KRWDZBQOSA-N 1 1 343.496 3.703 20 10 EHCDMO C[C@@H]([NH2+]CCOc1ccc(F)c(F)c1)c1cc(F)cc(F)c1O ZINC000756706378 1042025365 /nfs/dbraw/zinc/02/53/65/1042025365.db2.gz MOTGNRCYZOHKKD-SECBINFHSA-N 1 1 329.293 3.678 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c(O)c1OC ZINC000893684587 1043872251 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C[C@H](CCN(C)C)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001648986296 1120324031 /nfs/dbraw/zinc/32/40/31/1120324031.db2.gz RDJMJOSWQRBZJA-MRXNPFEDSA-N 1 1 331.529 3.814 20 10 EHCDMO CCOC(=O)N1CCC([N@@H+](C)Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143112087 1129077065 /nfs/dbraw/zinc/07/70/65/1129077065.db2.gz JROQAFMWYCYWSM-UHFFFAOYSA-N 1 1 348.487 3.742 20 10 EHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)cc1 ZINC000175575933 1123721795 /nfs/dbraw/zinc/72/17/95/1123721795.db2.gz AMKHADHFOICGPX-LBPRGKRZSA-N 1 1 331.387 3.936 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000180272889 1123973374 /nfs/dbraw/zinc/97/33/74/1123973374.db2.gz VNBPUUSLWKSERT-SJLPKXTDSA-N 1 1 333.403 3.993 20 10 EHCDMO COc1ccc(CC[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc1 ZINC000070976373 1125447408 /nfs/dbraw/zinc/44/74/08/1125447408.db2.gz YEHXGDYWLDIISM-FQEVSTJZSA-N 1 1 341.451 3.625 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOc1cccc(F)c1)C[C@H]1CCCO1 ZINC000731845379 1130849326 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1131994839 /nfs/dbraw/zinc/99/48/39/1131994839.db2.gz WMGCTKVVTKUAFP-BRWVUGGUSA-N 1 1 332.488 3.782 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000743870442 1131996265 /nfs/dbraw/zinc/99/62/65/1131996265.db2.gz RJUKBTYIAXUAGT-YWTNHNAXSA-N 1 1 346.515 3.934 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](CO)[C@H](C)c2ccccc2)c1O ZINC000766970058 1132924306 /nfs/dbraw/zinc/92/43/06/1132924306.db2.gz NGIRMXQHMCXKRZ-KZULUSFZSA-N 1 1 347.842 3.502 20 10 EHCDMO C[N@@H+](CCC[NH2+]Cc1cc(Cl)cc(F)c1[O-])C1CCCCC1 ZINC001177071905 1133027880 /nfs/dbraw/zinc/02/78/80/1133027880.db2.gz RSWXQKZKPZVIJO-UHFFFAOYSA-N 1 1 328.859 3.929 20 10 EHCDMO COCC[C@H]1CCCC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000767941177 1133073092 /nfs/dbraw/zinc/07/30/92/1133073092.db2.gz KSESLRWIXRNONR-CQSZACIVSA-N 1 1 339.863 3.887 20 10 EHCDMO COCC[C@H]1CCCC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000767941177 1133073095 /nfs/dbraw/zinc/07/30/95/1133073095.db2.gz KSESLRWIXRNONR-CQSZACIVSA-N 1 1 339.863 3.887 20 10 EHCDMO Cc1ccc(C[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C(C)C)s1 ZINC000768442800 1133139680 /nfs/dbraw/zinc/13/96/80/1133139680.db2.gz NYJCUAKFHAZOFN-KRWDZBQOSA-N 1 1 333.453 3.599 20 10 EHCDMO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)cc1 ZINC000768466600 1133145207 /nfs/dbraw/zinc/14/52/07/1133145207.db2.gz SVYSPSFFBCBMRI-IBGZPJMESA-N 1 1 341.451 3.536 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@@H]2CCCCO2)c1 ZINC001178295249 1133153935 /nfs/dbraw/zinc/15/39/35/1133153935.db2.gz NCZXHEPUKCMIDO-ZDUSSCGKSA-N 1 1 328.250 3.512 20 10 EHCDMO CCC[C@H](C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768915725 1133201991 /nfs/dbraw/zinc/20/19/91/1133201991.db2.gz MKQXZHRRLQGLLX-XJKSGUPXSA-N 1 1 338.879 3.562 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]CC(C)(C)C3=CCCC3)cc2)CC1 ZINC001178871835 1133205865 /nfs/dbraw/zinc/20/58/65/1133205865.db2.gz AZMQPQLGHXTCNC-UHFFFAOYSA-N 1 1 327.516 3.665 20 10 EHCDMO C[NH+]1CCN(c2ccc(CNCc3ccc(F)cc3Cl)cc2)CC1 ZINC001179453224 1133253591 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CCOc1ccc(O)c(C[N@@H+](C)[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000769452277 1133293628 /nfs/dbraw/zinc/29/36/28/1133293628.db2.gz UYGWLTBVFGODQW-LJQANCHMSA-N 1 1 340.467 3.892 20 10 EHCDMO CCC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000769471492 1133298861 /nfs/dbraw/zinc/29/88/61/1133298861.db2.gz UUZZDKMMKYVVPT-KFKAGJAMSA-N 1 1 334.479 3.917 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 ZINC000769540418 1133300376 /nfs/dbraw/zinc/30/03/76/1133300376.db2.gz OZUWEGKMVLNBIR-KKSFZXQISA-N 1 1 340.442 3.855 20 10 EHCDMO COC(=O)C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CCCC1 ZINC000769501334 1133303343 /nfs/dbraw/zinc/30/33/43/1133303343.db2.gz CFCHVXCJKZTTSG-UHFFFAOYSA-N 1 1 330.472 3.595 20 10 EHCDMO CCOc1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c(O)c1 ZINC000769513345 1133306097 /nfs/dbraw/zinc/30/60/97/1133306097.db2.gz BIPJMWNNVOTFEQ-ACJLOTCBSA-N 1 1 333.453 3.814 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c(O)c1 ZINC000769513345 1133306103 /nfs/dbraw/zinc/30/61/03/1133306103.db2.gz BIPJMWNNVOTFEQ-ACJLOTCBSA-N 1 1 333.453 3.814 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)cc1F ZINC000769519252 1133308401 /nfs/dbraw/zinc/30/84/01/1133308401.db2.gz NEXANHBQGJBQCU-SFHVURJKSA-N 1 1 334.479 3.920 20 10 EHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2cc(Br)ccc2O)c1 ZINC000769536511 1133310432 /nfs/dbraw/zinc/31/04/32/1133310432.db2.gz AOXCRRANDRYNLZ-UHFFFAOYSA-N 1 1 349.272 3.853 20 10 EHCDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1cccc(OC)c1O ZINC000770304924 1133409088 /nfs/dbraw/zinc/40/90/88/1133409088.db2.gz MTUQKOBUVKBFNM-QGZVFWFLSA-N 1 1 326.440 3.631 20 10 EHCDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001181234578 1133472563 /nfs/dbraw/zinc/47/25/63/1133472563.db2.gz MEGPOGXPFAUNOR-CQQBXOTJSA-N 1 1 344.499 3.677 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCCN(c2ccccc2F)CC1 ZINC001181575069 1133501597 /nfs/dbraw/zinc/50/15/97/1133501597.db2.gz FDDSJVPDWFISSY-UHFFFAOYSA-N 1 1 336.357 3.522 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCCN(c2ccccc2F)CC1 ZINC001181575069 1133501602 /nfs/dbraw/zinc/50/16/02/1133501602.db2.gz FDDSJVPDWFISSY-UHFFFAOYSA-N 1 1 336.357 3.522 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000771790896 1133595881 /nfs/dbraw/zinc/59/58/81/1133595881.db2.gz JGSFFUPMYBWJQF-UHFFFAOYSA-N 1 1 338.451 3.688 20 10 EHCDMO C[C@@H]([NH2+]CCOC[C@@H]1CCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774187781 1133629248 /nfs/dbraw/zinc/62/92/48/1133629248.db2.gz HHZFGNFFBIXWFJ-MNOVXSKESA-N 1 1 334.243 3.545 20 10 EHCDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3COC[C@H]32)c(O)c(C(C)(C)C)c1 ZINC001182327241 1133633824 /nfs/dbraw/zinc/63/38/24/1133633824.db2.gz QOROLHGRQGDKST-DLBZAZTESA-N 1 1 333.472 3.555 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)CC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774264490 1133649156 /nfs/dbraw/zinc/64/91/56/1133649156.db2.gz DPKSPDRSXQCZOM-BQBZGAKWSA-N 1 1 332.149 3.663 20 10 EHCDMO CC(C)[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C1(CO)CC=CC1 ZINC001182532497 1133697864 /nfs/dbraw/zinc/69/78/64/1133697864.db2.gz DCTBLEGGFKQQKV-MRXNPFEDSA-N 1 1 327.827 3.628 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@@H+](C)CCc2ccc3c(c2)OCO3)cc1 ZINC001183843162 1133863157 /nfs/dbraw/zinc/86/31/57/1133863157.db2.gz HWDNWHNORLOAKX-PLNGDYQASA-N 1 1 338.451 3.669 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000774841267 1134049412 /nfs/dbraw/zinc/04/94/12/1134049412.db2.gz SZAQOELCZCJMLQ-NWANDNLSSA-N 1 1 334.416 3.710 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000774841267 1134049420 /nfs/dbraw/zinc/04/94/20/1134049420.db2.gz SZAQOELCZCJMLQ-NWANDNLSSA-N 1 1 334.416 3.710 20 10 EHCDMO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774908615 1134116283 /nfs/dbraw/zinc/11/62/83/1134116283.db2.gz NLIOGHJZPMSUIK-MRXNPFEDSA-N 1 1 344.411 3.762 20 10 EHCDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774908615 1134116287 /nfs/dbraw/zinc/11/62/87/1134116287.db2.gz NLIOGHJZPMSUIK-MRXNPFEDSA-N 1 1 344.411 3.762 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000774909419 1134116714 /nfs/dbraw/zinc/11/67/14/1134116714.db2.gz MSGKAZAFKGUFQB-SWLSCSKDSA-N 1 1 346.383 3.875 20 10 EHCDMO COc1c(O)c(C[NH2+]CC2(c3ccccc3)CCC2)ccc1[N+](=O)[O-] ZINC000774965828 1134158958 /nfs/dbraw/zinc/15/89/58/1134158958.db2.gz VSYPENMJPXDEMZ-UHFFFAOYSA-N 1 1 342.395 3.521 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1ccsc1)c1cccc(C(F)(F)F)c1O ZINC000788753320 1134165171 /nfs/dbraw/zinc/16/51/71/1134165171.db2.gz IQAVMIKZASMCKF-ZANVPECISA-N 1 1 331.359 3.857 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000774982849 1134179202 /nfs/dbraw/zinc/17/92/02/1134179202.db2.gz KSTQAFAKNZVVHC-UHFFFAOYSA-N 1 1 338.363 3.752 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@@]23CCCN(C(=O)OC(C)(C)C)C3)c1O ZINC000788841647 1134181820 /nfs/dbraw/zinc/18/18/20/1134181820.db2.gz VUYGJERQOBGVMZ-HXUWFJFHSA-N 1 1 346.471 3.676 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000774990655 1134184244 /nfs/dbraw/zinc/18/42/44/1134184244.db2.gz AAJFJOIRLOPTCX-UHFFFAOYSA-N 1 1 344.411 3.685 20 10 EHCDMO CC(C)N1CCC[C@H]([N@@H+](Cc2ccccc2O)C2CCCC2)C1=O ZINC000790288154 1134390285 /nfs/dbraw/zinc/39/02/85/1134390285.db2.gz PHLAYZBLCBVYHZ-SFHVURJKSA-N 1 1 330.472 3.536 20 10 EHCDMO COc1ccc(O[C@H](C)C[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790974347 1134493687 /nfs/dbraw/zinc/49/36/87/1134493687.db2.gz SYVSQZLEWPNBRY-LLVKDONJSA-N 1 1 339.794 3.750 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@H](O)c1cccc(F)c1 ZINC000790973522 1134493702 /nfs/dbraw/zinc/49/37/02/1134493702.db2.gz NIWRMKCGTRIDPG-ABKXIKBNSA-N 1 1 327.758 3.536 20 10 EHCDMO CCCNC(=O)C1([NH2+]Cc2c(O)ccc(Cl)c2F)CCCCC1 ZINC000792175406 1134663703 /nfs/dbraw/zinc/66/37/03/1134663703.db2.gz SVJXMVQCOHLKKI-UHFFFAOYSA-N 1 1 342.842 3.503 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1cccnc1Cl ZINC000772797596 1134686079 /nfs/dbraw/zinc/68/60/79/1134686079.db2.gz GQGUZFIOSCVTKE-CYBMUJFWSA-N 1 1 347.846 3.680 20 10 EHCDMO Fc1cccc(Br)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000792951246 1134832294 /nfs/dbraw/zinc/83/22/94/1134832294.db2.gz PYKXNBVANBSFPS-UHFFFAOYSA-N 1 1 336.204 3.813 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1 ZINC000793604008 1134967757 /nfs/dbraw/zinc/96/77/57/1134967757.db2.gz HPDFHCQVODYERR-FQEVSTJZSA-N 1 1 346.471 3.534 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)Cc3cccc(Cl)c3)cc2)CC1 ZINC000775643210 1135382061 /nfs/dbraw/zinc/38/20/61/1135382061.db2.gz OUEMXPYBJOLTBB-UHFFFAOYSA-N 1 1 343.902 3.724 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)Cc3cccc(Cl)c3)cc2)CC1 ZINC000775643210 1135382067 /nfs/dbraw/zinc/38/20/67/1135382067.db2.gz OUEMXPYBJOLTBB-UHFFFAOYSA-N 1 1 343.902 3.724 20 10 EHCDMO CC[C@@H]([NH2+]CCC[N@@H+](C)CCOC)c1cc(Cl)cc(Cl)c1[O-] ZINC000806131435 1135388365 /nfs/dbraw/zinc/38/83/65/1135388365.db2.gz JHUNQSYJSOSVFG-OAHLLOKOSA-N 1 1 349.302 3.708 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775645586 1135389535 /nfs/dbraw/zinc/38/95/35/1135389535.db2.gz BNAOFKHHWPYCEF-GOSISDBHSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)Cc2ccccc21 ZINC000775645586 1135389539 /nfs/dbraw/zinc/38/95/39/1135389539.db2.gz BNAOFKHHWPYCEF-GOSISDBHSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)Cc2ccccc21 ZINC000775645586 1135389543 /nfs/dbraw/zinc/38/95/43/1135389543.db2.gz BNAOFKHHWPYCEF-GOSISDBHSA-N 1 1 335.495 3.558 20 10 EHCDMO C[C@@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000806172531 1135397904 /nfs/dbraw/zinc/39/79/04/1135397904.db2.gz NSLORTDUAYKCSX-FOIQADDNSA-N 1 1 329.463 3.845 20 10 EHCDMO Cc1cccc(C[N@@H+](Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c1O ZINC000775648635 1135406064 /nfs/dbraw/zinc/40/60/64/1135406064.db2.gz FHLQZIYZZMMVCN-UHFFFAOYSA-N 1 1 337.423 3.760 20 10 EHCDMO Cc1cccc(C[N@H+](Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c1O ZINC000775648635 1135406068 /nfs/dbraw/zinc/40/60/68/1135406068.db2.gz FHLQZIYZZMMVCN-UHFFFAOYSA-N 1 1 337.423 3.760 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3ccsc3)cc2)CC1 ZINC000775652782 1135422494 /nfs/dbraw/zinc/42/24/94/1135422494.db2.gz TVMOAJLFYJHIIX-HXUWFJFHSA-N 1 1 341.524 3.837 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3ccsc3)cc2)CC1 ZINC000775652782 1135422496 /nfs/dbraw/zinc/42/24/96/1135422496.db2.gz TVMOAJLFYJHIIX-HXUWFJFHSA-N 1 1 341.524 3.837 20 10 EHCDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2cc(OC)ccc2O)c1 ZINC000775659183 1135431390 /nfs/dbraw/zinc/43/13/90/1135431390.db2.gz FHDLJFSGDVIBPU-KRWDZBQOSA-N 1 1 327.424 3.617 20 10 EHCDMO CN(C)c1ccc(CN(C(=O)CC[C@@H]2CCCC[N@H+]2C)C2CC2)cc1 ZINC000806422987 1135437356 /nfs/dbraw/zinc/43/73/56/1135437356.db2.gz JVKAHEPRCLKKET-IBGZPJMESA-N 1 1 343.515 3.508 20 10 EHCDMO C[C@H](c1ccco1)[N@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CC1 ZINC000775662197 1135437580 /nfs/dbraw/zinc/43/75/80/1135437580.db2.gz RXTFFVBDDKLKFI-QGZVFWFLSA-N 1 1 339.483 3.757 20 10 EHCDMO C[C@H](c1ccco1)[N@@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CC1 ZINC000775662197 1135437584 /nfs/dbraw/zinc/43/75/84/1135437584.db2.gz RXTFFVBDDKLKFI-QGZVFWFLSA-N 1 1 339.483 3.757 20 10 EHCDMO COC(=O)CC[N@@H+](Cc1ccc(F)c(F)c1)Cc1cccc(C)c1O ZINC000775690343 1135527268 /nfs/dbraw/zinc/52/72/68/1135527268.db2.gz RQHLZVCVVJOETB-UHFFFAOYSA-N 1 1 349.377 3.544 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@H](C)CNC(=O)OC(C)(C)C)c1O ZINC000775698318 1135532311 /nfs/dbraw/zinc/53/23/11/1135532311.db2.gz OPJSKGUSNWXZFY-GFCCVEGCSA-N 1 1 342.867 3.699 20 10 EHCDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(C)c1O ZINC000775723947 1135574849 /nfs/dbraw/zinc/57/48/49/1135574849.db2.gz KPORYZVMUKUJQX-ZDUSSCGKSA-N 1 1 330.291 3.791 20 10 EHCDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775724822 1135579034 /nfs/dbraw/zinc/57/90/34/1135579034.db2.gz NRRMUXDPKDCBOP-UHFFFAOYSA-N 1 1 349.478 3.817 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)Cc3cc4ccccc4o3)cc2)CC1 ZINC000775724822 1135579043 /nfs/dbraw/zinc/57/90/43/1135579043.db2.gz NRRMUXDPKDCBOP-UHFFFAOYSA-N 1 1 349.478 3.817 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)Cc3cc4ccccc4o3)cc2)CC1 ZINC000775724822 1135579045 /nfs/dbraw/zinc/57/90/45/1135579045.db2.gz NRRMUXDPKDCBOP-UHFFFAOYSA-N 1 1 349.478 3.817 20 10 EHCDMO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)C1 ZINC000775735559 1135592471 /nfs/dbraw/zinc/59/24/71/1135592471.db2.gz SDXDVFAUCBFESM-VQTJNVASSA-N 1 1 347.572 3.544 20 10 EHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)C1 ZINC000775735559 1135592474 /nfs/dbraw/zinc/59/24/74/1135592474.db2.gz SDXDVFAUCBFESM-VQTJNVASSA-N 1 1 347.572 3.544 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000775739182 1135597027 /nfs/dbraw/zinc/59/70/27/1135597027.db2.gz MJXJLNZTSKVEAU-SJCJKPOMSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000775739182 1135597032 /nfs/dbraw/zinc/59/70/32/1135597032.db2.gz MJXJLNZTSKVEAU-SJCJKPOMSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000775739182 1135597042 /nfs/dbraw/zinc/59/70/42/1135597042.db2.gz MJXJLNZTSKVEAU-SJCJKPOMSA-N 1 1 338.854 3.633 20 10 EHCDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1cc(-c2ccccc2)ccc1O ZINC000809697371 1135868673 /nfs/dbraw/zinc/86/86/73/1135868673.db2.gz FVTHHVNFLBRKKF-DSMZAQLRSA-N 1 1 335.447 3.914 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)c1O ZINC000809752380 1135885625 /nfs/dbraw/zinc/88/56/25/1135885625.db2.gz QGGSGFFBLCLSEI-SFHVURJKSA-N 1 1 348.450 3.865 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@]2(C)CCCO)c1O ZINC000809757495 1135887342 /nfs/dbraw/zinc/88/73/42/1135887342.db2.gz OHHBPRULFSZXSJ-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]CC3CCC(C)(C)CC3)cc2)CC1 ZINC001201865214 1136067056 /nfs/dbraw/zinc/06/70/56/1136067056.db2.gz SGLPFUKMNTUBBL-UHFFFAOYSA-N 1 1 329.532 3.744 20 10 EHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(C)cc(OC)c1O)C2 ZINC000811792896 1136141554 /nfs/dbraw/zinc/14/15/54/1136141554.db2.gz JKLYRPAMOSFKOK-UHFFFAOYSA-N 1 1 339.435 3.765 20 10 EHCDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825537309 1136165274 /nfs/dbraw/zinc/16/52/74/1136165274.db2.gz VBQMMJJCOWUKBZ-CYBMUJFWSA-N 1 1 342.277 3.793 20 10 EHCDMO CNC(=O)CC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCCCC1 ZINC000850555343 1136284613 /nfs/dbraw/zinc/28/46/13/1136284613.db2.gz KYYIATPHVZFBKH-ZDUSSCGKSA-N 1 1 338.879 3.783 20 10 EHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC12CCC2 ZINC000814171871 1136415354 /nfs/dbraw/zinc/41/53/54/1136415354.db2.gz XKMMRVJYOMHFRL-IBGZPJMESA-N 1 1 332.463 3.673 20 10 EHCDMO CCC[N@@H+](CCC(=O)N1CCc2ccccc21)Cc1ccccc1O ZINC000110990050 1136494923 /nfs/dbraw/zinc/49/49/23/1136494923.db2.gz YEZYYDQBTLOWBT-UHFFFAOYSA-N 1 1 338.451 3.584 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815031422 1136542547 /nfs/dbraw/zinc/54/25/47/1136542547.db2.gz SXCRAEFEXOPALI-MJGOQNOKSA-N 1 1 345.531 3.578 20 10 EHCDMO CCc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)nc1 ZINC000815069899 1136546443 /nfs/dbraw/zinc/54/64/43/1136546443.db2.gz HYKHXIRQRRWVCJ-IBGZPJMESA-N 1 1 326.440 3.531 20 10 EHCDMO CCOC1(C[NH2+]Cc2cc(C)cc(Br)c2O)CCCC1 ZINC000815146763 1136562436 /nfs/dbraw/zinc/56/24/36/1136562436.db2.gz JLAJBJLGCXXNEP-UHFFFAOYSA-N 1 1 342.277 3.902 20 10 EHCDMO Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000815575829 1136613157 /nfs/dbraw/zinc/61/31/57/1136613157.db2.gz BJQGUZRUUKKTIT-VXGBXAGGSA-N 1 1 341.377 3.903 20 10 EHCDMO CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815632250 1136622014 /nfs/dbraw/zinc/62/20/14/1136622014.db2.gz HXTFAUFLQGIJAS-VXGBXAGGSA-N 1 1 346.393 3.614 20 10 EHCDMO COC[C@H]1CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000112960337 1136665209 /nfs/dbraw/zinc/66/52/09/1136665209.db2.gz FKRVBUPTJIBXKX-AWEZNQCLSA-N 1 1 329.440 3.876 20 10 EHCDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816483780 1136723696 /nfs/dbraw/zinc/72/36/96/1136723696.db2.gz DRRKMUYBFWXWKE-MRXNPFEDSA-N 1 1 342.439 3.644 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000816551002 1136733271 /nfs/dbraw/zinc/73/32/71/1136733271.db2.gz LCBJCXIOAGNWEQ-UHFFFAOYSA-N 1 1 335.806 3.980 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](O)c1cc(F)cc(Cl)c1 ZINC000816593918 1136735544 /nfs/dbraw/zinc/73/55/44/1136735544.db2.gz JDQOCEGFARFSFK-HNNXBMFYSA-N 1 1 348.176 3.800 20 10 EHCDMO OC[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CC[C@H]1C(F)(F)F ZINC000816607664 1136740489 /nfs/dbraw/zinc/74/04/89/1136740489.db2.gz BHORWTOLGBERIK-GDBMZVCRSA-N 1 1 339.357 3.538 20 10 EHCDMO CCCn1ccnc1CCC[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816611625 1136740795 /nfs/dbraw/zinc/74/07/95/1136740795.db2.gz UEJURJKPVLHOJY-UHFFFAOYSA-N 1 1 339.842 3.856 20 10 EHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816611625 1136740797 /nfs/dbraw/zinc/74/07/97/1136740797.db2.gz UEJURJKPVLHOJY-UHFFFAOYSA-N 1 1 339.842 3.856 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000816614847 1136741667 /nfs/dbraw/zinc/74/16/67/1136741667.db2.gz HDMRVQKHTVLZRB-OAHLLOKOSA-N 1 1 346.833 3.822 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000816614847 1136741669 /nfs/dbraw/zinc/74/16/69/1136741669.db2.gz HDMRVQKHTVLZRB-OAHLLOKOSA-N 1 1 346.833 3.822 20 10 EHCDMO CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C[N@@H+](C)CC(C)(C)C ZINC001135967902 1136830595 /nfs/dbraw/zinc/83/05/95/1136830595.db2.gz AGFCWHCTEGVHCO-UHFFFAOYSA-N 1 1 345.531 3.613 20 10 EHCDMO CC[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cccc(Cl)c1[O-] ZINC000817939908 1136847437 /nfs/dbraw/zinc/84/74/37/1136847437.db2.gz IAGSTRBVMRIBQP-KRWDZBQOSA-N 1 1 333.863 3.661 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc2ccccc2n1 ZINC000817942505 1136849456 /nfs/dbraw/zinc/84/94/56/1136849456.db2.gz PCXJQVIZENCHMC-BEFAXECRSA-N 1 1 334.467 3.651 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1[O-] ZINC000817976560 1136854216 /nfs/dbraw/zinc/85/42/16/1136854216.db2.gz NLTHIVNZVGRFKU-UKRRQHHQSA-N 1 1 328.378 3.594 20 10 EHCDMO C[NH+](C)CCCCCCC[NH2+]Cc1c([O-])cccc1Br ZINC000858109004 1136940695 /nfs/dbraw/zinc/94/06/95/1136940695.db2.gz OBNKVDFTBGHQNL-UHFFFAOYSA-N 1 1 343.309 3.756 20 10 EHCDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858135835 1136942637 /nfs/dbraw/zinc/94/26/37/1136942637.db2.gz DUSTWCFJHCRTSP-INIZCTEOSA-N 1 1 348.393 3.653 20 10 EHCDMO CC(C)c1cc(C[NH2+]Cc2c(O)cccc2Br)on1 ZINC000858137631 1136942791 /nfs/dbraw/zinc/94/27/91/1136942791.db2.gz UZOOMBSWLCYHOG-UHFFFAOYSA-N 1 1 325.206 3.556 20 10 EHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858145997 1136943528 /nfs/dbraw/zinc/94/35/28/1136943528.db2.gz MSVPYCDYRSUVDG-KRWDZBQOSA-N 1 1 348.393 3.653 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](CCCO)C2CC2)cc1 ZINC000823448220 1137100051 /nfs/dbraw/zinc/10/00/51/1137100051.db2.gz VENDSIXJZZSJJT-UHFFFAOYSA-N 1 1 330.497 3.731 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000862247864 1137134938 /nfs/dbraw/zinc/13/49/38/1137134938.db2.gz CVPLNCBRUNZJLA-MRXNPFEDSA-N 1 1 340.261 3.547 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2c(C3CCC3)cnn2C)C2CC2)cc1 ZINC000824555139 1137142521 /nfs/dbraw/zinc/14/25/21/1137142521.db2.gz BXFCAWFUKVGMQN-UHFFFAOYSA-N 1 1 338.499 3.918 20 10 EHCDMO COCc1csc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)c1 ZINC000824606672 1137144870 /nfs/dbraw/zinc/14/48/70/1137144870.db2.gz VDIJLUQOLODIKW-UHFFFAOYSA-N 1 1 346.496 3.615 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1O ZINC000824636870 1137145566 /nfs/dbraw/zinc/14/55/66/1137145566.db2.gz UPDFFXOXVKBYMV-MJGOQNOKSA-N 1 1 349.833 3.654 20 10 EHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3c(O)cccc3Br)C2)cc1 ZINC000862540715 1137149150 /nfs/dbraw/zinc/14/91/50/1137149150.db2.gz KMQNMEWTGNRIRG-CYBMUJFWSA-N 1 1 348.240 3.850 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824892915 1137155857 /nfs/dbraw/zinc/15/58/57/1137155857.db2.gz FNUMIQSHFOKDBQ-CJNGLKHVSA-N 1 1 339.838 3.966 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824892915 1137155859 /nfs/dbraw/zinc/15/58/59/1137155859.db2.gz FNUMIQSHFOKDBQ-CJNGLKHVSA-N 1 1 339.838 3.966 20 10 EHCDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)c2nccn21 ZINC000825017502 1137162238 /nfs/dbraw/zinc/16/22/38/1137162238.db2.gz STPLUARTCFZWRJ-NHYWBVRUSA-N 1 1 338.377 3.764 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)C[C@H](c2ccsc2)O1 ZINC000119945861 1137219714 /nfs/dbraw/zinc/21/97/14/1137219714.db2.gz RLPSNCPBPKFXSG-BFUOFWGJSA-N 1 1 329.465 3.904 20 10 EHCDMO COCC[C@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299940 1137268815 /nfs/dbraw/zinc/26/88/15/1137268815.db2.gz MWKCHXGAZOGCTD-GFCCVEGCSA-N 1 1 346.240 3.685 20 10 EHCDMO COCC[C@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299940 1137268817 /nfs/dbraw/zinc/26/88/17/1137268817.db2.gz MWKCHXGAZOGCTD-GFCCVEGCSA-N 1 1 346.240 3.685 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3cccnc3Br)ccc21 ZINC000865437523 1137283708 /nfs/dbraw/zinc/28/37/08/1137283708.db2.gz PCSJXGROOPQXOK-UHFFFAOYSA-N 1 1 346.272 3.516 20 10 EHCDMO C[C@H]([NH2+]Cc1cccnc1Br)c1ccc(N(C)C)cc1 ZINC000865531319 1137292347 /nfs/dbraw/zinc/29/23/47/1137292347.db2.gz HWPCXJUFQJKCHT-LBPRGKRZSA-N 1 1 334.261 3.761 20 10 EHCDMO C[N@H+](Cc1c(O)cc(O)cc1O)Cc1c(Cl)cccc1Cl ZINC001144508881 1137303373 /nfs/dbraw/zinc/30/33/73/1137303373.db2.gz BNVJSZBHYXGGIE-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO C[N@@H+](Cc1c(O)cc(O)cc1O)Cc1c(Cl)cccc1Cl ZINC001144508881 1137303374 /nfs/dbraw/zinc/30/33/74/1137303374.db2.gz BNVJSZBHYXGGIE-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2c(O)cc(O)cc2O)cc1 ZINC001144514482 1137304243 /nfs/dbraw/zinc/30/42/43/1137304243.db2.gz HKCKIRMZFMZOQZ-KRWDZBQOSA-N 1 1 329.396 3.539 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2noc3cc(F)ccc23)ccc1OC ZINC000865836978 1137315694 /nfs/dbraw/zinc/31/56/94/1137315694.db2.gz ZQVJPNKHBABBDY-UHFFFAOYSA-N 1 1 344.386 3.802 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1F ZINC000846044669 1137329703 /nfs/dbraw/zinc/32/97/03/1137329703.db2.gz IJLPHCPQTQZGCX-AWEZNQCLSA-N 1 1 334.347 3.689 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846216418 1137341892 /nfs/dbraw/zinc/34/18/92/1137341892.db2.gz SBETYWUCSICASG-ZYHUDNBSSA-N 1 1 346.254 3.803 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc3cnccc3o2)c1 ZINC000866621803 1137370373 /nfs/dbraw/zinc/37/03/73/1137370373.db2.gz VIDPGLBFGVSBQU-NWDGAFQWSA-N 1 1 340.379 3.732 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CCCC(=O)N(C)C)Cc1ccccc1O ZINC000846841423 1137371024 /nfs/dbraw/zinc/37/10/24/1137371024.db2.gz MVSFTTFNLZTAME-QGZVFWFLSA-N 1 1 340.467 3.824 20 10 EHCDMO C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Br)cc2[O-])CC1 ZINC000715584248 1137477370 /nfs/dbraw/zinc/47/73/70/1137477370.db2.gz PDNRJSRLMKCNHV-UHFFFAOYSA-N 1 1 341.293 3.507 20 10 EHCDMO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000872135633 1137573545 /nfs/dbraw/zinc/57/35/45/1137573545.db2.gz XNADQJLFWCOXBQ-MWLCHTKSSA-N 1 1 325.334 3.921 20 10 EHCDMO CO[C@H](C[N@@H+](Cc1ccccc1O)C1CCCC1)C1CCOCC1 ZINC000876722583 1137659746 /nfs/dbraw/zinc/65/97/46/1137659746.db2.gz ZFYQRAWZCCAYOL-HXUWFJFHSA-N 1 1 333.472 3.578 20 10 EHCDMO OC1CCN(c2ccc(CNc3ccc(C4CCC4)c[nH+]3)cc2)CC1 ZINC000877553529 1137681194 /nfs/dbraw/zinc/68/11/94/1137681194.db2.gz UZLDDKYXTSPNCO-UHFFFAOYSA-N 1 1 337.467 3.922 20 10 EHCDMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000877835988 1137692962 /nfs/dbraw/zinc/69/29/62/1137692962.db2.gz KPAGTUINEYSFDF-GOSISDBHSA-N 1 1 341.451 3.564 20 10 EHCDMO OCC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)cc1 ZINC000883119947 1137845323 /nfs/dbraw/zinc/84/53/23/1137845323.db2.gz OJFBWNAKNXCZQM-HNNXBMFYSA-N 1 1 327.758 3.537 20 10 EHCDMO Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883289201 1137852881 /nfs/dbraw/zinc/85/28/81/1137852881.db2.gz HMSCGIVHAARCDJ-INIZCTEOSA-N 1 1 329.513 3.659 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1OC(F)F ZINC000886498490 1138083948 /nfs/dbraw/zinc/08/39/48/1138083948.db2.gz DIYXDMBSVWENNL-JTQLQIEISA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1c(O)cccc1F ZINC000886502939 1138085326 /nfs/dbraw/zinc/08/53/26/1138085326.db2.gz USJQTSGMODJZTN-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO COc1cccc(N2CC[C@@H](C[NH2+][C@@H](C)c3c(O)cccc3F)C2)c1 ZINC000886520859 1138088980 /nfs/dbraw/zinc/08/89/80/1138088980.db2.gz OSYSSYRITFVADX-GJZGRUSLSA-N 1 1 344.430 3.717 20 10 EHCDMO CC(C)Oc1cccc([C@H](O)C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886528811 1138090933 /nfs/dbraw/zinc/09/09/33/1138090933.db2.gz RTSNNIKLADEQCJ-FZKQIMNGSA-N 1 1 333.403 3.703 20 10 EHCDMO C[C@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1c(O)cccc1F ZINC000886553686 1138095419 /nfs/dbraw/zinc/09/54/19/1138095419.db2.gz SWXMCCGDUHNVNO-GOEBONIOSA-N 1 1 331.431 3.984 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886558069 1138096653 /nfs/dbraw/zinc/09/66/53/1138096653.db2.gz ASHJTKPZNUEEJB-QMTHXVAHSA-N 1 1 343.320 3.934 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)c1O ZINC000092975654 1138233608 /nfs/dbraw/zinc/23/36/08/1138233608.db2.gz WYLLTKZPLNDKIY-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)c1O ZINC000092975654 1138233609 /nfs/dbraw/zinc/23/36/09/1138233609.db2.gz WYLLTKZPLNDKIY-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO CC[N@@H+](Cc1cncs1)Cc1cc(Br)ccc1O ZINC000093866939 1138242056 /nfs/dbraw/zinc/24/20/56/1138242056.db2.gz IYFBTBWPLRXGIF-UHFFFAOYSA-N 1 1 327.247 3.633 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cn2cccnc2n1)C1CCCCC1 ZINC000264890876 1138668782 /nfs/dbraw/zinc/66/87/82/1138668782.db2.gz FRYNUOJWZXEDEJ-UHFFFAOYSA-N 1 1 336.439 3.770 20 10 EHCDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179575519 1139766389 /nfs/dbraw/zinc/76/63/89/1139766389.db2.gz DMLWOFYAPIJWCQ-HUUCEWRRSA-N 1 1 334.460 3.517 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)c1O ZINC000180503500 1139840207 /nfs/dbraw/zinc/84/02/07/1139840207.db2.gz UHFBTWORYCAXBC-QFIPXVFZSA-N 1 1 337.872 3.723 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cc1OC ZINC000183447262 1140038853 /nfs/dbraw/zinc/03/88/53/1140038853.db2.gz WUTPUJWMOAGGRZ-QGZVFWFLSA-N 1 1 342.439 3.922 20 10 EHCDMO CCC[N@@H+](Cc1cc(-c2cnn(C)c2C)no1)Cc1ccccc1O ZINC000184589993 1140110737 /nfs/dbraw/zinc/11/07/37/1140110737.db2.gz JHPWMNACMZROJF-UHFFFAOYSA-N 1 1 340.427 3.501 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1O ZINC000186196471 1140191545 /nfs/dbraw/zinc/19/15/45/1140191545.db2.gz GRTRWGGRPDDBSV-JDNHERCYSA-N 1 1 327.758 3.708 20 10 EHCDMO COc1ccsc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000271027225 1141296696 /nfs/dbraw/zinc/29/66/96/1141296696.db2.gz WRYUSAMFHYXBLA-OAHLLOKOSA-N 1 1 333.453 3.644 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3OC)C2)c(O)cc1C ZINC000160276885 1016414736 /nfs/dbraw/zinc/41/47/36/1016414736.db2.gz DWXKKMJMNPAZLF-OAHLLOKOSA-N 1 1 327.424 3.707 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(O)cccc1Br ZINC001140103305 1016744063 /nfs/dbraw/zinc/74/40/63/1016744063.db2.gz IXFJPGNPDODHLJ-UHFFFAOYSA-N 1 1 336.229 3.882 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3ccsc3)C1)CCCC2 ZINC000160396288 1018707065 /nfs/dbraw/zinc/70/70/65/1018707065.db2.gz VSRAOZJVYNLRDK-LJQANCHMSA-N 1 1 329.465 3.906 20 10 EHCDMO CC[C@H]([NH2+]C1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(C)cc1O ZINC000280265777 1020233814 /nfs/dbraw/zinc/23/38/14/1020233814.db2.gz XNXRHJHSBMZYFS-SLFFLAALSA-N 1 1 346.515 3.509 20 10 EHCDMO Cn1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c1C1CC1 ZINC000891401150 1020918143 /nfs/dbraw/zinc/91/81/43/1020918143.db2.gz ZGJQXFKEYGMJML-UHFFFAOYSA-N 1 1 338.499 3.920 20 10 EHCDMO Cc1cnc(CC[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)cn1 ZINC000834909917 1021131279 /nfs/dbraw/zinc/13/12/79/1021131279.db2.gz UWXHHFZTPDTYTE-JTQLQIEISA-N 1 1 326.227 3.691 20 10 EHCDMO CCOC(=O)N[C@@H](C[NH2+][C@@H](CC)c1ccc(F)cc1O)CC(C)C ZINC000796677215 1021401108 /nfs/dbraw/zinc/40/11/08/1021401108.db2.gz AYIGKJIANSDWIG-ZBFHGGJFSA-N 1 1 340.439 3.733 20 10 EHCDMO COCC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@H](C)c1ccccc1 ZINC000891677861 1022287619 /nfs/dbraw/zinc/28/76/19/1022287619.db2.gz NIKYIJQNDPFAGN-OAHLLOKOSA-N 1 1 345.439 3.619 20 10 EHCDMO COCC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(C)o1 ZINC000293668897 1022887264 /nfs/dbraw/zinc/88/72/64/1022887264.db2.gz QHCZJKWZRKHRBL-CQSZACIVSA-N 1 1 327.783 3.954 20 10 EHCDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 ZINC000843776481 1024453982 /nfs/dbraw/zinc/45/39/82/1024453982.db2.gz OODMEYCBUZCQQA-INIZCTEOSA-N 1 1 342.487 3.511 20 10 EHCDMO CC[N@@H+](Cc1cn(C)nc1-c1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000156847796 1024629920 /nfs/dbraw/zinc/62/99/20/1024629920.db2.gz XILLSQRIQGDEOX-UHFFFAOYSA-N 1 1 349.482 3.570 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000281078444 1024634161 /nfs/dbraw/zinc/63/41/61/1024634161.db2.gz JCLZJOVITRSTSA-MRVPVSSYSA-N 1 1 329.293 3.808 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2Cc3ccccc3OC3(CCOCC3)C2)c1 ZINC000896442605 1025452096 /nfs/dbraw/zinc/45/20/96/1025452096.db2.gz XFXVFYTXPAIPDS-UHFFFAOYSA-N 1 1 339.435 3.644 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3nc4c(s3)CCC4)C2)c1 ZINC000896515791 1025525153 /nfs/dbraw/zinc/52/51/53/1025525153.db2.gz JQNGOQUEKIBWKW-ZDUSSCGKSA-N 1 1 344.480 3.726 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCOc3ccccc32)c1 ZINC000273368940 1027398627 /nfs/dbraw/zinc/39/86/27/1027398627.db2.gz CBZAMABDJBXYLK-DYVFJYSZSA-N 1 1 341.407 3.743 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Br)ccc1O ZINC000273458036 1027439893 /nfs/dbraw/zinc/43/98/93/1027439893.db2.gz HMYUJXRIYXXUDO-RNCFNFMXSA-N 1 1 336.233 3.606 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Br)ccc1O ZINC000273458033 1027439972 /nfs/dbraw/zinc/43/99/72/1027439972.db2.gz HMYUJXRIYXXUDO-NOZJJQNGSA-N 1 1 336.233 3.606 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000273584238 1027505809 /nfs/dbraw/zinc/50/58/09/1027505809.db2.gz NHRAEBHFSGGVLF-GTNSWQLSSA-N 1 1 329.371 3.656 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000840892950 1027593036 /nfs/dbraw/zinc/59/30/36/1027593036.db2.gz FILOUNJVBWTJKE-QGZVFWFLSA-N 1 1 331.548 3.845 20 10 EHCDMO C[C@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278654415 1031843575 /nfs/dbraw/zinc/84/35/75/1031843575.db2.gz IGWDLMXJNCROJK-KGFZYKRKSA-N 1 1 332.149 3.663 20 10 EHCDMO C[C@@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278654437 1031843401 /nfs/dbraw/zinc/84/34/01/1031843401.db2.gz IGWDLMXJNCROJK-KSBSHMNSSA-N 1 1 332.149 3.663 20 10 EHCDMO CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1cc(Br)ccc1[O-] ZINC000229546812 1034233145 /nfs/dbraw/zinc/23/31/45/1034233145.db2.gz QTSIDPCIHOCESK-OAHLLOKOSA-N 1 1 343.309 3.926 20 10 EHCDMO CC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1cc(Br)ccc1[O-] ZINC000229546812 1034233163 /nfs/dbraw/zinc/23/31/63/1034233163.db2.gz QTSIDPCIHOCESK-OAHLLOKOSA-N 1 1 343.309 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C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000769474002 1133298805 /nfs/dbraw/zinc/29/88/05/1133298805.db2.gz QVMLTQFAVCTURV-FOIQADDNSA-N 1 1 328.431 3.854 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3ccccc3OC)C2)c(O)c1 ZINC000769475188 1133299604 /nfs/dbraw/zinc/29/96/04/1133299604.db2.gz VGZYMYMFUCIUCU-OAHLLOKOSA-N 1 1 327.424 3.789 20 10 EHCDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769497455 1133301328 /nfs/dbraw/zinc/30/13/28/1133301328.db2.gz FARIIZAQZABHSQ-GCJKJVERSA-N 1 1 336.479 3.901 20 10 EHCDMO CCc1cccc(C[N@@H+](CC)C[C@H]2COc3ccccc3O2)c1O ZINC001179913893 1133305800 /nfs/dbraw/zinc/30/58/00/1133305800.db2.gz LZOASSRNKXSERJ-KRWDZBQOSA-N 1 1 327.424 3.617 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000769544627 1133312467 /nfs/dbraw/zinc/31/24/67/1133312467.db2.gz ZKQPCPARKDNDHP-SFHVURJKSA-N 1 1 341.451 3.625 20 10 EHCDMO CC[N@H+]1C[C@H](C)N(Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@H]1C ZINC001180141609 1133330375 /nfs/dbraw/zinc/33/03/75/1133330375.db2.gz HAFVUUWJKXCFGI-KGLIPLIRSA-N 1 1 343.437 3.686 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCSC(C)(C)C2)c1O ZINC001180199750 1133348696 /nfs/dbraw/zinc/34/86/96/1133348696.db2.gz XKUFRCANBHAYBN-UHFFFAOYSA-N 1 1 330.291 3.791 20 10 EHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2c(C)cc(OC)cc2O)o1 ZINC001180601730 1133397336 /nfs/dbraw/zinc/39/73/36/1133397336.db2.gz CFIBDBPIHCEXBF-QGZVFWFLSA-N 1 1 331.412 3.786 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)OCCO2 ZINC000771533668 1133570601 /nfs/dbraw/zinc/57/06/01/1133570601.db2.gz PYSUHVIYHLDVFI-UHFFFAOYSA-N 1 1 326.440 3.546 20 10 EHCDMO C[C@@H]1CN(Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@H](C)[N@@H+]1C ZINC001182114576 1133573611 /nfs/dbraw/zinc/57/36/11/1133573611.db2.gz AJTYLMWTNJYCTD-KDURUIRLSA-N 1 1 349.522 3.774 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@H](C)N1C ZINC001182114576 1133573615 /nfs/dbraw/zinc/57/36/15/1133573615.db2.gz AJTYLMWTNJYCTD-KDURUIRLSA-N 1 1 349.522 3.774 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@H](C)N1C ZINC001182114576 1133573621 /nfs/dbraw/zinc/57/36/21/1133573621.db2.gz AJTYLMWTNJYCTD-KDURUIRLSA-N 1 1 349.522 3.774 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cc(Cl)c(Cl)cc1O ZINC000774165682 1133626438 /nfs/dbraw/zinc/62/64/38/1133626438.db2.gz QRWCUTRDHBCLIZ-WCQYABFASA-N 1 1 340.250 3.953 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C2CCC2)C2CCCC2)ccc1[N+](=O)[O-] ZINC001182543235 1133699387 /nfs/dbraw/zinc/69/93/87/1133699387.db2.gz JWXJPZYYGTWLQH-MRXNPFEDSA-N 1 1 334.416 3.758 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+]C(C)(C)C2CCOCC2)c1O ZINC000786163515 1133809580 /nfs/dbraw/zinc/80/95/80/1133809580.db2.gz QAGZNSRBTTUJKB-UHFFFAOYSA-N 1 1 325.836 3.543 20 10 EHCDMO Cc1ccc(C[N@H+](C)Cc2cc(C)c(Br)cc2O)cn1 ZINC001250133669 1133870828 /nfs/dbraw/zinc/87/08/28/1133870828.db2.gz OMJNFKXWNIRZIV-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO CC(C)[N@H+]1CCCC[C@@H]1CN(Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000787729532 1134036060 /nfs/dbraw/zinc/03/60/60/1134036060.db2.gz IZSNLNWWLQSMDT-UXHICEINSA-N 1 1 346.515 3.636 20 10 EHCDMO CC(C)N1CCCC[C@@H]1C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000787729532 1134036066 /nfs/dbraw/zinc/03/60/66/1134036066.db2.gz IZSNLNWWLQSMDT-UXHICEINSA-N 1 1 346.515 3.636 20 10 EHCDMO CC(C)N1CCCC[C@@H]1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000787729532 1134036072 /nfs/dbraw/zinc/03/60/72/1134036072.db2.gz IZSNLNWWLQSMDT-UXHICEINSA-N 1 1 346.515 3.636 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCC(F)(F)C1)C[C@H]1CCCO1 ZINC000787731906 1134036476 /nfs/dbraw/zinc/03/64/76/1134036476.db2.gz UDSARSQPFJTDPT-GDBMZVCRSA-N 1 1 325.399 3.809 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000774911154 1134118284 /nfs/dbraw/zinc/11/82/84/1134118284.db2.gz VYUHFZJALAXBIG-MLGOLLRUSA-N 1 1 328.368 3.502 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000788564768 1134141215 /nfs/dbraw/zinc/14/12/15/1134141215.db2.gz SZIQNZJGRPDSLQ-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774961937 1134155415 /nfs/dbraw/zinc/15/54/15/1134155415.db2.gz GLZDBAPLHBETDJ-MRXNPFEDSA-N 1 1 344.411 3.838 20 10 EHCDMO C[C@H]([NH2+]CCOc1ncccc1F)c1cccc(C(F)(F)F)c1O ZINC000788668457 1134159258 /nfs/dbraw/zinc/15/92/58/1134159258.db2.gz BAIJIBGFSFAAMI-JTQLQIEISA-N 1 1 344.308 3.675 20 10 EHCDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000789593416 1134304599 /nfs/dbraw/zinc/30/45/99/1134304599.db2.gz PUDKZKBWGPWVLJ-INIZCTEOSA-N 1 1 342.277 3.528 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)cc1C(C)C ZINC000790403088 1134416861 /nfs/dbraw/zinc/41/68/61/1134416861.db2.gz MNBJHZJGTUQNOL-YRNRMSPPSA-N 1 1 333.472 3.592 20 10 EHCDMO C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790950305 1134484204 /nfs/dbraw/zinc/48/42/04/1134484204.db2.gz VRLOUCJXEFVUFM-ZDUSSCGKSA-N 1 1 328.859 3.786 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000790974895 1134493923 /nfs/dbraw/zinc/49/39/23/1134493923.db2.gz YZIFYLSEYSNROR-UHFFFAOYSA-N 1 1 335.806 3.980 20 10 EHCDMO C[C@@H](NC(=O)CC[N@@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000791137105 1134513175 /nfs/dbraw/zinc/51/31/75/1134513175.db2.gz AOVGTTUNWQOVFH-MRXNPFEDSA-N 1 1 331.504 3.584 20 10 EHCDMO COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792174366 1134663225 /nfs/dbraw/zinc/66/32/25/1134663225.db2.gz UHCHBFRNVVIMPQ-LLVKDONJSA-N 1 1 343.826 3.596 20 10 EHCDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792174366 1134663230 /nfs/dbraw/zinc/66/32/30/1134663230.db2.gz UHCHBFRNVVIMPQ-LLVKDONJSA-N 1 1 343.826 3.596 20 10 EHCDMO CC(C)[N@@H+](CC(=O)NCCC(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC001190437120 1134699975 /nfs/dbraw/zinc/69/99/75/1134699975.db2.gz SRTAXCCLJYEXKR-UHFFFAOYSA-N 1 1 333.520 3.515 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC3(C2)CCOCC3)c(C(F)(F)F)c1 ZINC000792836171 1134800156 /nfs/dbraw/zinc/80/01/56/1134800156.db2.gz UAZBQWRZBCTLOZ-UHFFFAOYSA-N 1 1 342.405 3.774 20 10 EHCDMO COc1ccc(CNC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c(O)c1 ZINC000793390883 1134922059 /nfs/dbraw/zinc/92/20/59/1134922059.db2.gz TYJJNMXOBMCDDR-MAUKXSAKSA-N 1 1 332.488 3.534 20 10 EHCDMO COCCC1(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)CCCCC1 ZINC000775588637 1135121940 /nfs/dbraw/zinc/12/19/40/1135121940.db2.gz KTVLNIYSAHSXDY-HNNXBMFYSA-N 1 1 349.471 3.816 20 10 EHCDMO CCCCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000775668376 1135453496 /nfs/dbraw/zinc/45/34/96/1135453496.db2.gz YELMNPCHHARGHB-GOSISDBHSA-N 1 1 332.488 3.609 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000775669859 1135464234 /nfs/dbraw/zinc/46/42/34/1135464234.db2.gz RKJJLMIOHAJRAP-OAHLLOKOSA-N 1 1 326.843 3.635 20 10 EHCDMO COc1cc(OC)cc(OCCC[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000775738071 1135600712 /nfs/dbraw/zinc/60/07/12/1135600712.db2.gz ZEXDDMRBQQGHHQ-UHFFFAOYSA-N 1 1 345.439 3.619 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c1O ZINC000808236529 1135639457 /nfs/dbraw/zinc/63/94/57/1135639457.db2.gz GAUJAFXVZCBYGW-UHFFFAOYSA-N 1 1 327.424 3.882 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc(C)c1O ZINC000809538879 1135848927 /nfs/dbraw/zinc/84/89/27/1135848927.db2.gz UUOQSTHGVVMNLF-LJQANCHMSA-N 1 1 341.451 3.896 20 10 EHCDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC000809697593 1135868085 /nfs/dbraw/zinc/86/80/85/1135868085.db2.gz JSUQHLNUGDXYKA-GBMAXXPESA-N 1 1 326.484 3.532 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC001199052868 1135876450 /nfs/dbraw/zinc/87/64/50/1135876450.db2.gz OVSALSMDTZIKQJ-NJDAHSKKSA-N 1 1 341.543 3.887 20 10 EHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000809768279 1135880874 /nfs/dbraw/zinc/88/08/74/1135880874.db2.gz GTDKQZHXEQYZIM-MFKMUULPSA-N 1 1 328.250 3.926 20 10 EHCDMO C[NH+](C)CCN(Cc1cccc(F)c1)Cc1cccc(Cl)c1O ZINC000809737148 1135882131 /nfs/dbraw/zinc/88/21/31/1135882131.db2.gz DAXBIOSAVQSLGM-UHFFFAOYSA-N 1 1 336.838 3.749 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)C1CCOCC1 ZINC000776029713 1135933830 /nfs/dbraw/zinc/93/38/30/1135933830.db2.gz NGVAXPWWLPGATJ-INIZCTEOSA-N 1 1 325.836 3.543 20 10 EHCDMO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001201686085 1136056705 /nfs/dbraw/zinc/05/67/05/1136056705.db2.gz ZJPKMBICMMZCNS-JPYJTQIMSA-N 1 1 349.522 3.852 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@@H]1[C@@H]1CCCO1)CCCC2 ZINC000811791226 1136140812 /nfs/dbraw/zinc/14/08/12/1136140812.db2.gz RTDIVCZDSVZYOF-PMACEKPBSA-N 1 1 327.468 3.805 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812736846 1136240092 /nfs/dbraw/zinc/24/00/92/1136240092.db2.gz OQKGHEJUKDNDMY-KGLIPLIRSA-N 1 1 332.394 3.848 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1cccc(OC)c1 ZINC000850514031 1136274857 /nfs/dbraw/zinc/27/48/57/1136274857.db2.gz KSJUITLHZJHZRI-GTNSWQLSSA-N 1 1 337.366 3.717 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000850549097 1136283190 /nfs/dbraw/zinc/28/31/90/1136283190.db2.gz DLGIKHMUGJRHEM-BLQFLSLASA-N 1 1 339.382 3.797 20 10 EHCDMO C[N@H+](CC(=O)Nc1cccc(Cl)c1Cl)Cc1ccccc1O ZINC000109769309 1136339781 /nfs/dbraw/zinc/33/97/81/1136339781.db2.gz RBSHLRSUGSDETP-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1cccc(Cl)c1Cl)Cc1ccccc1O ZINC000109769309 1136339784 /nfs/dbraw/zinc/33/97/84/1136339784.db2.gz RBSHLRSUGSDETP-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO CC(C)(C)c1cc(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000814171002 1136415052 /nfs/dbraw/zinc/41/50/52/1136415052.db2.gz GPBSENWGFMDRQW-FVQHAEBGSA-N 1 1 331.500 3.657 20 10 EHCDMO CCN(C(=O)C[N@@H+](C)Cc1ccccc1O)[C@H](C)c1ccc(F)cc1 ZINC000111235812 1136524358 /nfs/dbraw/zinc/52/43/58/1136524358.db2.gz DGHFVSJFLNQKOD-OAHLLOKOSA-N 1 1 344.430 3.573 20 10 EHCDMO Cc1sc2nc([C@@H](C)[N@H+](C)Cc3ccccc3O)nc(N)c2c1C ZINC000111235083 1136524491 /nfs/dbraw/zinc/52/44/91/1136524491.db2.gz XUHNGHNFSZFECN-LLVKDONJSA-N 1 1 342.468 3.789 20 10 EHCDMO Cc1sc2nc([C@@H](C)[N@@H+](C)Cc3ccccc3O)nc(N)c2c1C ZINC000111235083 1136524494 /nfs/dbraw/zinc/52/44/94/1136524494.db2.gz XUHNGHNFSZFECN-LLVKDONJSA-N 1 1 342.468 3.789 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc1 ZINC001134810957 1136536131 /nfs/dbraw/zinc/53/61/31/1136536131.db2.gz BNASTNOANXPJCJ-UHFFFAOYSA-N 1 1 339.483 3.556 20 10 EHCDMO Cc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089101 1136543857 /nfs/dbraw/zinc/54/38/57/1136543857.db2.gz OBAMFQRKOKEJCZ-HKUYNNGSSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(CN[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089101 1136543859 /nfs/dbraw/zinc/54/38/59/1136543859.db2.gz OBAMFQRKOKEJCZ-HKUYNNGSSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(CN[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089101 1136543863 /nfs/dbraw/zinc/54/38/63/1136543863.db2.gz OBAMFQRKOKEJCZ-HKUYNNGSSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c1 ZINC000853552116 1136543878 /nfs/dbraw/zinc/54/38/78/1136543878.db2.gz VSVLNSUISIYGQV-LJQANCHMSA-N 1 1 327.424 3.956 20 10 EHCDMO [O-]c1ccc(Br)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815152065 1136557389 /nfs/dbraw/zinc/55/73/89/1136557389.db2.gz YKMKSIBEONQACO-UHFFFAOYSA-N 1 1 341.293 3.510 20 10 EHCDMO C[C@@H](CN1CCCCC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815559141 1136610733 /nfs/dbraw/zinc/61/07/33/1136610733.db2.gz YTXMTHYLKSROSD-STQMWFEESA-N 1 1 330.394 3.936 20 10 EHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2[O-])C1 ZINC000815564053 1136611357 /nfs/dbraw/zinc/61/13/57/1136611357.db2.gz WAPNTVVEDZXRKW-QWHCGFSZSA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)c1cc[nH]c(=O)c1 ZINC000815642713 1136625132 /nfs/dbraw/zinc/62/51/32/1136625132.db2.gz KEADTOLCSIHQKO-NXEZZACHSA-N 1 1 326.318 3.923 20 10 EHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000748049497 1136682902 /nfs/dbraw/zinc/68/29/02/1136682902.db2.gz DJQVJCWHVDVUAF-HNNXBMFYSA-N 1 1 325.449 3.842 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)CCOc2cccc(Cl)c2)c1O ZINC000748051720 1136685827 /nfs/dbraw/zinc/68/58/27/1136685827.db2.gz XMAFHUUGCCTSMU-UHFFFAOYSA-N 1 1 335.831 3.873 20 10 EHCDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816499049 1136727910 /nfs/dbraw/zinc/72/79/10/1136727910.db2.gz CMRGJNRDVHTYSH-SFHVURJKSA-N 1 1 340.467 3.674 20 10 EHCDMO CCC(=O)Nc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816536415 1136731124 /nfs/dbraw/zinc/73/11/24/1136731124.db2.gz WNQODSMEPBBPMM-UHFFFAOYSA-N 1 1 336.794 3.823 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000816544708 1136732642 /nfs/dbraw/zinc/73/26/42/1136732642.db2.gz QLCOPKGDVHXRCW-UHFFFAOYSA-N 1 1 331.778 3.660 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000817585538 1136825424 /nfs/dbraw/zinc/82/54/24/1136825424.db2.gz GIDHGAYDVHLWKS-DCAQKATOSA-N 1 1 345.270 3.641 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000817938257 1136847933 /nfs/dbraw/zinc/84/79/33/1136847933.db2.gz HNWOJODDCHVWBO-KZULUSFZSA-N 1 1 335.854 3.896 20 10 EHCDMO Cc1ccc2c(c1)[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)CCCO2 ZINC000817940708 1136848597 /nfs/dbraw/zinc/84/85/97/1136848597.db2.gz HACAFBGSTLPGJW-VQTJNVASSA-N 1 1 339.483 3.564 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](OC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000858443938 1136968136 /nfs/dbraw/zinc/96/81/36/1136968136.db2.gz XEABKRCUCLBOEL-HKUYNNGSSA-N 1 1 333.403 3.968 20 10 EHCDMO COC(=O)C1=CC[C@@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858471852 1136970976 /nfs/dbraw/zinc/97/09/76/1136970976.db2.gz FLHLXORWIYDGRI-WCBMZHEXSA-N 1 1 330.211 3.611 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2ccc(C)cn2)c1 ZINC000858488581 1136972564 /nfs/dbraw/zinc/97/25/64/1136972564.db2.gz WACMKQTYKQCGLR-CQSZACIVSA-N 1 1 342.439 3.511 20 10 EHCDMO C[C@@H]([NH2+]CCN(C)CC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000858597319 1136981758 /nfs/dbraw/zinc/98/17/58/1136981758.db2.gz YSJHLVKXRNSMIW-MRVPVSSYSA-N 1 1 327.202 3.547 20 10 EHCDMO C[C@H]1COCC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823458800 1137100514 /nfs/dbraw/zinc/10/05/14/1137100514.db2.gz GXCXFGXEKLCKTA-MRXNPFEDSA-N 1 1 330.497 3.853 20 10 EHCDMO CC[N@@H+](Cc1ccncc1C)Cc1cc(Br)ccc1O ZINC000823478001 1137101656 /nfs/dbraw/zinc/10/16/56/1137101656.db2.gz YOEBMGGKQPSPFM-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c1O ZINC000823660271 1137108356 /nfs/dbraw/zinc/10/83/56/1137108356.db2.gz IVNOMGZWZBRENW-IBGZPJMESA-N 1 1 347.430 3.515 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@H]2CCO)cc1 ZINC000824215076 1137128362 /nfs/dbraw/zinc/12/83/62/1137128362.db2.gz LJXXPQBJMPUXHQ-SFHVURJKSA-N 1 1 330.497 3.731 20 10 EHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)ncc1Br ZINC000862210658 1137132428 /nfs/dbraw/zinc/13/24/28/1137132428.db2.gz RTNQZKAFGRRMGK-UHFFFAOYSA-N 1 1 348.288 3.851 20 10 EHCDMO CN(C)c1cc(F)c(C[N@@H+](C)[C@@H](CCO)c2ccccc2)cc1F ZINC000862246298 1137135014 /nfs/dbraw/zinc/13/50/14/1137135014.db2.gz MBWOXTLJGAMNAV-SFHVURJKSA-N 1 1 334.410 3.586 20 10 EHCDMO Cn1ncc(C2CC2)c1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000824474158 1137139092 /nfs/dbraw/zinc/13/90/92/1137139092.db2.gz JEFQCABXWHGKEG-UHFFFAOYSA-N 1 1 338.499 3.920 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1O ZINC000824696983 1137147285 /nfs/dbraw/zinc/14/72/85/1137147285.db2.gz WXJVMCKVEGRIOB-OAGGEKHMSA-N 1 1 339.863 3.570 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+]2CCO[C@@H](CCF)C2)cc1 ZINC000862530548 1137148317 /nfs/dbraw/zinc/14/83/17/1137148317.db2.gz OIRFWTHIHNEDKF-SFHVURJKSA-N 1 1 348.487 3.945 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCO[C@@H](CCF)C2)cc1 ZINC000862530548 1137148318 /nfs/dbraw/zinc/14/83/18/1137148318.db2.gz OIRFWTHIHNEDKF-SFHVURJKSA-N 1 1 348.487 3.945 20 10 EHCDMO CO[C@@H]1CC[N@H+](Cc2cc(C)cc(Br)c2O)CC1(C)C ZINC000824820296 1137153834 /nfs/dbraw/zinc/15/38/34/1137153834.db2.gz COMNGHMQHPGGRA-CQSZACIVSA-N 1 1 342.277 3.710 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1(C)C ZINC000824820296 1137153836 /nfs/dbraw/zinc/15/38/36/1137153836.db2.gz COMNGHMQHPGGRA-CQSZACIVSA-N 1 1 342.277 3.710 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1O ZINC000863302399 1137180465 /nfs/dbraw/zinc/18/04/65/1137180465.db2.gz KKLFDTJTIKVWHH-GOEBONIOSA-N 1 1 349.471 3.509 20 10 EHCDMO C[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccc(N2CCCCC2)cc1 ZINC000844272285 1137207785 /nfs/dbraw/zinc/20/77/85/1137207785.db2.gz WHJPHTLADMULBT-UHFFFAOYSA-N 1 1 338.499 3.842 20 10 EHCDMO C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccc(N2CCCCC2)cc1 ZINC000844272285 1137207787 /nfs/dbraw/zinc/20/77/87/1137207787.db2.gz WHJPHTLADMULBT-UHFFFAOYSA-N 1 1 338.499 3.842 20 10 EHCDMO CCc1cc(C[N@H+]2CCO[C@@]3(CCO[C@@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000794665805 1137222409 /nfs/dbraw/zinc/22/24/09/1137222409.db2.gz VZYGJTRGPGMEFP-VFNWGFHPSA-N 1 1 347.499 3.632 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3ccccc3[C@@H](C)C2)cc1OC ZINC000844741672 1137249045 /nfs/dbraw/zinc/24/90/45/1137249045.db2.gz KYJLHDDCTUMWKL-AWEZNQCLSA-N 1 1 327.424 3.571 20 10 EHCDMO CC[C@H](Nc1ccc(N2CCOCC2)[nH+]c1C)c1ccc(C)cc1O ZINC000794815910 1137263691 /nfs/dbraw/zinc/26/36/91/1137263691.db2.gz ILRKYRGOCWEOCM-KRWDZBQOSA-N 1 1 341.455 3.804 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1F)C[C@H]1CCCO1 ZINC000120529502 1137280086 /nfs/dbraw/zinc/28/00/86/1137280086.db2.gz NUIQMEVOGOKJIN-QGZVFWFLSA-N 1 1 333.378 3.852 20 10 EHCDMO COc1cccc(O)c1C[NH2+]Cc1c(Cl)cccc1OC(F)F ZINC000865789925 1137312179 /nfs/dbraw/zinc/31/21/79/1137312179.db2.gz AJCVRJYYSLGXTD-UHFFFAOYSA-N 1 1 343.757 3.945 20 10 EHCDMO Cn1cc(C(F)F)c(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000865810201 1137313581 /nfs/dbraw/zinc/31/35/81/1137313581.db2.gz LIROYZAKFZPMBF-UHFFFAOYSA-N 1 1 334.414 3.638 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC[C@]2(C)C[C@]2(F)Cl)c1 ZINC000846184841 1137340148 /nfs/dbraw/zinc/34/01/48/1137340148.db2.gz OFQHZBNSZZNRPP-AMKSKSKJSA-N 1 1 329.799 3.534 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc3cnccc3o2)c1 ZINC000866621800 1137370344 /nfs/dbraw/zinc/37/03/44/1137370344.db2.gz VIDPGLBFGVSBQU-NEPJUHHUSA-N 1 1 340.379 3.732 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2C[C@H](c3cnn(C)c3)C(C)(C)C2)cc1 ZINC000846932357 1137376214 /nfs/dbraw/zinc/37/62/14/1137376214.db2.gz RRHCUODLXAPUGG-LJQANCHMSA-N 1 1 326.488 3.502 20 10 EHCDMO C[NH+](C)C1(C)CCC([NH2+]Cc2cc(Br)ccc2[O-])CC1 ZINC000715492594 1137477207 /nfs/dbraw/zinc/47/72/07/1137477207.db2.gz VVDCKHBXWHQGCF-UHFFFAOYSA-N 1 1 341.293 3.507 20 10 EHCDMO COCCCOCC[N@@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000773271094 1137483621 /nfs/dbraw/zinc/48/36/21/1137483621.db2.gz JIHXCJNPLYXWCU-UHFFFAOYSA-N 1 1 343.423 3.777 20 10 EHCDMO CC[C@H](C)OCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172340725 1137552493 /nfs/dbraw/zinc/55/24/93/1137552493.db2.gz KVSJAVSMKQAPBX-ROUUACIJSA-N 1 1 334.504 3.549 20 10 EHCDMO Nc1ccc(NC(=O)[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000876504311 1137654241 /nfs/dbraw/zinc/65/42/41/1137654241.db2.gz MKGOMFFULVOKNT-LJQANCHMSA-N 1 1 335.451 3.510 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2c(C)cccc2O)c(C)c1 ZINC000876590844 1137656420 /nfs/dbraw/zinc/65/64/20/1137656420.db2.gz DWFSZBCQUQEGAF-UHFFFAOYSA-N 1 1 326.440 3.696 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@H]1CC(C)(C)OC1(C)C ZINC000877923103 1137695883 /nfs/dbraw/zinc/69/58/83/1137695883.db2.gz JCWYOYUDZTTZKA-GOSISDBHSA-N 1 1 346.515 3.549 20 10 EHCDMO CC(C)[N@H+](Cc1nccn1CC(F)F)Cc1ccc(N(C)C)cc1 ZINC000877976790 1137697988 /nfs/dbraw/zinc/69/79/88/1137697988.db2.gz KFENDKFFJBRRBJ-UHFFFAOYSA-N 1 1 336.430 3.625 20 10 EHCDMO CC(C)[N@@H+](Cc1nccn1CC(F)F)Cc1ccc(N(C)C)cc1 ZINC000877976790 1137697989 /nfs/dbraw/zinc/69/79/89/1137697989.db2.gz KFENDKFFJBRRBJ-UHFFFAOYSA-N 1 1 336.430 3.625 20 10 EHCDMO O=C(Nc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1)C1CCC1 ZINC000882883415 1137836750 /nfs/dbraw/zinc/83/67/50/1137836750.db2.gz YLMRSGIDNQAUOX-UHFFFAOYSA-N 1 1 346.377 3.699 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000882921263 1137838560 /nfs/dbraw/zinc/83/85/60/1137838560.db2.gz CAYFVIZDJBCQRB-AUUYWEPGSA-N 1 1 333.378 3.928 20 10 EHCDMO COc1cc(F)c([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC000882999877 1137841057 /nfs/dbraw/zinc/84/10/57/1137841057.db2.gz CIVVHKSVIPSEGG-SECBINFHSA-N 1 1 341.329 3.678 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1c(F)cccc1F ZINC000883025399 1137841881 /nfs/dbraw/zinc/84/18/81/1137841881.db2.gz JAZSMGCJBQGZOX-YOEHRIQHSA-N 1 1 343.320 3.550 20 10 EHCDMO CSc1ccc(C[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)s1 ZINC000883283555 1137852425 /nfs/dbraw/zinc/85/24/25/1137852425.db2.gz JSANIQALJLTVPG-UHFFFAOYSA-N 1 1 347.553 3.512 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885940670 1138026854 /nfs/dbraw/zinc/02/68/54/1138026854.db2.gz OVRYNZDNMUSVGT-UHFFFAOYSA-N 1 1 340.427 3.612 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885940670 1138026855 /nfs/dbraw/zinc/02/68/55/1138026855.db2.gz OVRYNZDNMUSVGT-UHFFFAOYSA-N 1 1 340.427 3.612 20 10 EHCDMO C[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1c(O)cccc1F ZINC000886487724 1138082605 /nfs/dbraw/zinc/08/26/05/1138082605.db2.gz RKQXVHYDDDZFNA-HNNXBMFYSA-N 1 1 328.431 3.847 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1c(O)cccc1F ZINC000886512272 1138087259 /nfs/dbraw/zinc/08/72/59/1138087259.db2.gz BEYBTDNNDSVQIM-JTQLQIEISA-N 1 1 337.778 3.807 20 10 EHCDMO CCOc1c(OC)cc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1OC ZINC000886519256 1138088907 /nfs/dbraw/zinc/08/89/07/1138088907.db2.gz RLZKVHMPFGTOPX-GFCCVEGCSA-N 1 1 349.402 3.798 20 10 EHCDMO C[C@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000886710843 1138122190 /nfs/dbraw/zinc/12/21/90/1138122190.db2.gz HKWYXTSFWPCYLM-HOCLYGCPSA-N 1 1 337.435 3.548 20 10 EHCDMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n[nH]1 ZINC000090531358 1138211663 /nfs/dbraw/zinc/21/16/63/1138211663.db2.gz QOPYMRRCQJILNM-NVXWUHKLSA-N 1 1 326.488 3.990 20 10 EHCDMO COc1cccc(C[N@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c1O ZINC000093532573 1138238131 /nfs/dbraw/zinc/23/81/31/1138238131.db2.gz DVGRTUQDNKYWTP-UHFFFAOYSA-N 1 1 343.267 3.718 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cccc(Br)c2O)cc(C)c1O ZINC000263709766 1138347106 /nfs/dbraw/zinc/34/71/06/1138347106.db2.gz TUWLUUIIHFLUMF-UHFFFAOYSA-N 1 1 336.229 3.767 20 10 EHCDMO C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384902 1139088309 /nfs/dbraw/zinc/08/83/09/1139088309.db2.gz YEIFFRBBNYANTO-IRXDYDNUSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384902 1139088318 /nfs/dbraw/zinc/08/83/18/1139088318.db2.gz YEIFFRBBNYANTO-IRXDYDNUSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384902 1139088326 /nfs/dbraw/zinc/08/83/26/1139088326.db2.gz YEIFFRBBNYANTO-IRXDYDNUSA-N 1 1 345.506 3.951 20 10 EHCDMO COc1cccc(-c2noc([C@@H](C)[NH2+]Cc3cc(C)ccc3O)n2)c1 ZINC000174659233 1139433408 /nfs/dbraw/zinc/43/34/08/1139433408.db2.gz SGQHKIDGFMJEGR-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(F)c(F)c1 ZINC000186225696 1140192994 /nfs/dbraw/zinc/19/29/94/1140192994.db2.gz KIQUUDFLWHQIKJ-MGPLVRAMSA-N 1 1 325.330 3.848 20 10 EHCDMO CCC[N@@H+](Cc1ccc2c(c1)CCC(=O)N2C)Cc1ccccc1O ZINC000186922240 1140228366 /nfs/dbraw/zinc/22/83/66/1140228366.db2.gz HUYAHRONCGMUTA-UHFFFAOYSA-N 1 1 338.451 3.713 20 10 EHCDMO CCN1C(=O)/C(=C/c2[nH+]c(C(C)C)n3ccccc23)SC1=S ZINC000268542108 1140953936 /nfs/dbraw/zinc/95/39/36/1140953936.db2.gz DNMRIHRWNVAVJE-LCYFTJDESA-N 1 1 331.466 3.679 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCS[C@@H]2COCC[C@H]21 ZINC000271297345 1141340805 /nfs/dbraw/zinc/34/08/05/1141340805.db2.gz SMKAXHSFECHENJ-UYAOXDASSA-N 1 1 341.476 3.766 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(F)cc1O ZINC000185134247 1032351297 /nfs/dbraw/zinc/35/12/97/1032351297.db2.gz BPPIMOSGKPCNSJ-GFCCVEGCSA-N 1 1 329.350 3.707 20 10 EHCDMO C[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1O ZINC000170788803 1017093675 /nfs/dbraw/zinc/09/36/75/1017093675.db2.gz PQLDXJOIHHHRBG-OAHLLOKOSA-N 1 1 328.431 3.847 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+](C)CCOC(C)(C)C)c1O ZINC000689894632 1032497799 /nfs/dbraw/zinc/49/77/99/1032497799.db2.gz KBKZLROTTBUNDH-UHFFFAOYSA-N 1 1 330.266 3.710 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1O ZINC000170788921 1032626983 /nfs/dbraw/zinc/62/69/83/1032626983.db2.gz NODCNZOKSUGNNL-ZDUSSCGKSA-N 1 1 328.387 3.509 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)c1O ZINC000709007053 1018338194 /nfs/dbraw/zinc/33/81/94/1018338194.db2.gz OBRNDJFQVHCXCE-AWEZNQCLSA-N 1 1 342.277 3.710 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)c1O ZINC000709007053 1018338205 /nfs/dbraw/zinc/33/82/05/1018338205.db2.gz OBRNDJFQVHCXCE-AWEZNQCLSA-N 1 1 342.277 3.710 20 10 EHCDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000050901697 1020660514 /nfs/dbraw/zinc/66/05/14/1020660514.db2.gz RTKGFUDIYRRPFP-KRWDZBQOSA-N 1 1 340.467 3.674 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2[O-])C[C@H]1C ZINC000894902752 1022058475 /nfs/dbraw/zinc/05/84/75/1022058475.db2.gz LAGDUQLKZCKWPI-NOZJJQNGSA-N 1 1 348.668 3.665 20 10 EHCDMO CCC[N@@H+](CCO)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255369880 1022077549 /nfs/dbraw/zinc/07/75/49/1022077549.db2.gz BYJJOOFMNYGJHJ-UHFFFAOYSA-N 1 1 340.427 3.745 20 10 EHCDMO CC1(C)CC[C@@H](C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)OC1 ZINC001167982357 1022825249 /nfs/dbraw/zinc/82/52/49/1022825249.db2.gz CNRATZYFNRMEFH-ROUUACIJSA-N 1 1 333.472 3.578 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2c2ccnn2C)c1O ZINC000281107960 1024288652 /nfs/dbraw/zinc/28/86/52/1024288652.db2.gz AZRKCINCXPSBNI-OAHLLOKOSA-N 1 1 335.835 3.515 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2c2ccnn2C)c1O ZINC000281107960 1024288667 /nfs/dbraw/zinc/28/86/67/1024288667.db2.gz AZRKCINCXPSBNI-OAHLLOKOSA-N 1 1 335.835 3.515 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3c(O)cccc3Cl)[C@H]2C(C)C)C1 ZINC000895990474 1025033478 /nfs/dbraw/zinc/03/34/78/1025033478.db2.gz VMOZXAUVZDCBIC-INIZCTEOSA-N 1 1 339.863 3.655 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3cc(C)c(C)cc3O)[C@H]2C(C)C)C1 ZINC000895988916 1025047229 /nfs/dbraw/zinc/04/72/29/1025047229.db2.gz GKGJCFOJEKMFBD-SFHVURJKSA-N 1 1 333.472 3.619 20 10 EHCDMO COc1ccc(CNc2ccc([NH+]3CCCC3)cc2C)c(O)c1OC ZINC000892254734 1025894343 /nfs/dbraw/zinc/89/43/43/1025894343.db2.gz QQKWWMGLKRWYDT-UHFFFAOYSA-N 1 1 342.439 3.930 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000840775625 1026143434 /nfs/dbraw/zinc/14/34/34/1026143434.db2.gz RYMZHOQKKBBHHF-CABCVRRESA-N 1 1 342.439 3.636 20 10 EHCDMO COc1ccc2[nH]cc(C3=CCN(c4cc(C)[nH+]c(C)n4)CC3)c2c1 ZINC000301179764 1026713296 /nfs/dbraw/zinc/71/32/96/1026713296.db2.gz HINOYXZKLIJMRY-UHFFFAOYSA-N 1 1 334.423 3.877 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1=O)c1ccc(F)cc1O ZINC000840881221 1027090261 /nfs/dbraw/zinc/09/02/61/1027090261.db2.gz GHQXAYCXYYIGCT-DLBZAZTESA-N 1 1 346.377 3.517 20 10 EHCDMO COc1cccc(C[N@@H+](C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1O ZINC000273348267 1027388409 /nfs/dbraw/zinc/38/84/09/1027388409.db2.gz AMGXVOWGDKKHMQ-MJGOQNOKSA-N 1 1 345.414 3.892 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN(C)[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874310 1027864192 /nfs/dbraw/zinc/86/41/92/1027864192.db2.gz RFPFCDWPSHWPCC-NBQZKYEYSA-N 1 1 328.431 3.875 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)c1 ZINC000271770761 1029163316 /nfs/dbraw/zinc/16/33/16/1029163316.db2.gz GEIDMDHOUNZVNO-APWZRJJASA-N 1 1 345.439 3.862 20 10 EHCDMO CC(C)c1ncc2c(n1)CC[N@@H+](Cc1cc3c(cc1O)CCCC3)C2 ZINC000527616044 1031037934 /nfs/dbraw/zinc/03/79/34/1031037934.db2.gz QRXIYBOTUMRIEN-UHFFFAOYSA-N 1 1 337.467 3.743 20 10 EHCDMO CC(C)c1ncc2c(n1)CC[N@H+](Cc1cc3c(cc1O)CCCC3)C2 ZINC000527616044 1031037947 /nfs/dbraw/zinc/03/79/47/1031037947.db2.gz QRXIYBOTUMRIEN-UHFFFAOYSA-N 1 1 337.467 3.743 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)cc1O ZINC000185718372 1035523554 /nfs/dbraw/zinc/52/35/54/1035523554.db2.gz QGERBXRSNDQNPX-WCQYABFASA-N 1 1 335.810 3.509 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000164431769 1035608703 /nfs/dbraw/zinc/60/87/03/1035608703.db2.gz MIJOBXRKWGHJQS-MAUKXSAKSA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000164431769 1035608716 /nfs/dbraw/zinc/60/87/16/1035608716.db2.gz MIJOBXRKWGHJQS-MAUKXSAKSA-N 1 1 327.424 3.671 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)Nc1ccc(Cl)cn1 ZINC000157069876 1036462043 /nfs/dbraw/zinc/46/20/43/1036462043.db2.gz FFAYWDIDYMBJHB-ZDUSSCGKSA-N 1 1 347.846 3.680 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCc2n[nH]cc2C1)c1cc(Cl)c(Cl)cc1O ZINC000193023928 1036575458 /nfs/dbraw/zinc/57/54/58/1036575458.db2.gz SCQXRTSDGDGSQX-WPRPVWTQSA-N 1 1 326.227 3.630 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000248183254 1040715954 /nfs/dbraw/zinc/71/59/54/1040715954.db2.gz WWJSXRCRFGDMCE-WFXMLNOXSA-N 1 1 347.547 3.540 20 10 EHCDMO CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000044515713 1040963897 /nfs/dbraw/zinc/96/38/97/1040963897.db2.gz NKWDVDGYSWYUEW-OAHLLOKOSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)C1 ZINC000781928544 1041099088 /nfs/dbraw/zinc/09/90/88/1041099088.db2.gz MQWOZOYDXPDITR-OXJNMPFZSA-N 1 1 332.463 3.674 20 10 EHCDMO COc1ccccc1C[N@@H+](Cc1cc(C)cc(OC)c1O)C1CC1 ZINC000164209151 1041219045 /nfs/dbraw/zinc/21/90/45/1041219045.db2.gz AROYFVIODDBSNF-UHFFFAOYSA-N 1 1 327.424 3.882 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000156480592 1041242235 /nfs/dbraw/zinc/24/22/35/1041242235.db2.gz LJUPFMZIHYGXMO-UHFFFAOYSA-N 1 1 338.499 3.770 20 10 EHCDMO COc1ccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c(O)c1OC ZINC000893475052 1042217968 /nfs/dbraw/zinc/21/79/68/1042217968.db2.gz HWDCHLVDGFSJNB-JQWIXIFHSA-N 1 1 333.350 3.572 20 10 EHCDMO CCC1([NH3+])CCN([C@H](C)c2cc(Br)c(F)cc2O)CC1 ZINC000925761311 1042651026 /nfs/dbraw/zinc/65/10/26/1042651026.db2.gz ZFPQWXDIXKTRGE-SNVBAGLBSA-N 1 1 345.256 3.558 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccccc2SC)cc1OC ZINC000279760680 1044547216 /nfs/dbraw/zinc/54/72/16/1044547216.db2.gz ZTHOWQRHIXAZDI-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000185337392 1126868455 /nfs/dbraw/zinc/86/84/55/1126868455.db2.gz HEAUSTMKLIGOFU-WMZOPIPTSA-N 1 1 342.458 3.747 20 10 EHCDMO CC(C)N1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000764141307 1127450942 /nfs/dbraw/zinc/45/09/42/1127450942.db2.gz XRVUTPZJSHZHIC-HXUWFJFHSA-N 1 1 343.515 3.508 20 10 EHCDMO C[C@H](N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963299 1127559909 /nfs/dbraw/zinc/55/99/09/1127559909.db2.gz CKABODVOHMHAIL-YYWHXJBOSA-N 1 1 327.516 3.954 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963299 1127559912 /nfs/dbraw/zinc/55/99/12/1127559912.db2.gz CKABODVOHMHAIL-YYWHXJBOSA-N 1 1 327.516 3.954 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+]Cc3ccc(C(F)F)cc3)cc2)CC1 ZINC000764979515 1127559426 /nfs/dbraw/zinc/55/94/26/1127559426.db2.gz FMGDCLOOEVVSMD-UHFFFAOYSA-N 1 1 345.437 3.666 20 10 EHCDMO C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963298 1127560121 /nfs/dbraw/zinc/56/01/21/1127560121.db2.gz CKABODVOHMHAIL-WMQCIHAUSA-N 1 1 327.516 3.954 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1ccc(N2CCCCC2)cc1 ZINC000764963298 1127560123 /nfs/dbraw/zinc/56/01/23/1127560123.db2.gz CKABODVOHMHAIL-WMQCIHAUSA-N 1 1 327.516 3.954 20 10 EHCDMO C[C@@H](NC[C@H](C1CC1)[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765145464 1127580221 /nfs/dbraw/zinc/58/02/21/1127580221.db2.gz DPVOSYFEBDHZIE-FOIQADDNSA-N 1 1 333.495 3.807 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2c(Cl)c(C)nn2C)cc1F ZINC000921714944 1128661290 /nfs/dbraw/zinc/66/12/90/1128661290.db2.gz IKUQRJVCHYRJHQ-UHFFFAOYSA-N 1 1 338.858 3.657 20 10 EHCDMO Cc1nc(C)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000172797994 1128958472 /nfs/dbraw/zinc/95/84/72/1128958472.db2.gz KPDGPPXCKIFBJK-INIZCTEOSA-N 1 1 332.469 3.647 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(F)cc1 ZINC000917013538 1122438563 /nfs/dbraw/zinc/43/85/63/1122438563.db2.gz GAJDMJYPGYZBFU-HXUWFJFHSA-N 1 1 330.447 3.836 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H](O)c2ccccc2F)C2CC2)cc1 ZINC000917014539 1122438575 /nfs/dbraw/zinc/43/85/75/1122438575.db2.gz WZNOHSHBHTUMSB-FQEVSTJZSA-N 1 1 328.431 3.590 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N[C@@H]1CCCC[C@H]1C)Cc1ccc(N(C)C)cc1 ZINC000917074934 1122472006 /nfs/dbraw/zinc/47/20/06/1122472006.db2.gz MATLWZBMGSTIBP-YLJYHZDGSA-N 1 1 345.531 3.658 20 10 EHCDMO Cc1cccc2nc(C[N@@H+](Cc3ccc(N(C)C)cc3)C3CC3)cn21 ZINC000917074968 1122472316 /nfs/dbraw/zinc/47/23/16/1122472316.db2.gz NACNXCUDDNEZHZ-UHFFFAOYSA-N 1 1 334.467 3.873 20 10 EHCDMO Cc1cccc2nc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)cn21 ZINC000917074968 1122472322 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PSINSFQQBXRPKD-UHFFFAOYSA-N 1 1 349.272 3.923 20 10 EHCDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3cc4c(cc3O)OCO4)C2)c(C)c1 ZINC000793231202 1134879631 /nfs/dbraw/zinc/87/96/31/1134879631.db2.gz AOVIGMPPYHKQBG-OAHLLOKOSA-N 1 1 325.408 3.727 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCN(c3ccc(F)c(F)c3)CC2)c1O ZINC000793608763 1134970225 /nfs/dbraw/zinc/97/02/25/1134970225.db2.gz XLDGFBPMUVBIFI-UHFFFAOYSA-N 1 1 332.394 3.691 20 10 EHCDMO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2C(=O)c1cc(O)c(O)c(Cl)c1 ZINC001193626619 1135161211 /nfs/dbraw/zinc/16/12/11/1135161211.db2.gz YDQAWENCTJJLAA-AWEZNQCLSA-N 1 1 346.814 3.500 20 10 EHCDMO CO[C@]1(C)C[C@@H]([NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)C1(C)C ZINC001194444981 1135274363 /nfs/dbraw/zinc/27/43/63/1135274363.db2.gz GOBJOYHUUSLQFX-RHSMWYFYSA-N 1 1 325.836 3.541 20 10 EHCDMO CCCc1ccc([C@@H](C)[N@@H+](CC(N)=O)Cc2cccc(C)c2O)cc1 ZINC000775663143 1135435668 /nfs/dbraw/zinc/43/56/68/1135435668.db2.gz ZJEUODGTYPXPSQ-MRXNPFEDSA-N 1 1 340.467 3.702 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccc(C)c2O)C[C@H]2CCCO2)c1 ZINC000775662693 1135441859 /nfs/dbraw/zinc/44/18/59/1135441859.db2.gz GXFATWGZUVDKFG-HXUWFJFHSA-N 1 1 341.451 3.890 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000775669857 1135464489 /nfs/dbraw/zinc/46/44/89/1135464489.db2.gz RKJJLMIOHAJRAP-HNNXBMFYSA-N 1 1 326.843 3.635 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cccc(C)c2O)CC[C@H]1NC(=O)OC(C)(C)C ZINC000775716932 1135557269 /nfs/dbraw/zinc/55/72/69/1135557269.db2.gz ISPVLLLGQVXRPC-NVXWUHKLSA-N 1 1 348.487 3.826 20 10 EHCDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCN(C)CC3)cc1)CCC2 ZINC000808435998 1135666808 /nfs/dbraw/zinc/66/68/08/1135666808.db2.gz GYNZVDMVXRVYNC-QHCPKHFHSA-N 1 1 349.522 3.914 20 10 EHCDMO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cccc(Br)c1O ZINC000808444579 1135668717 /nfs/dbraw/zinc/66/87/17/1135668717.db2.gz OLZDKBPONZSCMN-BMIGLBTASA-N 1 1 334.213 3.767 20 10 EHCDMO COC[C@H]1CC[N@@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC000809575339 1135853142 /nfs/dbraw/zinc/85/31/42/1135853142.db2.gz ZDOWERVAJZPJAU-FQEVSTJZSA-N 1 1 336.479 3.718 20 10 EHCDMO CCOc1cccc(C[N@@H+](Cc2ccccc2)[C@@H](CC)CO)c1O ZINC000809642528 1135864662 /nfs/dbraw/zinc/86/46/62/1135864662.db2.gz GVZQKWNCMODCTH-SFHVURJKSA-N 1 1 329.440 3.564 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1F ZINC000809767402 1135879327 /nfs/dbraw/zinc/87/93/27/1135879327.db2.gz JYVJMLLHKBIOFR-IEBWSBKVSA-N 1 1 333.495 3.588 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1F ZINC000809767402 1135879330 /nfs/dbraw/zinc/87/93/30/1135879330.db2.gz JYVJMLLHKBIOFR-IEBWSBKVSA-N 1 1 333.495 3.588 20 10 EHCDMO CCOc1ccc(C[N@@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)c(O)c1 ZINC000809775001 1135881786 /nfs/dbraw/zinc/88/17/86/1135881786.db2.gz WWQHKGDAXCEUMW-IRXDYDNUSA-N 1 1 343.467 3.777 20 10 EHCDMO COCc1nc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)cs1 ZINC000810170287 1135929895 /nfs/dbraw/zinc/92/98/95/1135929895.db2.gz HTRQNCFBOHLIIZ-UHFFFAOYSA-N 1 1 340.448 3.952 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1O ZINC000811512232 1136102804 /nfs/dbraw/zinc/10/28/04/1136102804.db2.gz IMDLOAJBICMXHF-NRFANRHFSA-N 1 1 339.435 3.761 20 10 EHCDMO CC(C)[N@@H+](C)C[C@@H](C)NCc1ccc(OCc2ccccc2)cc1O ZINC000811516198 1136104357 /nfs/dbraw/zinc/10/43/57/1136104357.db2.gz SCUDDVXKYMJIRE-QGZVFWFLSA-N 1 1 342.483 3.790 20 10 EHCDMO CC(C)[N@H+](C)C[C@@H](C)NCc1ccc(OCc2ccccc2)cc1O ZINC000811516198 1136104361 /nfs/dbraw/zinc/10/43/61/1136104361.db2.gz SCUDDVXKYMJIRE-QGZVFWFLSA-N 1 1 342.483 3.790 20 10 EHCDMO Cc1cc(C[NH2+][C@H]2C[C@H](C)n3ncnc32)c(C)n1-c1cccc(C)c1 ZINC000850352262 1136239438 /nfs/dbraw/zinc/23/94/38/1136239438.db2.gz QCOAYXZADDTTBH-KXBFYZLASA-N 1 1 335.455 3.790 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@@]2(C)CC2(F)F)c1 ZINC000850380834 1136245802 /nfs/dbraw/zinc/24/58/02/1136245802.db2.gz NRHDBPGLIWRUSF-ZDUSSCGKSA-N 1 1 334.204 3.988 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000812781481 1136246618 /nfs/dbraw/zinc/24/66/18/1136246618.db2.gz WBPIRXZPHPFGSZ-JOCHJYFZSA-N 1 1 338.495 3.669 20 10 EHCDMO COC[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)c1cccc(OC)c1 ZINC000850514033 1136274693 /nfs/dbraw/zinc/27/46/93/1136274693.db2.gz KSJUITLHZJHZRI-PIGZYNQJSA-N 1 1 337.366 3.717 20 10 EHCDMO CO[C@H](C[N@@H+](Cc1ccccc1O)C1CCCCC1)[C@@H]1CCOC1 ZINC000851769648 1136406374 /nfs/dbraw/zinc/40/63/74/1136406374.db2.gz KIPLFIZAFLRTMX-YLJYHZDGSA-N 1 1 333.472 3.578 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2Cc3ccccc3O[C@H](C)C2)c1O ZINC000814177558 1136411198 /nfs/dbraw/zinc/41/11/98/1136411198.db2.gz HBPFSAQEEJJMBX-GFCCVEGCSA-N 1 1 333.815 3.837 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)c1O ZINC000814177558 1136411201 /nfs/dbraw/zinc/41/12/01/1136411201.db2.gz HBPFSAQEEJJMBX-GFCCVEGCSA-N 1 1 333.815 3.837 20 10 EHCDMO CSC[C@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000814179036 1136412348 /nfs/dbraw/zinc/41/23/48/1136412348.db2.gz NTIAQMDWPYMSKR-NSHDSACASA-N 1 1 330.291 3.730 20 10 EHCDMO CSC[C@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000814179036 1136412349 /nfs/dbraw/zinc/41/23/49/1136412349.db2.gz NTIAQMDWPYMSKR-NSHDSACASA-N 1 1 330.291 3.730 20 10 EHCDMO COC(CC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1)OC ZINC000851879339 1136415152 /nfs/dbraw/zinc/41/51/52/1136415152.db2.gz IJMWNYSSFMIIEQ-INIZCTEOSA-N 1 1 329.440 3.964 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c1O ZINC000852594306 1136469034 /nfs/dbraw/zinc/46/90/34/1136469034.db2.gz BGHDJTRXNZFKTI-KDOFPFPSSA-N 1 1 335.419 3.515 20 10 EHCDMO CC(C)(C)c1nnc(C[N@H+](Cc2ccccc2O)C2CCCC2)[nH]1 ZINC000814623925 1136481554 /nfs/dbraw/zinc/48/15/54/1136481554.db2.gz FPQXHVXVMPIMOU-UHFFFAOYSA-N 1 1 328.460 3.753 20 10 EHCDMO CC(C)(C)c1nnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)[nH]1 ZINC000814623925 1136481556 /nfs/dbraw/zinc/48/15/56/1136481556.db2.gz FPQXHVXVMPIMOU-UHFFFAOYSA-N 1 1 328.460 3.753 20 10 EHCDMO COc1ncccc1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815557794 1136610307 /nfs/dbraw/zinc/61/03/07/1136610307.db2.gz FKTGXAOOTPZRQU-SNVBAGLBSA-N 1 1 326.318 3.665 20 10 EHCDMO Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815576004 1136613110 /nfs/dbraw/zinc/61/31/10/1136613110.db2.gz GUAPZJDBDDAOJJ-ZJUUUORDSA-N 1 1 327.350 3.865 20 10 EHCDMO Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000815575827 1136613163 /nfs/dbraw/zinc/61/31/63/1136613163.db2.gz BJQGUZRUUKKTIT-NWDGAFQWSA-N 1 1 341.377 3.903 20 10 EHCDMO CN1CCC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578240 1136613625 /nfs/dbraw/zinc/61/36/25/1136613625.db2.gz KGBMLPNSHCLWFO-CTNGQTDRSA-N 1 1 338.495 3.998 20 10 EHCDMO C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1cccc(C(F)(F)F)c1O ZINC000815623549 1136620451 /nfs/dbraw/zinc/62/04/51/1136620451.db2.gz ACDNWIFTUMVHAS-LLVKDONJSA-N 1 1 339.361 3.795 20 10 EHCDMO CCOc1ccc(C[N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)cc1 ZINC000748046836 1136676002 /nfs/dbraw/zinc/67/60/02/1136676002.db2.gz RKBBCTDPOKIEDL-UHFFFAOYSA-N 1 1 331.387 3.765 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)cc1 ZINC000748046836 1136676006 /nfs/dbraw/zinc/67/60/06/1136676006.db2.gz RKBBCTDPOKIEDL-UHFFFAOYSA-N 1 1 331.387 3.765 20 10 EHCDMO CC(C)COC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccco1 ZINC000113332110 1136697364 /nfs/dbraw/zinc/69/73/64/1136697364.db2.gz DYEKIQXHCJZVKJ-QGZVFWFLSA-N 1 1 334.435 3.988 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000816535344 1136730580 /nfs/dbraw/zinc/73/05/80/1136730580.db2.gz MLHDSXYZSJAKRA-ZDUSSCGKSA-N 1 1 334.822 3.801 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1c(C)nn(C)c1C ZINC000816554517 1136736016 /nfs/dbraw/zinc/73/60/16/1136736016.db2.gz APEXUAQFRDDIBG-CQSZACIVSA-N 1 1 325.815 3.776 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)ccc2ccccc21 ZINC000816560366 1136736829 /nfs/dbraw/zinc/73/68/29/1136736829.db2.gz MNIFLIURASWKAK-FQEVSTJZSA-N 1 1 333.431 3.989 20 10 EHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816610164 1136741051 /nfs/dbraw/zinc/74/10/51/1136741051.db2.gz AANILRXNELBSSJ-UHFFFAOYSA-N 1 1 336.838 3.878 20 10 EHCDMO OC[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CC[C@@H]1C(F)(F)F ZINC000816607666 1136741251 /nfs/dbraw/zinc/74/12/51/1136741251.db2.gz BHORWTOLGBERIK-HOCLYGCPSA-N 1 1 339.357 3.538 20 10 EHCDMO c1ccc([C@@H]2CCC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000816619799 1136742165 /nfs/dbraw/zinc/74/21/65/1136742165.db2.gz WAYNWMDUDFKLMG-OAQYLSRUSA-N 1 1 336.479 3.903 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000817281709 1136791591 /nfs/dbraw/zinc/79/15/91/1136791591.db2.gz NTGUQESQUBBGRE-NSHDSACASA-N 1 1 333.325 3.898 20 10 EHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc(F)c(F)c(F)c1 ZINC000817938114 1136847157 /nfs/dbraw/zinc/84/71/57/1136847157.db2.gz DUPQJZCQCSOLFR-GTNSWQLSSA-N 1 1 337.389 3.521 20 10 EHCDMO Cc1nc(C(C)C)sc1[C@@H](C)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939574 1136847690 /nfs/dbraw/zinc/84/76/90/1136847690.db2.gz CQTUESWRJQTUGL-DYVFJYSZSA-N 1 1 346.544 3.992 20 10 EHCDMO CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000817957443 1136851634 /nfs/dbraw/zinc/85/16/34/1136851634.db2.gz CIBQRCJHSQVBKL-KOLCDFICSA-N 1 1 349.700 3.832 20 10 EHCDMO Nc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H]3CCC[C@@H]32)cc1 ZINC000817957346 1136851705 /nfs/dbraw/zinc/85/17/05/1136851705.db2.gz LCKRVBOPWMMDMS-ZLNRFVROSA-N 1 1 349.522 3.844 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1[O-] ZINC000817975387 1136854472 /nfs/dbraw/zinc/85/44/72/1136854472.db2.gz MNSJWTPKRCWXOY-JHJVBQTASA-N 1 1 341.293 3.570 20 10 EHCDMO COc1cc(C)cc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1O ZINC000818287837 1136869725 /nfs/dbraw/zinc/86/97/25/1136869725.db2.gz STVDYFMRLRSDSY-INIZCTEOSA-N 1 1 347.480 3.952 20 10 EHCDMO COc1ccc(N2CC[C@H](C[NH2+][C@H](C)c3ccc(F)cc3O)C2)cc1 ZINC000818342207 1136871869 /nfs/dbraw/zinc/87/18/69/1136871869.db2.gz NHXWNRNOEZLHNB-HUUCEWRRSA-N 1 1 344.430 3.717 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C(=O)OC)s2)cc1 ZINC000818357696 1136875756 /nfs/dbraw/zinc/87/57/56/1136875756.db2.gz HWIRLOSUYVELHZ-QWHCGFSZSA-N 1 1 347.484 3.798 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc4ccccc4c3O)C2)nc1 ZINC000858012768 1136931139 /nfs/dbraw/zinc/93/11/39/1136931139.db2.gz LQDFMWJFECLTAU-GOSISDBHSA-N 1 1 334.419 3.902 20 10 EHCDMO COc1cccc(C2([NH2+]Cc3cc(F)c(N(C)C)cc3F)CC2)c1 ZINC000858150195 1136944539 /nfs/dbraw/zinc/94/45/39/1136944539.db2.gz MBNGNQXTASWSSO-UHFFFAOYSA-N 1 1 332.394 3.818 20 10 EHCDMO COC(=O)C1=CC[C@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858471854 1136971001 /nfs/dbraw/zinc/97/10/01/1136971001.db2.gz FLHLXORWIYDGRI-WPRPVWTQSA-N 1 1 330.211 3.611 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Br)cc1[O-] ZINC000858490630 1136973067 /nfs/dbraw/zinc/97/30/67/1136973067.db2.gz KYTLAIRDMZHSPK-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H]4CC[C@@H](C3)S4)cc2)CC1 ZINC000859545443 1137019272 /nfs/dbraw/zinc/01/92/72/1137019272.db2.gz QDGIGGZNFLSXKP-UXHICEINSA-N 1 1 346.540 3.772 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(O[C@H]3CCOC3)cc2)cc1 ZINC000824474290 1137138967 /nfs/dbraw/zinc/13/89/67/1137138967.db2.gz MIRABSRHQMZYBV-NRFANRHFSA-N 1 1 340.467 3.552 20 10 EHCDMO CC(C)[C@@H]1[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC12CCOCC2 ZINC000862395225 1137142499 /nfs/dbraw/zinc/14/24/99/1137142499.db2.gz QCKCYBVRBHDMEM-SFHVURJKSA-N 1 1 338.442 3.668 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2cccc(Br)c2[O-])C[C@H](C)C1(F)F ZINC000862442269 1137145154 /nfs/dbraw/zinc/14/51/54/1137145154.db2.gz HISZSEPWPFLSES-AOOOYVTPSA-N 1 1 334.204 3.878 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2cccc(Br)c2O)C[C@H](C)C1(F)F ZINC000862442269 1137145157 /nfs/dbraw/zinc/14/51/57/1137145157.db2.gz HISZSEPWPFLSES-AOOOYVTPSA-N 1 1 334.204 3.878 20 10 EHCDMO C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824645189 1137146109 /nfs/dbraw/zinc/14/61/09/1137146109.db2.gz ZQENUHVHMWCOAA-VHSXEESVSA-N 1 1 346.830 3.576 20 10 EHCDMO Cc1cc(O)c(CNc2ccc(C[NH+]3CCOCC3)cc2)cc1Cl ZINC000824983105 1137160960 /nfs/dbraw/zinc/16/09/60/1137160960.db2.gz HWYHOJIAOVPQCW-UHFFFAOYSA-N 1 1 346.858 3.798 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)C[C@H](C)n1cc[nH+]c1CC ZINC000843880991 1137186379 /nfs/dbraw/zinc/18/63/79/1137186379.db2.gz SDWLCAFLUALYLR-INIZCTEOSA-N 1 1 343.471 3.931 20 10 EHCDMO CCc1[nH+]c(C)cn1CC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C ZINC000865394694 1137279690 /nfs/dbraw/zinc/27/96/90/1137279690.db2.gz VDZHWNVHPREWKU-UHFFFAOYSA-N 1 1 340.402 3.578 20 10 EHCDMO CC1(C)C[C@H]([NH2+]Cc2ccc(O)cc2O)CCN1Cc1ccccc1 ZINC001171984677 1137527532 /nfs/dbraw/zinc/52/75/32/1137527532.db2.gz XLJLMLXXTNZKPN-GOSISDBHSA-N 1 1 340.467 3.631 20 10 EHCDMO C[C@@H]([NH2+]CCC[C@@H]1CCOC1=O)c1cc(Cl)c(Cl)cc1O ZINC000872113865 1137571978 /nfs/dbraw/zinc/57/19/78/1137571978.db2.gz RLNJEIXDIKLJPG-NXEZZACHSA-N 1 1 332.227 3.693 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2nncn2-c2ccccc2)cc1C ZINC000873012452 1137588025 /nfs/dbraw/zinc/58/80/25/1137588025.db2.gz ITKYWRIQWYOFAZ-UHFFFAOYSA-N 1 1 336.439 3.654 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCCC2)o1)Cc1ccc(N(C)C)cc1 ZINC001137070180 1137596381 /nfs/dbraw/zinc/59/63/81/1137596381.db2.gz DHGOGJBNHUMTKV-UHFFFAOYSA-N 1 1 327.472 3.968 20 10 EHCDMO CC[N@@H+](Cc1cccs1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876546959 1137655150 /nfs/dbraw/zinc/65/51/50/1137655150.db2.gz CCAOUZZYOGNTRF-UHFFFAOYSA-N 1 1 330.497 3.731 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCS[C@H]4CCCC[C@@H]43)cc2)CC1 ZINC000876771802 1137660936 /nfs/dbraw/zinc/66/09/36/1137660936.db2.gz ZGSONBAZZUYDAC-PMACEKPBSA-N 1 1 346.540 3.508 20 10 EHCDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876796676 1137661774 /nfs/dbraw/zinc/66/17/74/1137661774.db2.gz HSWIVALAGUXMBP-INIZCTEOSA-N 1 1 336.545 3.611 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000825935174 1137670875 /nfs/dbraw/zinc/67/08/75/1137670875.db2.gz OHMQSOXDHMIOND-UHFFFAOYSA-N 1 1 333.229 3.714 20 10 EHCDMO Cc1cccc2c1C[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)CC2 ZINC000877477055 1137677581 /nfs/dbraw/zinc/67/75/81/1137677581.db2.gz VTBQGOIFAWFSNS-UHFFFAOYSA-N 1 1 336.479 3.514 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC=C(c4ccccc4)C3)cc2)CC1 ZINC000877508069 1137679060 /nfs/dbraw/zinc/67/90/60/1137679060.db2.gz RMOOTKMTGVYHQG-UHFFFAOYSA-N 1 1 348.490 3.937 20 10 EHCDMO CC(=O)Nc1ccc2c(c1)C[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000877816322 1137691221 /nfs/dbraw/zinc/69/12/21/1137691221.db2.gz BXWFXTSCFYTMNF-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO Cc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)nc1Cl ZINC000877923472 1137695820 /nfs/dbraw/zinc/69/58/20/1137695820.db2.gz QRTVQTYARQFSFI-UHFFFAOYSA-N 1 1 345.874 3.512 20 10 EHCDMO CC(C)Oc1ccccc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001137139612 1137734700 /nfs/dbraw/zinc/73/47/00/1137734700.db2.gz KXDKBTUHNHFGBL-UHFFFAOYSA-N 1 1 327.424 3.833 20 10 EHCDMO COCC[N@@H+](Cc1ccc(N2CCCCC2)c(C)c1)C1CCOCC1 ZINC000879710716 1137755957 /nfs/dbraw/zinc/75/59/57/1137755957.db2.gz IGJAGNJGUUEIOB-UHFFFAOYSA-N 1 1 346.515 3.613 20 10 EHCDMO CCCC(=O)Nc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882894468 1137837147 /nfs/dbraw/zinc/83/71/47/1137837147.db2.gz RDGCXIGHWHBHFI-UHFFFAOYSA-N 1 1 334.366 3.699 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(OC)c(OC)c1 ZINC000883117120 1137845380 /nfs/dbraw/zinc/84/53/80/1137845380.db2.gz QWCZNVRVYYHICN-OAHLLOKOSA-N 1 1 337.366 3.929 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000883264122 1137851369 /nfs/dbraw/zinc/85/13/69/1137851369.db2.gz QRZAEPGEHHUMOC-WBVHZDCISA-N 1 1 337.435 3.548 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000883264119 1137851442 /nfs/dbraw/zinc/85/14/42/1137851442.db2.gz QRZAEPGEHHUMOC-DOTOQJQBSA-N 1 1 337.435 3.548 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1cccc(C(F)(F)F)c1O ZINC000883276199 1137852081 /nfs/dbraw/zinc/85/20/81/1137852081.db2.gz HOOYOXVXKZEADF-AAEUAGOBSA-N 1 1 343.345 3.506 20 10 EHCDMO COc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1OC(F)F ZINC000886498491 1138083849 /nfs/dbraw/zinc/08/38/49/1138083849.db2.gz DIYXDMBSVWENNL-SNVBAGLBSA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(N2CCOC2=O)cc1 ZINC000886512535 1138087217 /nfs/dbraw/zinc/08/72/17/1138087217.db2.gz INWAGZAIJTYFKY-CHWSQXEVSA-N 1 1 344.386 3.900 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccccc1C(F)(F)F)c1c(O)cccc1F ZINC000886512719 1138087381 /nfs/dbraw/zinc/08/73/81/1138087381.db2.gz LQQQPBCGFVQZCC-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc(N2CCOC2=O)c1 ZINC000886513244 1138087710 /nfs/dbraw/zinc/08/77/10/1138087710.db2.gz XCJLNHWXARGBTC-OLZOCXBDSA-N 1 1 344.386 3.900 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886545555 1138094460 /nfs/dbraw/zinc/09/44/60/1138094460.db2.gz NQRPUOMBHHSPAB-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1c(O)cccc1F ZINC000886605204 1138101000 /nfs/dbraw/zinc/10/10/00/1138101000.db2.gz LRNVSWNOTUBSIY-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886608922 1138101400 /nfs/dbraw/zinc/10/14/00/1138101400.db2.gz IDOUQTDWNAWPEJ-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CC[C@@H](CNc3ccccn3)C2)c(O)c1 ZINC000092812795 1138232148 /nfs/dbraw/zinc/23/21/48/1138232148.db2.gz IRIRSAMKDPIUHS-INIZCTEOSA-N 1 1 341.455 3.510 20 10 EHCDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093888737 1138242747 /nfs/dbraw/zinc/24/27/47/1138242747.db2.gz LDCSIGRMXJRHKM-CMJOXMDJSA-N 1 1 330.497 3.683 20 10 EHCDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc3c(cc1O)OCO3)CCC2 ZINC000126146362 1138325669 /nfs/dbraw/zinc/32/56/69/1138325669.db2.gz NZPIBUFZVZMTDT-CYBMUJFWSA-N 1 1 346.452 3.649 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000127484062 1138359384 /nfs/dbraw/zinc/35/93/84/1138359384.db2.gz JDSPAPNCFNSJAP-DNVCBOLYSA-N 1 1 339.483 3.649 20 10 EHCDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(OC)c(OC)cc2O)c1 ZINC000179657596 1139772372 /nfs/dbraw/zinc/77/23/72/1139772372.db2.gz LFQYGOXVFAABDG-KRWDZBQOSA-N 1 1 343.423 3.755 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@H]2c2ccncc2)cc1OC ZINC000183447283 1140038761 /nfs/dbraw/zinc/03/87/61/1140038761.db2.gz WUTPUJWMOAGGRZ-KRWDZBQOSA-N 1 1 342.439 3.922 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@@H](C)c1ccc(F)cc1O)O[C@H](C)C2 ZINC000184975039 1140129205 /nfs/dbraw/zinc/12/92/05/1140129205.db2.gz IDZZXMDOOMABPC-NEPJUHHUSA-N 1 1 331.387 3.714 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3nccn3-c3ccccc3)ccc21 ZINC000190907870 1140424334 /nfs/dbraw/zinc/42/43/34/1140424334.db2.gz QTYHFTMTLLIXMX-UHFFFAOYSA-N 1 1 332.451 3.545 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000271165804 1141317292 /nfs/dbraw/zinc/31/72/92/1141317292.db2.gz RULWSGNCBDHFNP-SFHVURJKSA-N 1 1 339.435 3.644 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc(C(F)(F)F)cs1 ZINC000274557273 1014229274 /nfs/dbraw/zinc/22/92/74/1014229274.db2.gz FIPITZJQYGOGBL-VIFPVBQESA-N 1 1 328.359 3.948 20 10 EHCDMO COc1ccc(O)c(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000274593800 1014289053 /nfs/dbraw/zinc/28/90/53/1014289053.db2.gz KIBPHKSSNKOTHR-QMMMGPOBSA-N 1 1 332.347 3.727 20 10 EHCDMO CC[N@@H+](CCCCCCO)Cc1cc(Br)ccc1O ZINC000175776899 1016036437 /nfs/dbraw/zinc/03/64/37/1016036437.db2.gz KZYWMZXEUGJNPU-UHFFFAOYSA-N 1 1 330.266 3.529 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@@H](c3ccc(F)c(F)c3)C1)CCC2 ZINC000066794768 1018028638 /nfs/dbraw/zinc/02/86/38/1018028638.db2.gz OGWRFLUKZUFBLX-HXUWFJFHSA-N 1 1 345.389 3.733 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3ccc(F)c(F)c3)C1)CCC2 ZINC000066794768 1018028651 /nfs/dbraw/zinc/02/86/51/1018028651.db2.gz OGWRFLUKZUFBLX-HXUWFJFHSA-N 1 1 345.389 3.733 20 10 EHCDMO CC[C@@H]([NH2+]C1CCN(C(=O)OC(C)C)CC1)c1ccc(F)cc1O ZINC000796824396 1018235709 /nfs/dbraw/zinc/23/57/09/1018235709.db2.gz GVLVTCIFFAYDQN-MRXNPFEDSA-N 1 1 338.423 3.581 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cc1OC ZINC000160377424 1018650968 /nfs/dbraw/zinc/65/09/68/1018650968.db2.gz GHEYMNXCALYCMZ-RHSMWYFYSA-N 1 1 327.424 3.787 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204727468 1019171720 /nfs/dbraw/zinc/17/17/20/1019171720.db2.gz AEQOUGQLEOIPGR-UHFFFAOYSA-N 1 1 329.271 3.665 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1O ZINC000091891327 1032858572 /nfs/dbraw/zinc/85/85/72/1032858572.db2.gz HBFPLGFZGCHSEI-GJZGRUSLSA-N 1 1 333.453 3.550 20 10 EHCDMO OCC1([C@H]([NH2+]Cc2cc(F)cc(F)c2O)c2cccs2)CCC1 ZINC000894946023 1022268345 /nfs/dbraw/zinc/26/83/45/1022268345.db2.gz CKJRLSYKIGMZHU-MRXNPFEDSA-N 1 1 339.407 3.725 20 10 EHCDMO C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1cccc(Br)c1[O-] ZINC000048794765 1022840162 /nfs/dbraw/zinc/84/01/62/1022840162.db2.gz RXLIWEUOPCUGNN-CYBMUJFWSA-N 1 1 341.293 3.509 20 10 EHCDMO COCc1ccccc1C[NH2+]Cc1cccc(Br)c1O ZINC000048797311 1022883117 /nfs/dbraw/zinc/88/31/17/1022883117.db2.gz BIMWMCDNOVOMEI-UHFFFAOYSA-N 1 1 336.229 3.591 20 10 EHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc(OC)c2O)[nH]1 ZINC000277069129 1023735262 /nfs/dbraw/zinc/73/52/62/1023735262.db2.gz DUUAJJYNPQVQJA-UWVGGRQHSA-N 1 1 338.839 3.537 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc(F)c(F)cc1O ZINC001142520563 1033194715 /nfs/dbraw/zinc/19/47/15/1033194715.db2.gz LMRBBNYOURDAGL-UHFFFAOYSA-N 1 1 332.394 3.903 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc(F)c(F)cc1O ZINC001142520563 1033194726 /nfs/dbraw/zinc/19/47/26/1033194726.db2.gz LMRBBNYOURDAGL-UHFFFAOYSA-N 1 1 332.394 3.903 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c(O)c1 ZINC000896228541 1025261745 /nfs/dbraw/zinc/26/17/45/1025261745.db2.gz SRABZXZSKFRJAA-CQSZACIVSA-N 1 1 333.325 3.657 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)c(O)c1OC ZINC000892193897 1025365217 /nfs/dbraw/zinc/36/52/17/1025365217.db2.gz ITCZIUCMTXRLOF-UHFFFAOYSA-N 1 1 345.439 3.829 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nnc3n2CCCCC3)cc1 ZINC000326817911 1026074642 /nfs/dbraw/zinc/07/46/42/1026074642.db2.gz WZBCPWFVAAHVCT-INIZCTEOSA-N 1 1 341.503 3.702 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)NC(C)(C)C)Cc1ccccc1O ZINC000176677174 1026427038 /nfs/dbraw/zinc/42/70/38/1026427038.db2.gz VWJKMSCIZTWHBR-MRXNPFEDSA-N 1 1 340.467 3.870 20 10 EHCDMO CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224425 1026912005 /nfs/dbraw/zinc/91/20/05/1026912005.db2.gz JKHZSAPHTQALSN-IRXDYDNUSA-N 1 1 333.495 3.808 20 10 EHCDMO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224425 1026912016 /nfs/dbraw/zinc/91/20/16/1026912016.db2.gz JKHZSAPHTQALSN-IRXDYDNUSA-N 1 1 333.495 3.808 20 10 EHCDMO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224425 1026912019 /nfs/dbraw/zinc/91/20/19/1026912019.db2.gz JKHZSAPHTQALSN-IRXDYDNUSA-N 1 1 333.495 3.808 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCc2csc(C(C)C)n2)c1 ZINC000273605181 1027516531 /nfs/dbraw/zinc/51/65/31/1027516531.db2.gz TXNLDOZUAJDVNW-GFCCVEGCSA-N 1 1 348.468 3.652 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000271902561 1029223086 /nfs/dbraw/zinc/22/30/86/1029223086.db2.gz ZNONPKKJRPGOOX-PBHICJAKSA-N 1 1 333.453 3.550 20 10 EHCDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093706021 1029396050 /nfs/dbraw/zinc/39/60/50/1029396050.db2.gz VMKMXICKOBZUQY-MRXNPFEDSA-N 1 1 330.497 3.648 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000195136725 1032048843 /nfs/dbraw/zinc/04/88/43/1032048843.db2.gz TVTGWUHIIANSEE-DOTOQJQBSA-N 1 1 328.431 3.704 20 10 EHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071214 1033320442 /nfs/dbraw/zinc/32/04/42/1033320442.db2.gz HMTHNXAQDBSDBL-JTQLQIEISA-N 1 1 326.824 3.706 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071214 1033320450 /nfs/dbraw/zinc/32/04/50/1033320450.db2.gz HMTHNXAQDBSDBL-JTQLQIEISA-N 1 1 326.824 3.706 20 10 EHCDMO CCC[N@@H+](Cc1nc(-c2ccc(F)cc2)no1)Cc1ccccc1O ZINC000170779371 1033600647 /nfs/dbraw/zinc/60/06/47/1033600647.db2.gz JDUQQKMANOTBKI-UHFFFAOYSA-N 1 1 341.386 3.994 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1O ZINC000091966768 1034491986 /nfs/dbraw/zinc/49/19/86/1034491986.db2.gz GTGDDNWIYLJGBC-ROUUACIJSA-N 1 1 345.414 3.628 20 10 EHCDMO COc1cc(C[N@@H+](C)CCCn2ccnc2C)c(O)c(C(C)(C)C)c1 ZINC000164539259 1035656626 /nfs/dbraw/zinc/65/66/26/1035656626.db2.gz BCPWKFGPXOTIEP-UHFFFAOYSA-N 1 1 345.487 3.725 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)ccc1O)c1nc(-c2cccc(F)c2)no1 ZINC000190040432 1036186530 /nfs/dbraw/zinc/18/65/30/1036186530.db2.gz FSRSBAWBZOWUIV-JTQLQIEISA-N 1 1 331.322 3.571 20 10 EHCDMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3cc(C(C)C)c(C)cc3O)[C@H]2C1 ZINC000165274951 1036372440 /nfs/dbraw/zinc/37/24/40/1036372440.db2.gz VREFFPUUQPCINP-KPFFTGBYSA-N 1 1 333.472 3.592 20 10 EHCDMO CC[C@H]([NH2+]Cc1nncn1-c1ccccc1)c1ccc(N(C)C)cc1 ZINC000152666501 1037487263 /nfs/dbraw/zinc/48/72/63/1037487263.db2.gz IFHINLARHVSJSF-IBGZPJMESA-N 1 1 335.455 3.574 20 10 EHCDMO C[N@H+](Cc1ccccc1O)Cc1cc(Br)ncc1Cl ZINC001233428169 1037550925 /nfs/dbraw/zinc/55/09/25/1037550925.db2.gz AABJMABBYLZYHF-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Br)ncc1Cl ZINC001233428169 1037550941 /nfs/dbraw/zinc/55/09/41/1037550941.db2.gz AABJMABBYLZYHF-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000905677440 1039037924 /nfs/dbraw/zinc/03/79/24/1039037924.db2.gz IMDYZYGEMPIQKB-AWEZNQCLSA-N 1 1 333.325 3.576 20 10 EHCDMO CCC[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@H]21)Cc1ccccc1O ZINC000728927198 1039504215 /nfs/dbraw/zinc/50/42/15/1039504215.db2.gz MAZJKAONMUWZFJ-PKOBYXMFSA-N 1 1 344.499 3.785 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc3oc(=O)oc3c2)C2CC2)cc1 ZINC000893929772 1039841918 /nfs/dbraw/zinc/84/19/18/1039841918.db2.gz WRRRZHFYQUIUBL-UHFFFAOYSA-N 1 1 338.407 3.617 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000894085542 1040042808 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EHCDMO CC[C@@H]1CN(c2ccccc2)CC[N@H+]1Cc1cc(OC)ccc1O ZINC000764678924 1127519764 /nfs/dbraw/zinc/51/97/64/1127519764.db2.gz OWBDXUXMAUDCDS-QGZVFWFLSA-N 1 1 326.440 3.502 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1C ZINC000139962310 1128157373 /nfs/dbraw/zinc/15/73/73/1128157373.db2.gz BWJATWWYUNPVDV-INIZCTEOSA-N 1 1 348.487 3.746 20 10 EHCDMO CCN(CC)c1ccc(CN[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648903184 1120064125 /nfs/dbraw/zinc/06/41/25/1120064125.db2.gz JFKZQMZWBNHALN-CEXWTWQISA-N 1 1 331.548 3.989 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)CN2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648903184 1120064130 /nfs/dbraw/zinc/06/41/30/1120064130.db2.gz JFKZQMZWBNHALN-CEXWTWQISA-N 1 1 331.548 3.989 20 10 EHCDMO Fc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)ccc1N1CCOCC1 ZINC000155064879 1123126036 /nfs/dbraw/zinc/12/60/36/1123126036.db2.gz KFUMENFMMBYVCG-IBGZPJMESA-N 1 1 340.442 3.652 20 10 EHCDMO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC000179939617 1123900354 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Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000738056419 1131462282 /nfs/dbraw/zinc/46/22/82/1131462282.db2.gz POHFOSQFIILJAI-GJZGRUSLSA-N 1 1 325.408 3.807 20 10 EHCDMO C[N@H+](Cc1ccon1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000739879865 1131512771 /nfs/dbraw/zinc/51/27/71/1131512771.db2.gz NVBFSCQINOCROV-UHFFFAOYSA-N 1 1 347.212 3.928 20 10 EHCDMO C[N@@H+](Cc1ccon1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000739879865 1131512774 /nfs/dbraw/zinc/51/27/74/1131512774.db2.gz NVBFSCQINOCROV-UHFFFAOYSA-N 1 1 347.212 3.928 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@H]2C2OCCO2)c(O)c(C(C)(C)C)c1 ZINC000742150616 1131693208 /nfs/dbraw/zinc/69/32/08/1131693208.db2.gz VQLVNCICPYBBSC-KRWDZBQOSA-N 1 1 333.472 3.726 20 10 EHCDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)c(C)n1-c1cccc(Cl)c1 ZINC000742198061 1131696858 /nfs/dbraw/zinc/69/68/58/1131696858.db2.gz DXNKWUXQRDUJKL-CQSZACIVSA-N 1 1 345.874 3.524 20 10 EHCDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)c(C)n1-c1cccc(Cl)c1 ZINC000742198061 1131696862 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EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000768206963 1133107584 /nfs/dbraw/zinc/10/75/84/1133107584.db2.gz MPEOPTAAEDKPFT-UHFFFAOYSA-N 1 1 326.440 3.633 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc(F)c(Cl)c1 ZINC000768208541 1133107687 /nfs/dbraw/zinc/10/76/87/1133107687.db2.gz SRIAIPLUEXWMPR-UHFFFAOYSA-N 1 1 348.849 3.948 20 10 EHCDMO COC(=O)c1ccccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768258141 1133118600 /nfs/dbraw/zinc/11/86/00/1133118600.db2.gz QOBCIBFPZSDRSC-UHFFFAOYSA-N 1 1 338.451 3.704 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000768336939 1133126608 /nfs/dbraw/zinc/12/66/08/1133126608.db2.gz CGXNXSDVSBWHQO-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO COC(=O)[C@@H](C)C[N@@H+](Cc1ccccc1)Cc1cc(C)ccc1O ZINC000768353516 1133128965 /nfs/dbraw/zinc/12/89/65/1133128965.db2.gz ZPFMNGSGRKLAGJ-INIZCTEOSA-N 1 1 327.424 3.512 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)CCCCc2ccccc2)cc1OC ZINC000768439902 1133139270 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CC[N@@H+](CCc1cccs1)Cc1ccc(N2CCOCC2)cc1 ZINC000768756776 1133177841 /nfs/dbraw/zinc/17/78/41/1133177841.db2.gz CAAVPNCXMJGMAM-UHFFFAOYSA-N 1 1 330.497 3.649 20 10 EHCDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000769192830 1133234063 /nfs/dbraw/zinc/23/40/63/1133234063.db2.gz PVNDKBQQCBFRHX-UHFFFAOYSA-N 1 1 344.886 3.851 20 10 EHCDMO CC1CC[NH+](C[C@H]2CCCN(Cc3ccc(N(C)C)cc3)C2)CC1 ZINC000769147966 1133235213 /nfs/dbraw/zinc/23/52/13/1133235213.db2.gz KBGAKACISIZIEN-HXUWFJFHSA-N 1 1 329.532 3.697 20 10 EHCDMO Fc1cc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)ccc1N1CCOCC1 ZINC000769426644 1133282619 /nfs/dbraw/zinc/28/26/19/1133282619.db2.gz GLNIVSSCHZHMHQ-OAQYLSRUSA-N 1 1 344.474 3.985 20 10 EHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769483406 1133289245 /nfs/dbraw/zinc/28/92/45/1133289245.db2.gz PWMHQSBGOHNSNU-MRXNPFEDSA-N 1 1 340.442 3.609 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)c1O ZINC000769445635 1133290990 /nfs/dbraw/zinc/29/09/90/1133290990.db2.gz JDBTTZHLJKPEHK-WDEREUQCSA-N 1 1 328.250 3.784 20 10 EHCDMO CCOc1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C(C)C)c(O)c1 ZINC000769458059 1133294752 /nfs/dbraw/zinc/29/47/52/1133294752.db2.gz SMERDYDOMNTSJW-FQEVSTJZSA-N 1 1 343.467 3.810 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CCCO1 ZINC000769461886 1133295575 /nfs/dbraw/zinc/29/55/75/1133295575.db2.gz AYAOCDAREZNDPT-UHFFFAOYSA-N 1 1 347.459 3.586 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000769466918 1133296870 /nfs/dbraw/zinc/29/68/70/1133296870.db2.gz PDWMAOLFPRSHSR-HXUWFJFHSA-N 1 1 329.532 3.983 20 10 EHCDMO COC[C@H](C)C[N@@H+](C)Cc1cc(C)n(-c2ccc(OC)cc2)c1C ZINC001179920503 1133307676 /nfs/dbraw/zinc/30/76/76/1133307676.db2.gz SYTGQLUWERSJSH-OAHLLOKOSA-N 1 1 330.472 3.817 20 10 EHCDMO CC(C)OC(=O)[C@H](C)[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000769523621 1133308756 /nfs/dbraw/zinc/30/87/56/1133308756.db2.gz GWEPZFOEBYUHAT-HNNXBMFYSA-N 1 1 327.424 3.831 20 10 EHCDMO CC(C)OC(=O)[C@H](C)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000769523621 1133308762 /nfs/dbraw/zinc/30/87/62/1133308762.db2.gz GWEPZFOEBYUHAT-HNNXBMFYSA-N 1 1 327.424 3.831 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1F ZINC000770376691 1133415218 /nfs/dbraw/zinc/41/52/18/1133415218.db2.gz XBNMBRNOWBKUJD-ZWKOTPCHSA-N 1 1 334.479 3.920 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774220373 1133641034 /nfs/dbraw/zinc/64/10/34/1133641034.db2.gz XTZYJKYWAJTUAF-DCAQKATOSA-N 1 1 329.271 3.975 20 10 EHCDMO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)CCNC(=O)OC(C)(C)C ZINC001182910711 1133749247 /nfs/dbraw/zinc/74/92/47/1133749247.db2.gz PIWSNQVTFWNNRR-CMDGGOBGSA-N 1 1 347.503 3.612 20 10 EHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F ZINC001182942720 1133750530 /nfs/dbraw/zinc/75/05/30/1133750530.db2.gz ZDXNOYLGRJDQPP-CZUORRHYSA-N 1 1 341.304 3.556 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@H](C(C)(C)O)C2)cc1 ZINC001183653014 1133836468 /nfs/dbraw/zinc/83/64/68/1133836468.db2.gz XRMUACQTSMWRHC-KRWDZBQOSA-N 1 1 344.524 3.977 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)nc1)c1cccc(C(F)(F)F)c1O ZINC000788518164 1134136349 /nfs/dbraw/zinc/13/63/49/1134136349.db2.gz GQQXJZYALOKTQY-LLVKDONJSA-N 1 1 339.361 3.723 20 10 EHCDMO COc1c(O)c(C[NH2+]CC[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775004029 1134197942 /nfs/dbraw/zinc/19/79/42/1134197942.db2.gz ASTLACJAXWVOJD-ZDUSSCGKSA-N 1 1 330.384 3.592 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1ncnn1C ZINC000788984272 1134200043 /nfs/dbraw/zinc/20/00/43/1134200043.db2.gz PYRYNNKNNNJYBW-HOTGVXAUSA-N 1 1 327.476 3.607 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H](C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000775025940 1134227902 /nfs/dbraw/zinc/22/79/02/1134227902.db2.gz XMIPAFXAPIKYEM-ZDUSSCGKSA-N 1 1 330.384 3.511 20 10 EHCDMO COC(=O)[C@@H]1CC[C@@H](c2ccccc2)[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000789379292 1134265631 /nfs/dbraw/zinc/26/56/31/1134265631.db2.gz WMCDWFPVRPYMOV-PMACEKPBSA-N 1 1 338.451 3.631 20 10 EHCDMO COC(=O)[C@@H]1CC[C@@H](c2ccccc2)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000789379292 1134265634 /nfs/dbraw/zinc/26/56/34/1134265634.db2.gz WMCDWFPVRPYMOV-PMACEKPBSA-N 1 1 338.451 3.631 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2c(C)oc3ccccc32)ccc1[N+](=O)[O-] ZINC000775071982 1134285009 /nfs/dbraw/zinc/28/50/09/1134285009.db2.gz VARQXLXCVOTOFE-UHFFFAOYSA-N 1 1 342.351 3.653 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000775117786 1134331864 /nfs/dbraw/zinc/33/18/64/1134331864.db2.gz HESOMIGOKAHDNN-SECBINFHSA-N 1 1 336.310 3.520 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cc(F)c(F)cc1F ZINC000775150976 1134397398 /nfs/dbraw/zinc/39/73/98/1134397398.db2.gz CVNUUGHIAYOHDL-UHFFFAOYSA-N 1 1 346.146 3.862 20 10 EHCDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cccc(O)c2O)cc1 ZINC000790537070 1134427520 /nfs/dbraw/zinc/42/75/20/1134427520.db2.gz ASYSLVKHNLNKGJ-CQSZACIVSA-N 1 1 340.423 3.725 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000790935138 1134480620 /nfs/dbraw/zinc/48/06/20/1134480620.db2.gz VDTVTQLEKLSLSU-JSGCOSHPSA-N 1 1 342.277 3.589 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000790935138 1134480622 /nfs/dbraw/zinc/48/06/22/1134480622.db2.gz VDTVTQLEKLSLSU-JSGCOSHPSA-N 1 1 342.277 3.589 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccsc1 ZINC000790949606 1134483768 /nfs/dbraw/zinc/48/37/68/1134483768.db2.gz NTDSGEOCGSYFIO-CYBMUJFWSA-N 1 1 328.840 3.639 20 10 EHCDMO CCC(=O)Nc1cccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790948916 1134483949 /nfs/dbraw/zinc/48/39/49/1134483949.db2.gz NIKOBPLCWUFDJJ-UHFFFAOYSA-N 1 1 336.794 3.823 20 10 EHCDMO COc1ccc(OCCC[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790955705 1134484767 /nfs/dbraw/zinc/48/47/67/1134484767.db2.gz JMLHEEGWEXMGOC-UHFFFAOYSA-N 1 1 339.794 3.752 20 10 EHCDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792174367 1134663377 /nfs/dbraw/zinc/66/33/77/1134663377.db2.gz UHCHBFRNVVIMPQ-NSHDSACASA-N 1 1 343.826 3.596 20 10 EHCDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792174367 1134663380 /nfs/dbraw/zinc/66/33/80/1134663380.db2.gz UHCHBFRNVVIMPQ-NSHDSACASA-N 1 1 343.826 3.596 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C(=O)NC1CC1)c1ccccc1 ZINC000772797639 1134698858 /nfs/dbraw/zinc/69/88/58/1134698858.db2.gz HQNJAMAJGVXSIU-FQEVSTJZSA-N 1 1 338.451 3.624 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)CC2(O)CCCC2)c(C(F)(F)F)c1 ZINC000792828725 1134798139 /nfs/dbraw/zinc/79/81/39/1134798139.db2.gz WWMMPTHHBQPXBP-UHFFFAOYSA-N 1 1 330.394 3.508 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2nccs2)c(C(F)(F)F)c1 ZINC000792835084 1134798501 /nfs/dbraw/zinc/79/85/01/1134798501.db2.gz KNLFFMROXUNPSK-UHFFFAOYSA-N 1 1 343.418 3.902 20 10 EHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cccc(Br)c1O ZINC000793231325 1134879815 /nfs/dbraw/zinc/87/98/15/1134879815.db2.gz MILXBZJZAWJAQO-WPRPVWTQSA-N 1 1 338.167 3.927 20 10 EHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cccc(Br)c1O ZINC000793231325 1134879821 /nfs/dbraw/zinc/87/98/21/1134879821.db2.gz MILXBZJZAWJAQO-WPRPVWTQSA-N 1 1 338.167 3.927 20 10 EHCDMO O=[N+]([O-])c1cc(C[NH+]2CCC(F)(F)CC2)ccc1N1CCCCC1 ZINC000793360065 1134909085 /nfs/dbraw/zinc/90/90/85/1134909085.db2.gz PIEZSFRQXALIAN-UHFFFAOYSA-N 1 1 339.386 3.816 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1F ZINC000793614012 1134972491 /nfs/dbraw/zinc/97/24/91/1134972491.db2.gz NVJQLKAGCHNDLG-CABCVRRESA-N 1 1 331.262 3.907 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2(Cc3ccccc3)CC2)c1 ZINC000775565311 1135099325 /nfs/dbraw/zinc/09/93/25/1135099325.db2.gz ILRLZYZMXBYFGT-CQSZACIVSA-N 1 1 325.408 3.605 20 10 EHCDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3cc(OC)ccc3O)C2)cc1 ZINC000775690737 1135529526 /nfs/dbraw/zinc/52/95/26/1135529526.db2.gz SHUYJELESJGXNW-KRWDZBQOSA-N 1 1 341.451 3.864 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1 ZINC001196218315 1135534154 /nfs/dbraw/zinc/53/41/54/1135534154.db2.gz PHUQJGFMBSPRAJ-VQIMIIECSA-N 1 1 346.515 3.942 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1O ZINC001196292813 1135543790 /nfs/dbraw/zinc/54/37/90/1135543790.db2.gz AJWWUSVWMFRSTE-QGZVFWFLSA-N 1 1 345.826 3.902 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1O ZINC000775713548 1135558588 /nfs/dbraw/zinc/55/85/88/1135558588.db2.gz JPSPGBZYHMATQY-KRWDZBQOSA-N 1 1 327.399 3.935 20 10 EHCDMO COc1cc(C[N@@H+]2CC[C@H](N3CCCC3)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191647 1135628356 /nfs/dbraw/zinc/62/83/56/1135628356.db2.gz OVOVJGHLORNFSJ-BEFAXECRSA-N 1 1 346.515 3.757 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](N3CCCC3)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191647 1135628360 /nfs/dbraw/zinc/62/83/60/1135628360.db2.gz OVOVJGHLORNFSJ-BEFAXECRSA-N 1 1 346.515 3.757 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H](C(C)(C)O)C2)ccc1N1CCCCC1 ZINC001197587702 1135711018 /nfs/dbraw/zinc/71/10/18/1135711018.db2.gz DGECZQOLULMIQW-LJQANCHMSA-N 1 1 330.516 3.968 20 10 EHCDMO CN(C)c1ccc(CN2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)cc1 ZINC001197589830 1135711890 /nfs/dbraw/zinc/71/18/90/1135711890.db2.gz NUPYCLXMUJGYTK-GGAORHGYSA-N 1 1 349.522 3.707 20 10 EHCDMO CN(C)c1ccc(C[N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)cc1 ZINC001197589830 1135711906 /nfs/dbraw/zinc/71/19/06/1135711906.db2.gz NUPYCLXMUJGYTK-GGAORHGYSA-N 1 1 349.522 3.707 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)cc1 ZINC001197589830 1135711910 /nfs/dbraw/zinc/71/19/10/1135711910.db2.gz NUPYCLXMUJGYTK-GGAORHGYSA-N 1 1 349.522 3.707 20 10 EHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2nnc3n2CCCCC3)c1O ZINC000808672369 1135713355 /nfs/dbraw/zinc/71/33/55/1135713355.db2.gz LDUOWNQQTYLHKX-GFCCVEGCSA-N 1 1 334.851 3.523 20 10 EHCDMO Cc1cccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1O ZINC000809768528 1135880612 /nfs/dbraw/zinc/88/06/12/1135880612.db2.gz ODTZXHIYFNKHBE-DOTOQJQBSA-N 1 1 329.465 3.701 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1O ZINC000809758077 1135887555 /nfs/dbraw/zinc/88/75/55/1135887555.db2.gz BSOIEZPSDBGUPZ-KGLIPLIRSA-N 1 1 339.863 3.693 20 10 EHCDMO CCOC(=O)CC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000776003197 1135916970 /nfs/dbraw/zinc/91/69/70/1135916970.db2.gz HSWOPBVMOUXWSV-INIZCTEOSA-N 1 1 327.424 3.909 20 10 EHCDMO CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810229811 1135941483 /nfs/dbraw/zinc/94/14/83/1135941483.db2.gz KYPFNPWLKDSRCC-HNNXBMFYSA-N 1 1 328.378 3.714 20 10 EHCDMO CC[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810229811 1135941485 /nfs/dbraw/zinc/94/14/85/1135941485.db2.gz KYPFNPWLKDSRCC-HNNXBMFYSA-N 1 1 328.378 3.714 20 10 EHCDMO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@H]1CCOC(C)(C)C1 ZINC000811511479 1136102466 /nfs/dbraw/zinc/10/24/66/1136102466.db2.gz JSTWWLDBDDGHEG-AWEZNQCLSA-N 1 1 327.852 3.834 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c(O)c1 ZINC000811512140 1136102983 /nfs/dbraw/zinc/10/29/83/1136102983.db2.gz DWXQLQQRWMMQMU-NRFANRHFSA-N 1 1 339.435 3.761 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC000811791796 1136141590 /nfs/dbraw/zinc/14/15/90/1136141590.db2.gz VRBLOVBNKBJDEG-MJGOQNOKSA-N 1 1 345.483 3.929 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N(C)Cc2cccs2)cc1)c1nccn1C ZINC000850409996 1136252208 /nfs/dbraw/zinc/25/22/08/1136252208.db2.gz LGKDKPSDAAMDPG-HNNXBMFYSA-N 1 1 340.496 3.969 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000850483438 1136267502 /nfs/dbraw/zinc/26/75/02/1136267502.db2.gz YQUCHHKZCBCHRV-NWDGAFQWSA-N 1 1 330.394 3.934 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)c(C)s1 ZINC000850566196 1136287392 /nfs/dbraw/zinc/28/73/92/1136287392.db2.gz LQRSSKOZLINOOS-CYBMUJFWSA-N 1 1 345.512 3.572 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccc(Cl)c(Cl)c1)Cc1ccccc1O ZINC000109772612 1136340041 /nfs/dbraw/zinc/34/00/41/1136340041.db2.gz UAHNZQCSCYIQKG-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c(Cl)c1)Cc1ccccc1O ZINC000109772612 1136340045 /nfs/dbraw/zinc/34/00/45/1136340045.db2.gz UAHNZQCSCYIQKG-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO Cc1noc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1[N+](=O)[O-] ZINC000851768678 1136406135 /nfs/dbraw/zinc/40/61/35/1136406135.db2.gz CPWVTWLZJDEDCA-UHFFFAOYSA-N 1 1 331.372 3.542 20 10 EHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CC(C)(C)OC1=O ZINC000814179710 1136411955 /nfs/dbraw/zinc/41/19/55/1136411955.db2.gz GSHQCMUIQVFIGN-KRWDZBQOSA-N 1 1 325.408 3.585 20 10 EHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CC(C)(C)OC1=O ZINC000814179710 1136411956 /nfs/dbraw/zinc/41/19/56/1136411956.db2.gz GSHQCMUIQVFIGN-KRWDZBQOSA-N 1 1 325.408 3.585 20 10 EHCDMO CCc1cc(C[N@H+]2CCC3=C(CCC(=O)N3)C2)c(O)c(C(C)(C)C)c1 ZINC000853520149 1136540391 /nfs/dbraw/zinc/54/03/91/1136540391.db2.gz HVWAODPMASBFOS-UHFFFAOYSA-N 1 1 342.483 3.622 20 10 EHCDMO COc1cc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c(O)cc1C ZINC000853550393 1136544064 /nfs/dbraw/zinc/54/40/64/1136544064.db2.gz MZXXBCKIQOISJQ-LJQANCHMSA-N 1 1 343.423 3.656 20 10 EHCDMO Cc1cc(C[N@@H+]2CCC[C@H](c3nncn3C(C)C)C2)ccc1N(C)C ZINC000815074866 1136547099 /nfs/dbraw/zinc/54/70/99/1136547099.db2.gz HLMQREZXRGZASK-SFHVURJKSA-N 1 1 341.503 3.613 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074189 1136547487 /nfs/dbraw/zinc/54/74/87/1136547487.db2.gz LDUONBXRLRHGPX-RXVVDRJESA-N 1 1 327.516 3.510 20 10 EHCDMO Cc1cc(C[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ccc1N(C)C ZINC000815074189 1136547490 /nfs/dbraw/zinc/54/74/90/1136547490.db2.gz LDUONBXRLRHGPX-RXVVDRJESA-N 1 1 327.516 3.510 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](CCOC)Cc2scnc2C)cc1 ZINC000815104284 1136557028 /nfs/dbraw/zinc/55/70/28/1136557028.db2.gz GPWUMLLCCKYFPS-UHFFFAOYSA-N 1 1 333.501 3.556 20 10 EHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2[O-])C1 ZINC000815564051 1136611342 /nfs/dbraw/zinc/61/13/42/1136611342.db2.gz WAPNTVVEDZXRKW-CHWSQXEVSA-N 1 1 330.394 3.794 20 10 EHCDMO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815576001 1136613064 /nfs/dbraw/zinc/61/30/64/1136613064.db2.gz GUAPZJDBDDAOJJ-NXEZZACHSA-N 1 1 327.350 3.865 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1 ZINC001170804374 1136643690 /nfs/dbraw/zinc/64/36/90/1136643690.db2.gz NPXUTBPSOINERL-NRFANRHFSA-N 1 1 335.495 3.780 20 10 EHCDMO Oc1c(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521256 1136727085 /nfs/dbraw/zinc/72/70/85/1136727085.db2.gz KRMPHLQOUIKEAU-UWJYYQICSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc2ccccc21 ZINC000816521256 1136727086 /nfs/dbraw/zinc/72/70/86/1136727086.db2.gz KRMPHLQOUIKEAU-UWJYYQICSA-N 1 1 336.479 3.994 20 10 EHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816531693 1136730701 /nfs/dbraw/zinc/73/07/01/1136730701.db2.gz AJNSJRSVYJSSFS-JTQLQIEISA-N 1 1 336.794 3.994 20 10 EHCDMO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc3ccccc3c1O)CC2 ZINC000816565574 1136737334 /nfs/dbraw/zinc/73/73/34/1136737334.db2.gz UEESXPFGVOYAPZ-UHFFFAOYSA-N 1 1 347.414 3.890 20 10 EHCDMO C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1[O-] ZINC000817585236 1136825531 /nfs/dbraw/zinc/82/55/31/1136825531.db2.gz DETSRCCQIDVBOA-LMWSTFAQSA-N 1 1 341.293 3.678 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1cc(F)c(F)c(F)c1 ZINC000817938115 1136847917 /nfs/dbraw/zinc/84/79/17/1136847917.db2.gz DUPQJZCQCSOLFR-PIGZYNQJSA-N 1 1 337.389 3.521 20 10 EHCDMO CC(C)C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817941426 1136848183 /nfs/dbraw/zinc/84/81/83/1136848183.db2.gz JSFUBQRLUPXXIC-ICSRJNTNSA-N 1 1 326.488 3.524 20 10 EHCDMO Cc1ccc([C@@H]([NH2+]C[C@@H](N)c2ccc(N(C)C)cc2)C2CCC2)o1 ZINC000817942960 1136849476 /nfs/dbraw/zinc/84/94/76/1136849476.db2.gz SCWGPVCDITVDBS-QUCCMNQESA-N 1 1 327.472 3.785 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817946915 1136849860 /nfs/dbraw/zinc/84/98/60/1136849860.db2.gz HSZKVOKKXLHLPU-XUJVJEKNSA-N 1 1 341.293 3.584 20 10 EHCDMO C[C@@H](N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[C@@H]1CCC[NH2+]C1 ZINC000817948336 1136850603 /nfs/dbraw/zinc/85/06/03/1136850603.db2.gz XZAYDBWPZQTPQV-LZLYRXPVSA-N 1 1 333.495 3.855 20 10 EHCDMO COC(OC)c1ccc(F)c(CNc2ccc3c(c2)[nH+]cn3C)c1 ZINC000818196674 1136865342 /nfs/dbraw/zinc/86/53/42/1136865342.db2.gz VSSAXMMIQDYFEP-UHFFFAOYSA-N 1 1 329.375 3.616 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)c2ccns2)c1 ZINC000858316636 1136957975 /nfs/dbraw/zinc/95/79/75/1136957975.db2.gz FOBUJUVYIYDKBL-SECBINFHSA-N 1 1 327.247 3.770 20 10 EHCDMO COc1cc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000858245468 1136951887 /nfs/dbraw/zinc/95/18/87/1136951887.db2.gz JGIHNRUDMVHJDA-OAHLLOKOSA-N 1 1 334.504 3.520 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cc3n(n2)CCCC3)c(C)n1-c1ccccc1 ZINC000858295330 1136956022 /nfs/dbraw/zinc/95/60/22/1136956022.db2.gz ZJGUVEKBOYXZGL-UHFFFAOYSA-N 1 1 334.467 3.917 20 10 EHCDMO CC1(C)C[C@@H](c2ccccc2)[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000819901202 1136965610 /nfs/dbraw/zinc/96/56/10/1136965610.db2.gz VDHKWDOPKQEJSL-PKOBYXMFSA-N 1 1 339.435 3.791 20 10 EHCDMO C[C@@H]([NH2+]CC[C@@H](O)COCc1ccccc1)c1ccc(Cl)cc1O ZINC000858595591 1136981474 /nfs/dbraw/zinc/98/14/74/1136981474.db2.gz ROPYKTPZUWHGJN-RHSMWYFYSA-N 1 1 349.858 3.664 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859613143 1137022942 /nfs/dbraw/zinc/02/29/42/1137022942.db2.gz YPGUPTOWOUTEFT-CRAIPNDOSA-N 1 1 332.488 3.552 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)C(=O)NC(C)(C)CC)cc1 ZINC000862023661 1137127419 /nfs/dbraw/zinc/12/74/19/1137127419.db2.gz FSAFDSWURVSPLY-MRXNPFEDSA-N 1 1 333.520 3.658 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000824522596 1137141469 /nfs/dbraw/zinc/14/14/69/1137141469.db2.gz YCRPHQYQQKOCNB-UHFFFAOYSA-N 1 1 327.827 3.702 20 10 EHCDMO Cc1cccc2[nH]c(C[N@H+](C)Cc3ccc(N4CCOCC4)cc3)cc21 ZINC000824535810 1137141735 /nfs/dbraw/zinc/14/17/35/1137141735.db2.gz XGDRYUCGOKIQAG-UHFFFAOYSA-N 1 1 349.478 3.945 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000862484935 1137146772 /nfs/dbraw/zinc/14/67/72/1137146772.db2.gz CVWQXBKEOPAKDX-WMLDXEAASA-N 1 1 349.471 3.591 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1 ZINC000862527685 1137147949 /nfs/dbraw/zinc/14/79/49/1137147949.db2.gz RZZLVDRKURDCCD-NMMYMHLASA-N 1 1 348.556 3.798 20 10 EHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2O)CC1 ZINC000824777234 1137151579 /nfs/dbraw/zinc/15/15/79/1137151579.db2.gz MCBYJJLAEJOORS-OAHLLOKOSA-N 1 1 342.277 3.936 20 10 EHCDMO Cc1cc(O)c(C[NH+]2CCN([C@H](C)c3cccnc3)CC2)cc1Cl ZINC000824813723 1137153576 /nfs/dbraw/zinc/15/35/76/1137153576.db2.gz IJNOKKZQPORODU-OAHLLOKOSA-N 1 1 345.874 3.628 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2cnc(C)cc2C)c1 ZINC000825220971 1137169368 /nfs/dbraw/zinc/16/93/68/1137169368.db2.gz BBWGSSBKWDUSNZ-UHFFFAOYSA-N 1 1 335.245 3.765 20 10 EHCDMO Cc1cccc(C[N@H+](C)C2CCN(CCC(F)(F)F)CC2)c1O ZINC000825331587 1137173085 /nfs/dbraw/zinc/17/30/85/1137173085.db2.gz JCGJXDIBXHTWDA-UHFFFAOYSA-N 1 1 330.394 3.549 20 10 EHCDMO CO[C@@H](C)c1nc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cs1 ZINC000825326511 1137173230 /nfs/dbraw/zinc/17/32/30/1137173230.db2.gz RDIWJJQCSRASAA-JTQLQIEISA-N 1 1 326.849 3.808 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)C[C@@H](C)n1cc[nH+]c1CC ZINC000843880992 1137186455 /nfs/dbraw/zinc/18/64/55/1137186455.db2.gz SDWLCAFLUALYLR-MRXNPFEDSA-N 1 1 343.471 3.931 20 10 EHCDMO CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000863542085 1137191366 /nfs/dbraw/zinc/19/13/66/1137191366.db2.gz FLPLAZURLCZRBA-OXHMUOHRSA-N 1 1 347.684 3.599 20 10 EHCDMO Cc1c(F)cc(F)cc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001143764771 1137196631 /nfs/dbraw/zinc/19/66/31/1137196631.db2.gz ZOKGMAZMOVKVOF-UHFFFAOYSA-N 1 1 346.421 3.742 20 10 EHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc3c(c2)OCO3)c1O ZINC000120030909 1137225652 /nfs/dbraw/zinc/22/56/52/1137225652.db2.gz FEIYYUDVXVDKGH-UHFFFAOYSA-N 1 1 329.396 3.542 20 10 EHCDMO C[C@@H]1C[C@@H](N(C)Cc2ccc(N(C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC001171767757 1137509225 /nfs/dbraw/zinc/50/92/25/1137509225.db2.gz PMIDPONTCDTZBP-XMSQKQJNSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767757 1137509226 /nfs/dbraw/zinc/50/92/26/1137509226.db2.gz PMIDPONTCDTZBP-XMSQKQJNSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767757 1137509227 /nfs/dbraw/zinc/50/92/27/1137509227.db2.gz PMIDPONTCDTZBP-XMSQKQJNSA-N 1 1 337.511 3.847 20 10 EHCDMO CC1(C)C[C@@H]([NH2+]Cc2cccc(O)c2O)CCN1Cc1ccccc1 ZINC001171977215 1137525200 /nfs/dbraw/zinc/52/52/00/1137525200.db2.gz YYOLBHZZHUXNMT-SFHVURJKSA-N 1 1 340.467 3.631 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)on1 ZINC000876522088 1137654563 /nfs/dbraw/zinc/65/45/63/1137654563.db2.gz HGLSIJBNHVDUQU-UHFFFAOYSA-N 1 1 344.411 3.502 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnc(CCOC)s2)cc1 ZINC000876551149 1137655278 /nfs/dbraw/zinc/65/52/78/1137655278.db2.gz LZDRYJUSPARZRK-UHFFFAOYSA-N 1 1 347.528 3.810 20 10 EHCDMO CC1(C)C[N@H+](Cc2ccc(Br)cc2O)[C@@H]1[C@@H]1CCCO1 ZINC000825943726 1137671864 /nfs/dbraw/zinc/67/18/64/1137671864.db2.gz JAIFXSHDWUAWGQ-LSDHHAIUSA-N 1 1 340.261 3.544 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(Br)cc2O)[C@@H]1[C@@H]1CCCO1 ZINC000825943726 1137671865 /nfs/dbraw/zinc/67/18/65/1137671865.db2.gz JAIFXSHDWUAWGQ-LSDHHAIUSA-N 1 1 340.261 3.544 20 10 EHCDMO C[C@@]12CC[N@@H+](Cc3ccc(Br)cc3O)C[C@@H]1C2(F)F ZINC000825955385 1137674213 /nfs/dbraw/zinc/67/42/13/1137674213.db2.gz LZIABYWTKMWIHU-QWHCGFSZSA-N 1 1 332.188 3.632 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3cc(C(C)C)n[nH]3)C2)c1O ZINC000877785465 1137689998 /nfs/dbraw/zinc/68/99/98/1137689998.db2.gz ZJFLBNIHFRXJJD-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(C[N@@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000877785465 1137689999 /nfs/dbraw/zinc/68/99/99/1137689999.db2.gz ZJFLBNIHFRXJJD-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c1O ZINC000877785465 1137690000 /nfs/dbraw/zinc/69/00/00/1137690000.db2.gz ZJFLBNIHFRXJJD-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)c1O ZINC000878756585 1137727301 /nfs/dbraw/zinc/72/73/01/1137727301.db2.gz PSZCKSUGIYXFEM-OAHLLOKOSA-N 1 1 328.387 3.509 20 10 EHCDMO COc1ccc(-c2noc([C@@H](C)[NH2+][C@@H](C)c3ccccc3O)n2)cc1 ZINC000879651249 1137753885 /nfs/dbraw/zinc/75/38/85/1137753885.db2.gz ONZSRYBDHJHHKM-QWHCGFSZSA-N 1 1 339.395 3.863 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000826143137 1137768632 /nfs/dbraw/zinc/76/86/32/1137768632.db2.gz SZOGZXFCLZLEOV-ZDUSSCGKSA-N 1 1 332.188 3.776 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(N2CCCC2=O)cc1 ZINC000882925116 1137838841 /nfs/dbraw/zinc/83/88/41/1137838841.db2.gz VWHLDLUOOAEEAE-LBPRGKRZSA-N 1 1 346.377 3.648 20 10 EHCDMO Cc1ccc2cc(C[NH2+]Cc3ccc(N4CCN(C)CC4)cc3)[nH]c2c1 ZINC000883283093 1137852435 /nfs/dbraw/zinc/85/24/35/1137852435.db2.gz RASLNXBRDAMNPF-UHFFFAOYSA-N 1 1 348.494 3.518 20 10 EHCDMO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109772990 1137897531 /nfs/dbraw/zinc/89/75/31/1137897531.db2.gz OGWZRGMNGXISFT-OAHLLOKOSA-N 1 1 326.440 3.975 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1ccc(N(C)C)cc1 ZINC000120870013 1137953156 /nfs/dbraw/zinc/95/31/56/1137953156.db2.gz CEZYULYITXMSLM-HNNXBMFYSA-N 1 1 329.463 3.804 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@H](C)c1c(O)cccc1F)O[C@@H](C)C2 ZINC000886500318 1138084464 /nfs/dbraw/zinc/08/44/64/1138084464.db2.gz PEAZLYJQPUURRW-NWDGAFQWSA-N 1 1 331.387 3.714 20 10 EHCDMO CCCNC(=O)c1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886505025 1138085246 /nfs/dbraw/zinc/08/52/46/1138085246.db2.gz FPTFHPHFZAKEOW-CYBMUJFWSA-N 1 1 330.403 3.522 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc2c(c1)CCC(=O)N2 ZINC000886505021 1138085298 /nfs/dbraw/zinc/08/52/98/1138085298.db2.gz FCZFRYFXUAWMMW-RYUDHWBXSA-N 1 1 328.387 3.828 20 10 EHCDMO COC(=O)Nc1ccc(CC[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886549028 1138094765 /nfs/dbraw/zinc/09/47/65/1138094765.db2.gz AMASMLFMGSWDJE-GFCCVEGCSA-N 1 1 332.375 3.603 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1c(O)cccc1F ZINC000886603725 1138101020 /nfs/dbraw/zinc/10/10/20/1138101020.db2.gz UUYZBVWPOZIOLM-VFZGTOFNSA-N 1 1 327.758 3.708 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c([O-])cccc1F ZINC000886603333 1138101131 /nfs/dbraw/zinc/10/11/31/1138101131.db2.gz LPVVJFVGNKLERS-NVXWUHKLSA-N 1 1 328.431 3.704 20 10 EHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccc(OC)c(O)c2)c(O)c1 ZINC000092405147 1138227335 /nfs/dbraw/zinc/22/73/35/1138227335.db2.gz GQLFQMHYOPSZRM-UHFFFAOYSA-N 1 1 331.412 3.527 20 10 EHCDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 ZINC000174506030 1139424923 /nfs/dbraw/zinc/42/49/23/1139424923.db2.gz PSMBVZUMDSFLOJ-SFHVURJKSA-N 1 1 339.483 3.508 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000179584342 1139766265 /nfs/dbraw/zinc/76/62/65/1139766265.db2.gz SZAFVIGOPOXOPR-KRWDZBQOSA-N 1 1 335.350 3.567 20 10 EHCDMO CC[N@H+](Cc1ccccc1O)CC1CCN(c2ccccn2)CC1 ZINC000179578319 1139766624 /nfs/dbraw/zinc/76/66/24/1139766624.db2.gz ZMOQSGQWUDJVIS-UHFFFAOYSA-N 1 1 325.456 3.526 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)cc1OC ZINC000180154013 1139813139 /nfs/dbraw/zinc/81/31/39/1139813139.db2.gz WDWLJZRUHOXPEP-LLVKDONJSA-N 1 1 336.457 3.676 20 10 EHCDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183114475 1140014793 /nfs/dbraw/zinc/01/47/93/1140014793.db2.gz KAHOYCSFMSDIHL-SFHVURJKSA-N 1 1 341.451 3.830 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCSC2(CCOCC2)C1 ZINC000186504013 1140207340 /nfs/dbraw/zinc/20/73/40/1140207340.db2.gz SXEDTAVRLHNJAP-UHFFFAOYSA-N 1 1 346.540 3.775 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cscn1 ZINC000271069972 1141303927 /nfs/dbraw/zinc/30/39/27/1141303927.db2.gz DWGRMFNVAVRDMJ-MCIONIFRSA-N 1 1 349.475 3.747 20 10 EHCDMO C[C@@H](N[C@H](c1nccn1C)c1cccc(F)c1)c1ccc(F)cc1[O-] ZINC000184959492 1032347762 /nfs/dbraw/zinc/34/77/62/1032347762.db2.gz INDUUJQCBVOZPF-XIKOKIGWSA-N 1 1 343.377 3.844 20 10 EHCDMO Cc1ccccc1C[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000160522370 1019499893 /nfs/dbraw/zinc/49/98/93/1019499893.db2.gz UWMAWCBRRNCBRU-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cn(C(C)C)nn2)cc1F ZINC000925016471 1021555340 /nfs/dbraw/zinc/55/53/40/1021555340.db2.gz ZJBIHKVPACVBMU-AWEZNQCLSA-N 1 1 333.455 3.695 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)c(O)c1OC ZINC000891520240 1021820057 /nfs/dbraw/zinc/82/00/57/1021820057.db2.gz FCVYTJWKQIRSKS-UHFFFAOYSA-N 1 1 344.436 3.651 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)c(O)c1OC ZINC000891520240 1021820063 /nfs/dbraw/zinc/82/00/63/1021820063.db2.gz FCVYTJWKQIRSKS-UHFFFAOYSA-N 1 1 344.436 3.651 20 10 EHCDMO COc1ccc(C[N@H+]2CCSC3(CCCCC3)C2)c(O)c1OC ZINC000892123186 1024867045 /nfs/dbraw/zinc/86/70/45/1024867045.db2.gz KCSYQWHFEZVFLJ-UHFFFAOYSA-N 1 1 337.485 3.661 20 10 EHCDMO COC1(OC)CC2(C[N@@H+](Cc3cccc(Cl)c3[O-])[C@@H]2C(C)C)C1 ZINC000895989762 1025048124 /nfs/dbraw/zinc/04/81/24/1025048124.db2.gz OTTQKMNHGAUQQO-MRXNPFEDSA-N 1 1 339.863 3.655 20 10 EHCDMO CCc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896636258 1025789716 /nfs/dbraw/zinc/78/97/16/1025789716.db2.gz BTPGDAHZNUWTDY-ZDUSSCGKSA-N 1 1 330.403 3.601 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2OC)c1 ZINC000273417908 1027419850 /nfs/dbraw/zinc/41/98/50/1027419850.db2.gz REUYHTZNRZWUKJ-NWDGAFQWSA-N 1 1 347.386 3.738 20 10 EHCDMO CCOCc1ccccc1C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000273439601 1027427679 /nfs/dbraw/zinc/42/76/79/1027427679.db2.gz YAXZULSPAZJJND-CQSZACIVSA-N 1 1 343.423 3.566 20 10 EHCDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000121311938 1027521661 /nfs/dbraw/zinc/52/16/61/1027521661.db2.gz FNVNRMKALBTNOY-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO Cc1cc(C[NH2+]Cc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1C ZINC000840942894 1027861650 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CC1CC[NH+](CC[C@@H]2CCCN2Cc2ccc(N(C)C)cc2)CC1 ZINC001175351444 1132645232 /nfs/dbraw/zinc/64/52/32/1132645232.db2.gz MGGORKWXQPDXGW-NRFANRHFSA-N 1 1 329.532 3.839 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)O[C@H](C)C2)cc1 ZINC001175883012 1132780086 /nfs/dbraw/zinc/78/00/86/1132780086.db2.gz ODIUFWXFXAHXFB-CJNGLKHVSA-N 1 1 330.394 3.684 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1 ZINC000121358585 1132804872 /nfs/dbraw/zinc/80/48/72/1132804872.db2.gz MPLRJYQKNIJWLC-UHFFFAOYSA-N 1 1 337.423 3.609 20 10 EHCDMO CCc1cc(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c(O)c(C(C)(C)C)c1 ZINC000767783292 1133054060 /nfs/dbraw/zinc/05/40/60/1133054060.db2.gz TZTDUJCSYYCWLU-QZTJIDSGSA-N 1 1 349.540 3.958 20 10 EHCDMO CN(Cc1cccs1)c1ccc(CNC[C@H](C2CC2)[NH+](C)C)cc1 ZINC001177337318 1133056316 /nfs/dbraw/zinc/05/63/16/1133056316.db2.gz CVTWBDRKPKXWQS-HXUWFJFHSA-N 1 1 343.540 3.814 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cc(Cl)ccc1F ZINC000768209057 1133108941 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COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(C)cc1O ZINC000768445643 1133140004 /nfs/dbraw/zinc/14/00/04/1133140004.db2.gz SAMAUOHMJNPHGO-SFHVURJKSA-N 1 1 341.451 3.925 20 10 EHCDMO CCOc1ccc(C[N@@H+](CC)Cc2ccc(OC)cc2OC)c(O)c1 ZINC000768492267 1133148907 /nfs/dbraw/zinc/14/89/07/1133148907.db2.gz KYDXHSMVKVXVRY-UHFFFAOYSA-N 1 1 345.439 3.830 20 10 EHCDMO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2COc3cc(F)cc(F)c32)cc1 ZINC001178469603 1133171629 /nfs/dbraw/zinc/17/16/29/1133171629.db2.gz QGLIIZOVRGUUDF-REMYHPOOSA-N 1 1 330.378 3.767 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)CCCc2ccc(OC)cc2)c1O ZINC000768920017 1133203974 /nfs/dbraw/zinc/20/39/74/1133203974.db2.gz FDKXOVVKOHOJQL-UHFFFAOYSA-N 1 1 329.440 3.864 20 10 EHCDMO CCOc1ccc(O)c(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000769149007 1133235054 /nfs/dbraw/zinc/23/50/54/1133235054.db2.gz WUTABHWLPLUVDB-GOSISDBHSA-N 1 1 346.515 3.735 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000769214176 1133246141 /nfs/dbraw/zinc/24/61/41/1133246141.db2.gz SRVCDRROJNVRBQ-KGLIPLIRSA-N 1 1 338.879 3.562 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)c(O)c1 ZINC000769308232 1133258444 /nfs/dbraw/zinc/25/84/44/1133258444.db2.gz NHLMHNKKASGOJZ-FOIQADDNSA-N 1 1 327.424 3.753 20 10 EHCDMO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310153 1133258837 /nfs/dbraw/zinc/25/88/37/1133258837.db2.gz WZYPOFQBMAELLP-QRWLVFNGSA-N 1 1 328.431 3.854 20 10 EHCDMO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310153 1133258843 /nfs/dbraw/zinc/25/88/43/1133258843.db2.gz WZYPOFQBMAELLP-QRWLVFNGSA-N 1 1 328.431 3.854 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1C ZINC000769422869 1133281789 /nfs/dbraw/zinc/28/17/89/1133281789.db2.gz DXVQWBMRZBQXQR-HXUWFJFHSA-N 1 1 325.452 3.881 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c(O)c1 ZINC000769481369 1133288171 /nfs/dbraw/zinc/28/81/71/1133288171.db2.gz UASNXEKNZAVCCX-HXUWFJFHSA-N 1 1 345.414 3.812 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c(O)c1 ZINC000769481369 1133288173 /nfs/dbraw/zinc/28/81/73/1133288173.db2.gz UASNXEKNZAVCCX-HXUWFJFHSA-N 1 1 345.414 3.812 20 10 EHCDMO Fc1cc(C[N@H+]2CCC3(C2)CCCCC3)ccc1N1CCOCC1 ZINC000769487033 1133290607 /nfs/dbraw/zinc/29/06/07/1133290607.db2.gz GSEIZCDJYOKDJV-UHFFFAOYSA-N 1 1 332.463 3.819 20 10 EHCDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](C3CC3)C2)ccc1N1CCCCC1 ZINC000769515393 1133307357 /nfs/dbraw/zinc/30/73/57/1133307357.db2.gz PTHIDZOERQIPOX-KRWDZBQOSA-N 1 1 329.444 3.817 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)CC1(OC)CCCC1 ZINC001180141787 1133330838 /nfs/dbraw/zinc/33/08/38/1133330838.db2.gz IQDQJKHJPMZRBC-UHFFFAOYSA-N 1 1 342.277 3.936 20 10 EHCDMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1cccc(OC)c1O ZINC000770304416 1133409537 /nfs/dbraw/zinc/40/95/37/1133409537.db2.gz MTUQKOBUVKBFNM-KRWDZBQOSA-N 1 1 326.440 3.631 20 10 EHCDMO COc1ccc(C[N@@H+](C)C/C(C)=C/c2ccccc2)c(O)c1OC ZINC001180865290 1133422518 /nfs/dbraw/zinc/42/25/18/1133422518.db2.gz GOGKXSYFZUQISU-NTCAYCPXSA-N 1 1 327.424 3.945 20 10 EHCDMO Oc1cc(F)c(F)cc1C[NH2+]CCN1CCC2(CCCCC2)CC1 ZINC001181196702 1133465431 /nfs/dbraw/zinc/46/54/31/1133465431.db2.gz WDWCFOVZBSYPAH-UHFFFAOYSA-N 1 1 338.442 3.806 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC001182202464 1133591794 /nfs/dbraw/zinc/59/17/94/1133591794.db2.gz BBHYAXKJRNVLFW-HXUWFJFHSA-N 1 1 332.488 3.615 20 10 EHCDMO COCCCOc1cccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000771935411 1133616589 /nfs/dbraw/zinc/61/65/89/1133616589.db2.gz RPKPUZOLTSTECW-UHFFFAOYSA-N 1 1 342.483 3.800 20 10 EHCDMO C[C@H]([NH2+]CCCN1CCCCC1=O)c1cc(Cl)c(Cl)cc1O ZINC000774170445 1133627117 /nfs/dbraw/zinc/62/71/17/1133627117.db2.gz DKBQFRVVLFWHIC-NSHDSACASA-N 1 1 345.270 3.752 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc(N(C)C)cc2C)cc1 ZINC001182725319 1133725207 /nfs/dbraw/zinc/72/52/07/1133725207.db2.gz IKPJRHGGLCDFCW-UHFFFAOYSA-N 1 1 341.499 3.638 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H](O)c1cc(F)cc(Cl)c1 ZINC000785613979 1133732079 /nfs/dbraw/zinc/73/20/79/1133732079.db2.gz HETPOORVALOCJO-AWEZNQCLSA-N 1 1 348.176 3.800 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@@H](C(F)F)CC2)c(O)c(C(C)(C)C)c1 ZINC001183281930 1133783660 /nfs/dbraw/zinc/78/36/60/1133783660.db2.gz OLRICFJEWQMZJT-OAHLLOKOSA-N 1 1 343.414 3.554 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@@H]1CCSC1 ZINC000787200140 1133975099 /nfs/dbraw/zinc/97/50/99/1133975099.db2.gz BOUOKSLCKKOSPC-NSHDSACASA-N 1 1 330.291 3.730 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000746720249 1134061212 /nfs/dbraw/zinc/06/12/12/1134061212.db2.gz DSQRSGADWKPCPJ-GOSISDBHSA-N 1 1 330.497 3.995 20 10 EHCDMO Cc1cc(C)n(CCC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)n1 ZINC000788502662 1134133786 /nfs/dbraw/zinc/13/37/86/1134133786.db2.gz IXGCQIIKSGKTSO-ZDUSSCGKSA-N 1 1 341.377 3.965 20 10 EHCDMO CC(C)[C@@H](O)C1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000788695004 1134164032 /nfs/dbraw/zinc/16/40/32/1134164032.db2.gz YODXJPNFUIHMRY-XHDPSFHLSA-N 1 1 331.378 3.859 20 10 EHCDMO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000788798681 1134170375 /nfs/dbraw/zinc/17/03/75/1134170375.db2.gz AONYHRUMAGNYJM-UTUOFQBUSA-N 1 1 345.361 3.793 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2cc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000775050299 1134254427 /nfs/dbraw/zinc/25/44/27/1134254427.db2.gz GCGIXAVUZIOVMA-UHFFFAOYSA-N 1 1 344.392 3.814 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)cc1F ZINC000789767891 1134329527 /nfs/dbraw/zinc/32/95/27/1134329527.db2.gz BYZIMXVRBXNULK-GOSISDBHSA-N 1 1 343.446 3.720 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000790715706 1134456723 /nfs/dbraw/zinc/45/67/23/1134456723.db2.gz SDURYTNFFYNZQY-ZBFHGGJFSA-N 1 1 347.455 3.711 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc(F)cc1 ZINC000790948429 1134483976 /nfs/dbraw/zinc/48/39/76/1134483976.db2.gz IFJRQRDGRIPIIQ-OAHLLOKOSA-N 1 1 340.801 3.716 20 10 EHCDMO CC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1c(C)nn(C)c1C ZINC000790970544 1134487989 /nfs/dbraw/zinc/48/79/89/1134487989.db2.gz KAKDQPMMQYTFCQ-CYBMUJFWSA-N 1 1 325.815 3.776 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@H](c1ccccc1)N(C)C ZINC000790992451 1134489489 /nfs/dbraw/zinc/48/94/89/1134489489.db2.gz ZUQXLEQGZWRKEP-KZULUSFZSA-N 1 1 336.838 3.966 20 10 EHCDMO COCC[C@H](Cc1ccco1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790986642 1134496228 /nfs/dbraw/zinc/49/62/28/1134496228.db2.gz ROZHUPDWPNWTDX-LLVKDONJSA-N 1 1 327.783 3.515 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@H](c3ccc(CC)cc3)C2)c1O ZINC000792190559 1134666088 /nfs/dbraw/zinc/66/60/88/1134666088.db2.gz TUANRDCYHLFUNM-FQEVSTJZSA-N 1 1 341.451 3.927 20 10 EHCDMO COCC[N@H+](Cc1cccc(Br)c1O)[C@@H]1CC[C@@H](C)C1 ZINC000792192379 1134666430 /nfs/dbraw/zinc/66/64/30/1134666430.db2.gz JHLWXAOHYKBOEQ-TZMCWYRMSA-N 1 1 342.277 3.792 20 10 EHCDMO COCC[N@@H+](Cc1cccc(Br)c1O)[C@@H]1CC[C@@H](C)C1 ZINC000792192379 1134666431 /nfs/dbraw/zinc/66/64/31/1134666431.db2.gz JHLWXAOHYKBOEQ-TZMCWYRMSA-N 1 1 342.277 3.792 20 10 EHCDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792793440 1134789797 /nfs/dbraw/zinc/78/97/97/1134789797.db2.gz VHHKJCRAPMAUAT-UHFFFAOYSA-N 1 1 340.393 3.527 20 10 EHCDMO CC[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775499523 1134961984 /nfs/dbraw/zinc/96/19/84/1134961984.db2.gz IPGVJRBKNNDLKN-ZDUSSCGKSA-N 1 1 328.243 3.945 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1O ZINC000793617911 1134974264 /nfs/dbraw/zinc/97/42/64/1134974264.db2.gz XXTWSXIAMSUXNA-HIFRSBDPSA-N 1 1 330.255 3.807 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)c1O ZINC000793734319 1134986527 /nfs/dbraw/zinc/98/65/27/1134986527.db2.gz VNDSLLUNLYKJDC-HNNXBMFYSA-N 1 1 344.430 3.559 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1O ZINC000806174477 1135398834 /nfs/dbraw/zinc/39/88/34/1135398834.db2.gz JGEGSBWIQRYWOD-QLJPJBMISA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c1O ZINC000775696755 1135532531 /nfs/dbraw/zinc/53/25/31/1135532531.db2.gz NVNSHXNKPAUHTD-GOSISDBHSA-N 1 1 331.843 3.836 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1O ZINC000775740348 1135598901 /nfs/dbraw/zinc/59/89/01/1135598901.db2.gz VGXGBWKSPJOHQP-KBXCAEBGSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1O ZINC000775740348 1135598905 /nfs/dbraw/zinc/59/89/05/1135598905.db2.gz VGXGBWKSPJOHQP-KBXCAEBGSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1O ZINC000775740348 1135598907 /nfs/dbraw/zinc/59/89/07/1135598907.db2.gz VGXGBWKSPJOHQP-KBXCAEBGSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1O ZINC000775740348 1135598910 /nfs/dbraw/zinc/59/89/10/1135598910.db2.gz VGXGBWKSPJOHQP-KBXCAEBGSA-N 1 1 334.891 3.803 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000808239595 1135640212 /nfs/dbraw/zinc/64/02/12/1135640212.db2.gz XMSWVBDLWFWCRZ-UHFFFAOYSA-N 1 1 333.387 3.919 20 10 EHCDMO CCCC[N@@H+](Cc1cnnn1-c1ccccc1)Cc1ccccc1O ZINC000808757351 1135728366 /nfs/dbraw/zinc/72/83/66/1135728366.db2.gz JTKKKYIAJLAQQO-UHFFFAOYSA-N 1 1 336.439 3.775 20 10 EHCDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4ccc(N5CCCCC5)cc4)[C@H]1[C@H]3C2 ZINC000809697594 1135867927 /nfs/dbraw/zinc/86/79/27/1135867927.db2.gz JSUQHLNUGDXYKA-JZTRKIHISA-N 1 1 326.484 3.532 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000809715372 1135876888 /nfs/dbraw/zinc/87/68/88/1135876888.db2.gz IDNKPNKENSYQSG-SUMWQHHRSA-N 1 1 342.395 3.892 20 10 EHCDMO Cn1ccnc1[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809757512 1135887206 /nfs/dbraw/zinc/88/72/06/1135887206.db2.gz PCTCYOWBNFYJSJ-SFHVURJKSA-N 1 1 333.435 3.782 20 10 EHCDMO O=C(NC1CCCCC1)OC[C@H]1CCCC[N@@H+]1Cc1ccccc1O ZINC000809780328 1135890253 /nfs/dbraw/zinc/89/02/53/1135890253.db2.gz USNOJSQUIMLITA-GOSISDBHSA-N 1 1 346.471 3.806 20 10 EHCDMO C[C@H]1C[C@H](C)C[NH+](CCCNCc2ccc(N3CCCC3)cc2)C1 ZINC001199329513 1135897948 /nfs/dbraw/zinc/89/79/48/1135897948.db2.gz USVZWFBYXHNNKS-OALUTQOASA-N 1 1 329.532 3.744 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000776012570 1135919716 /nfs/dbraw/zinc/91/97/16/1135919716.db2.gz HQUDLTAWDZENQT-RHSMWYFYSA-N 1 1 342.405 3.686 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](n3cc(Cl)cn3)C1)CCCC2 ZINC000811801502 1136138410 /nfs/dbraw/zinc/13/84/10/1136138410.db2.gz NBTHICCPEHRBFJ-QGZVFWFLSA-N 1 1 331.847 3.568 20 10 EHCDMO CCOc1ccc(CNc2[nH+]cccc2CCCCOC)c(O)c1 ZINC000812345766 1136200550 /nfs/dbraw/zinc/20/05/50/1136200550.db2.gz NCTPSELSTSMWKN-UHFFFAOYSA-N 1 1 330.428 3.767 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@](CO)(Cc3ccccc3)C2)cc1C ZINC000812780171 1136246793 /nfs/dbraw/zinc/24/67/93/1136246793.db2.gz UZPYWNNDYRWOHU-QFIPXVFZSA-N 1 1 339.479 3.826 20 10 EHCDMO C[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cccc(C(F)(F)F)c1O ZINC000850533922 1136281195 /nfs/dbraw/zinc/28/11/95/1136281195.db2.gz DHMQGOOUYKBAAT-JTQLQIEISA-N 1 1 339.361 3.873 20 10 EHCDMO C[N@H+](Cc1nn(-c2ccccc2)c2c1CCC2)Cc1ccccc1O ZINC000109773855 1136339796 /nfs/dbraw/zinc/33/97/96/1136339796.db2.gz ANDVAMUTEDPMKP-UHFFFAOYSA-N 1 1 333.435 3.699 20 10 EHCDMO C[N@@H+](Cc1nn(-c2ccccc2)c2c1CCC2)Cc1ccccc1O ZINC000109773855 1136339799 /nfs/dbraw/zinc/33/97/99/1136339799.db2.gz ANDVAMUTEDPMKP-UHFFFAOYSA-N 1 1 333.435 3.699 20 10 EHCDMO Cc1ccoc1C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000813791069 1136363075 /nfs/dbraw/zinc/36/30/75/1136363075.db2.gz QLCSYNSXYXRRIK-UHFFFAOYSA-N 1 1 329.400 3.776 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)c1O ZINC000814178335 1136412169 /nfs/dbraw/zinc/41/21/69/1136412169.db2.gz MMIANDIHZHSAKU-HNNXBMFYSA-N 1 1 344.430 3.641 20 10 EHCDMO CCN(C)c1ccc([C@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239248 1136521024 /nfs/dbraw/zinc/52/10/24/1136521024.db2.gz CVASQHFETAXGTJ-PKOBYXMFSA-N 1 1 329.532 3.915 20 10 EHCDMO CCN(C)c1ccc([C@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000853239248 1136521025 /nfs/dbraw/zinc/52/10/25/1136521025.db2.gz CVASQHFETAXGTJ-PKOBYXMFSA-N 1 1 329.532 3.915 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c1O ZINC000853552218 1136544165 /nfs/dbraw/zinc/54/41/65/1136544165.db2.gz YZDAYPLBBJXGQC-IBGZPJMESA-N 1 1 343.423 3.656 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)C[C@@H]2CCc3ccccc32)cc1OC ZINC000853609793 1136548799 /nfs/dbraw/zinc/54/87/99/1136548799.db2.gz MVMVURRNKCUEJB-HNNXBMFYSA-N 1 1 327.424 3.571 20 10 EHCDMO COc1ccc(N2CC[C@H](Nc3[nH+]ccc4c(N)cccc43)C2)cc1 ZINC000853760151 1136561128 /nfs/dbraw/zinc/56/11/28/1136561128.db2.gz IROMETDHKPMRFE-AWEZNQCLSA-N 1 1 334.423 3.516 20 10 EHCDMO O=C1C[C@@H](c2ccccc2)[N@@H+](Cc2ccc3ccccc3c2O)CCN1 ZINC000816493627 1136724637 /nfs/dbraw/zinc/72/46/37/1136724637.db2.gz IMNCOCYKKNOUQB-FQEVSTJZSA-N 1 1 346.430 3.609 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000816520319 1136727165 /nfs/dbraw/zinc/72/71/65/1136727165.db2.gz LZWCVSOCZMHZPD-BLLLJJGKSA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000816520319 1136727167 /nfs/dbraw/zinc/72/71/67/1136727167.db2.gz LZWCVSOCZMHZPD-BLLLJJGKSA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](O)c1ccc(Cl)c(F)c1 ZINC000816559884 1136736596 /nfs/dbraw/zinc/73/65/96/1136736596.db2.gz YDUVJKGIAXABOL-HNNXBMFYSA-N 1 1 348.176 3.800 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@]2(CCO[C@H](C)C2)O1 ZINC000816598217 1136739974 /nfs/dbraw/zinc/73/99/74/1136739974.db2.gz SZLZLODJKUYLCJ-WHSLLNHNSA-N 1 1 341.451 3.704 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)c1 ZINC000816659236 1136745662 /nfs/dbraw/zinc/74/56/62/1136745662.db2.gz GFESCVOQOHRUNR-KRWDZBQOSA-N 1 1 333.815 3.708 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000816659602 1136746126 /nfs/dbraw/zinc/74/61/26/1136746126.db2.gz UFWALLXMFJHJNR-HNNXBMFYSA-N 1 1 333.815 3.708 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2F)n1)c1ccc(N(C)C)cc1 ZINC000776885321 1136783051 /nfs/dbraw/zinc/78/30/51/1136783051.db2.gz XZPXHMNPFQZBKL-OAHLLOKOSA-N 1 1 338.430 3.928 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cncc(Cl)c1)C[C@H]1CCCO1 ZINC000856730482 1136804253 /nfs/dbraw/zinc/80/42/53/1136804253.db2.gz CYYLKCPOIDPQKW-QGZVFWFLSA-N 1 1 332.831 3.622 20 10 EHCDMO CCOc1ccccc1[C@@H](C)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000817938594 1136847255 /nfs/dbraw/zinc/84/72/55/1136847255.db2.gz OABPWQKOFVCOOZ-BEFAXECRSA-N 1 1 327.472 3.502 20 10 EHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938544 1136847763 /nfs/dbraw/zinc/84/77/63/1136847763.db2.gz MSMPIOMKHXLAIG-UXHICEINSA-N 1 1 327.472 3.502 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817944378 1136849119 /nfs/dbraw/zinc/84/91/19/1136849119.db2.gz ZZNYHCXFQOTMQK-OALUTQOASA-N 1 1 329.875 3.683 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(=O)OC)s2)cc1 ZINC000818357695 1136875477 /nfs/dbraw/zinc/87/54/77/1136875477.db2.gz HWIRLOSUYVELHZ-OLZOCXBDSA-N 1 1 347.484 3.798 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000818357106 1136875531 /nfs/dbraw/zinc/87/55/31/1136875531.db2.gz VPLHUDZFASIJQR-DTWKUNHWSA-N 1 1 340.832 3.701 20 10 EHCDMO CCC(C)(C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000857758601 1136905711 /nfs/dbraw/zinc/90/57/11/1136905711.db2.gz MRAFXEHBARXWPO-KRWDZBQOSA-N 1 1 345.531 3.802 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)c1cc(Cl)c(Cl)cc1O ZINC000858603082 1136982022 /nfs/dbraw/zinc/98/20/22/1136982022.db2.gz QRJYMYOSMHSPCT-XPTSAGLGSA-N 1 1 343.254 3.503 20 10 EHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cs1 ZINC000772855837 1137045812 /nfs/dbraw/zinc/04/58/12/1137045812.db2.gz BRPSKGBNZOVMRL-ZDUSSCGKSA-N 1 1 333.526 3.856 20 10 EHCDMO COc1cc(F)cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000823386714 1137097501 /nfs/dbraw/zinc/09/75/01/1137097501.db2.gz KSDVHNDLHDQRJE-GOSISDBHSA-N 1 1 345.414 3.721 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@@](C)(O)c2ccccc2)c1O ZINC000823591979 1137107574 /nfs/dbraw/zinc/10/75/74/1137107574.db2.gz OIOQZABAQHKCES-LJQANCHMSA-N 1 1 347.842 3.588 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+]Cc3csc(C)c3)cc2F)CC1 ZINC000823802294 1137115241 /nfs/dbraw/zinc/11/52/41/1137115241.db2.gz YHXBGNHGFMQLDM-UHFFFAOYSA-N 1 1 347.503 3.627 20 10 EHCDMO COCc1csc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000824506988 1137142377 /nfs/dbraw/zinc/14/23/77/1137142377.db2.gz CPIMUBOBIGYVDL-KRWDZBQOSA-N 1 1 347.480 3.781 20 10 EHCDMO C[C@H]1CC2(C[N@H+]1Cc1c(O)cccc1Br)CCOCC2 ZINC000862400213 1137142799 /nfs/dbraw/zinc/14/27/99/1137142799.db2.gz PYFSHVNKQCMGCM-LBPRGKRZSA-N 1 1 340.261 3.546 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1 ZINC000862527687 1137147959 /nfs/dbraw/zinc/14/79/59/1137147959.db2.gz RZZLVDRKURDCCD-JXALWOEJSA-N 1 1 348.556 3.798 20 10 EHCDMO CS[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000824683618 1137148142 /nfs/dbraw/zinc/14/81/42/1137148142.db2.gz SMTLACLMVWXBPB-GOSISDBHSA-N 1 1 329.465 3.909 20 10 EHCDMO Cc1ncsc1CC[NH2+]Cc1cc(C)cc(Br)c1O ZINC000824737815 1137149201 /nfs/dbraw/zinc/14/92/01/1137149201.db2.gz FDWZUZNRSWTEHM-UHFFFAOYSA-N 1 1 341.274 3.560 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@@H]1C ZINC000824815695 1137153647 /nfs/dbraw/zinc/15/36/47/1137153647.db2.gz WYSJJCDQRHAGSZ-KKSFZXQISA-N 1 1 341.451 3.828 20 10 EHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000824863439 1137155000 /nfs/dbraw/zinc/15/50/00/1137155000.db2.gz QPVKFEQHFZSSOC-GDBMZVCRSA-N 1 1 334.504 3.613 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c(O)c1 ZINC000824893012 1137155965 /nfs/dbraw/zinc/15/59/65/1137155965.db2.gz INISQJYQVIUKED-MSOLQXFVSA-N 1 1 331.456 3.572 20 10 EHCDMO COC[C@H]1CCC[N@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000825321511 1137172941 /nfs/dbraw/zinc/17/29/41/1137172941.db2.gz FZVQAJZRERSOGF-ZDUSSCGKSA-N 1 1 342.277 3.712 20 10 EHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000825321511 1137172942 /nfs/dbraw/zinc/17/29/42/1137172942.db2.gz FZVQAJZRERSOGF-ZDUSSCGKSA-N 1 1 342.277 3.712 20 10 EHCDMO CC(C)(C)c1ncc2c(n1)CC[N@H+](Cc1c(O)ccc3ccncc31)C2 ZINC000863279121 1137179537 /nfs/dbraw/zinc/17/95/37/1137179537.db2.gz WPHKNPSTDKUJTH-UHFFFAOYSA-N 1 1 348.450 3.586 20 10 EHCDMO COc1ccc2c(c1)c1c(n2C)CCN(Cc2ccc3nc[nH]c3c2)C1 ZINC001137046479 1137180709 /nfs/dbraw/zinc/18/07/09/1137180709.db2.gz DMJDXJGFBZYHII-UHFFFAOYSA-N 1 1 346.434 3.622 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000825484434 1137181223 /nfs/dbraw/zinc/18/12/23/1137181223.db2.gz LQKMDGJHCCOQEE-CQSZACIVSA-N 1 1 347.256 3.614 20 10 EHCDMO C[C@@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccoc1 ZINC000773146141 1137469864 /nfs/dbraw/zinc/46/98/64/1137469864.db2.gz ORRKTBDBICVBII-QGZVFWFLSA-N 1 1 339.483 3.662 20 10 EHCDMO Oc1c(C[NH2+][C@@H]2Cc3cccc(F)c3C2)cc(Cl)c2cccnc12 ZINC001171777611 1137510304 /nfs/dbraw/zinc/51/03/04/1137510304.db2.gz QXIPCELKNFYRJF-CYBMUJFWSA-N 1 1 342.801 3.990 20 10 EHCDMO CC[C@@H](C)OCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172340723 1137552499 /nfs/dbraw/zinc/55/24/99/1137552499.db2.gz KVSJAVSMKQAPBX-QZTJIDSGSA-N 1 1 334.504 3.549 20 10 EHCDMO CCOc1ccc(O)c(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC000873176003 1137592487 /nfs/dbraw/zinc/59/24/87/1137592487.db2.gz ZVYREBCSOPLJDS-UHFFFAOYSA-N 1 1 330.428 3.584 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)Cc2ccccc21 ZINC000876544840 1137654970 /nfs/dbraw/zinc/65/49/70/1137654970.db2.gz YTZPSEBAEJCZTK-QGZVFWFLSA-N 1 1 336.479 3.767 20 10 EHCDMO OC1CCN(c2ccc(C[N@@H+](Cc3cccs3)C3CC3)cc2)CC1 ZINC000876571304 1137655830 /nfs/dbraw/zinc/65/58/30/1137655830.db2.gz ITZGSFBRXFISLX-UHFFFAOYSA-N 1 1 342.508 3.874 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCCC4(CCCC4)C3)cc2)CC1 ZINC000877462361 1137677093 /nfs/dbraw/zinc/67/70/93/1137677093.db2.gz OEPABWKIOWPLGD-UHFFFAOYSA-N 1 1 328.500 3.804 20 10 EHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000877478163 1137677537 /nfs/dbraw/zinc/67/75/37/1137677537.db2.gz CPHLUEGKFDUSFE-UHFFFAOYSA-N 1 1 342.458 3.727 20 10 EHCDMO CC(C)(C)OC(=O)N=c1[nH]cc(C[N@@H+]2Cc3cccc(O)c3C2)s1 ZINC000877703214 1137686399 /nfs/dbraw/zinc/68/63/99/1137686399.db2.gz WJYPXNQGQPSKKJ-UHFFFAOYSA-N 1 1 347.440 3.712 20 10 EHCDMO CC(C)(C)OC(=O)N=c1[nH]cc(C[N@H+]2Cc3cccc(O)c3C2)s1 ZINC000877703214 1137686400 /nfs/dbraw/zinc/68/64/00/1137686400.db2.gz WJYPXNQGQPSKKJ-UHFFFAOYSA-N 1 1 347.440 3.712 20 10 EHCDMO OC1CCN(c2ccc(C[NH2+][C@@H](CF)c3ccc(F)cc3)cc2)CC1 ZINC000877759237 1137688498 /nfs/dbraw/zinc/68/84/98/1137688498.db2.gz ZRHMMGQPOMLEDN-FQEVSTJZSA-N 1 1 346.421 3.587 20 10 EHCDMO C[N@@H+](CC[C@H]1CCCC1(F)F)Cc1ccc(N2CCOCC2)cc1 ZINC000877923230 1137695877 /nfs/dbraw/zinc/69/58/77/1137695877.db2.gz LWDORZPIJHBCDN-QGZVFWFLSA-N 1 1 338.442 3.781 20 10 EHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(C(=O)OC)co1 ZINC000878565294 1137720422 /nfs/dbraw/zinc/72/04/22/1137720422.db2.gz IODINMPDOCQXAY-CYBMUJFWSA-N 1 1 332.400 3.530 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c(C)n1 ZINC000187243763 1137839416 /nfs/dbraw/zinc/83/94/16/1137839416.db2.gz OIEJOEGLRUHOAD-IBGZPJMESA-N 1 1 326.440 3.585 20 10 EHCDMO COCCC[C@H](Cc1ccccc1)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883106999 1137844819 /nfs/dbraw/zinc/84/48/19/1137844819.db2.gz LATRDQVCIGVWHW-QGZVFWFLSA-N 1 1 335.394 3.798 20 10 EHCDMO Cc1ncc([C@H](C)[NH2+]Cc2cc(Br)cc(F)c2O)s1 ZINC000883193751 1137848125 /nfs/dbraw/zinc/84/81/25/1137848125.db2.gz DKRDFRIOWAGABP-ZETCQYMHSA-N 1 1 345.237 3.910 20 10 EHCDMO CSc1cccc(NC(=O)[C@H](C)[N@@H+](C)Cc2ccccc2O)c1 ZINC000109773134 1137897478 /nfs/dbraw/zinc/89/74/78/1137897478.db2.gz NUPIQARXAOYYQD-ZDUSSCGKSA-N 1 1 330.453 3.573 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000884483257 1137961041 /nfs/dbraw/zinc/96/10/41/1137961041.db2.gz QLQHNYHTVPBXHW-KDOFPFPSSA-N 1 1 333.472 3.699 20 10 EHCDMO CCOCCOCc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886503704 1138085364 /nfs/dbraw/zinc/08/53/64/1138085364.db2.gz AIVBTOVAWSYTIC-OAHLLOKOSA-N 1 1 347.430 3.935 20 10 EHCDMO CCCCNC(=O)c1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886514596 1138087886 /nfs/dbraw/zinc/08/78/86/1138087886.db2.gz UCXMXZBKOOUUIC-AWEZNQCLSA-N 1 1 344.430 3.912 20 10 EHCDMO COc1ccc(OC(F)F)c(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886538773 1138093072 /nfs/dbraw/zinc/09/30/72/1138093072.db2.gz NRQDONUBTOBFRJ-SNVBAGLBSA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(C(F)(F)F)cc1)c1c(O)cccc1F ZINC000886608924 1138101248 /nfs/dbraw/zinc/10/12/48/1138101248.db2.gz IDOUQTDWNAWPEJ-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3nc(C)no3)C2)cc1 ZINC000091833316 1138222208 /nfs/dbraw/zinc/22/22/08/1138222208.db2.gz IWVUXYLKPKWVTB-KRWDZBQOSA-N 1 1 328.460 3.604 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)c(OC)cc1O ZINC000179929324 1139793658 /nfs/dbraw/zinc/79/36/58/1139793658.db2.gz ZZRQVBVKUNNMQJ-UHFFFAOYSA-N 1 1 331.412 3.527 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000179937151 1139794262 /nfs/dbraw/zinc/79/42/62/1139794262.db2.gz YVJAZHZCCSDKBF-HNNXBMFYSA-N 1 1 347.480 3.769 20 10 EHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000184691664 1140115083 /nfs/dbraw/zinc/11/50/83/1140115083.db2.gz UVFLPIVXVPPYJF-OAHLLOKOSA-N 1 1 327.852 3.835 20 10 EHCDMO CCCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185048383 1140133137 /nfs/dbraw/zinc/13/31/37/1140133137.db2.gz BIQNHLIMEYEJQV-CYBMUJFWSA-N 1 1 330.403 3.522 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(N2CCOC2=O)cc1 ZINC000185160327 1140138275 /nfs/dbraw/zinc/13/82/75/1140138275.db2.gz DBGBCAZWHLAUAA-OLZOCXBDSA-N 1 1 344.386 3.900 20 10 EHCDMO COCCCN1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000185314499 1140144463 /nfs/dbraw/zinc/14/44/63/1140144463.db2.gz KHAFGLUVTBNAHV-INIZCTEOSA-N 1 1 342.483 3.697 20 10 EHCDMO COC(=O)CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185999085 1140181276 /nfs/dbraw/zinc/18/12/76/1140181276.db2.gz JAHSYKQTCJGOFB-SUMWQHHRSA-N 1 1 331.387 3.876 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000192657861 1140542166 /nfs/dbraw/zinc/54/21/66/1140542166.db2.gz NPXQGWNRBWELKJ-QWRGUYRKSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@H](CO[C@H]1CCOC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192943247 1140556610 /nfs/dbraw/zinc/55/66/10/1140556610.db2.gz RYOLBUFGXKQNOZ-VWYCJHECSA-N 1 1 334.243 3.544 20 10 EHCDMO CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000193102764 1140564315 /nfs/dbraw/zinc/56/43/15/1140564315.db2.gz WFCHHWJNXYEYPY-SECBINFHSA-N 1 1 333.259 3.512 20 10 EHCDMO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)[nH]1 ZINC000271543425 1141393920 /nfs/dbraw/zinc/39/39/20/1141393920.db2.gz RDANAQPIIGXKDR-ZIAGYGMSSA-N 1 1 345.466 3.908 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(-c2nn[nH]n2)cc1)C1CCCC1 ZINC000738400132 598621124 /nfs/dbraw/zinc/62/11/24/598621124.db2.gz DDHBPUVLGGBAQD-UHFFFAOYSA-N 1 1 349.438 3.517 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000377683764 1018184778 /nfs/dbraw/zinc/18/47/78/1018184778.db2.gz TULRPQXJLXEVAN-KRWDZBQOSA-N 1 1 334.423 3.557 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841889011 1032875485 /nfs/dbraw/zinc/87/54/85/1032875485.db2.gz XILRRLUOEXXKMX-UHFFFAOYSA-N 1 1 340.261 3.688 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)c(C(F)(F)F)c1 ZINC000280268427 1020236866 /nfs/dbraw/zinc/23/68/66/1020236866.db2.gz LTFFTILMESMDGI-HNNXBMFYSA-N 1 1 338.377 3.662 20 10 EHCDMO C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)cc1[O-] ZINC000834910731 1021128621 /nfs/dbraw/zinc/12/86/21/1021128621.db2.gz YSMIRBZTBUAOLO-LBPRGKRZSA-N 1 1 341.293 3.680 20 10 EHCDMO C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)cc1[O-] ZINC000834910731 1021128625 /nfs/dbraw/zinc/12/86/25/1021128625.db2.gz YSMIRBZTBUAOLO-LBPRGKRZSA-N 1 1 341.293 3.680 20 10 EHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(C)cc(OC)c2O)o1 ZINC000894475223 1022363921 /nfs/dbraw/zinc/36/39/21/1022363921.db2.gz MFDXYBVYNPMZEE-MRXNPFEDSA-N 1 1 331.412 3.786 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000894746676 1022827346 /nfs/dbraw/zinc/82/73/46/1022827346.db2.gz AVXIRGLKSGKDEC-AOIWGVFYSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000894746676 1022827361 /nfs/dbraw/zinc/82/73/61/1022827361.db2.gz AVXIRGLKSGKDEC-AOIWGVFYSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000894746676 1022827371 /nfs/dbraw/zinc/82/73/71/1022827371.db2.gz AVXIRGLKSGKDEC-AOIWGVFYSA-N 1 1 345.389 3.675 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@H](CNC(C)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000067382691 1023005138 /nfs/dbraw/zinc/00/51/38/1023005138.db2.gz XNQNGZNOJDHPAS-QGZVFWFLSA-N 1 1 346.515 3.600 20 10 EHCDMO c1ccc(-n2nc(C[NH2+]Cc3ccc4c(c3)CCO4)c3c2CCC3)cc1 ZINC000054176064 1023289084 /nfs/dbraw/zinc/28/90/84/1023289084.db2.gz BJGOTTRWLYLBPJ-UHFFFAOYSA-N 1 1 345.446 3.586 20 10 EHCDMO COc1cccc(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)c1O ZINC000276981188 1023557208 /nfs/dbraw/zinc/55/72/08/1023557208.db2.gz FMIXVKAJNDPRDG-UHFFFAOYSA-N 1 1 345.414 3.721 20 10 EHCDMO C[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)Cc1ccccc1[N+](=O)[O-] ZINC000046477471 1033163155 /nfs/dbraw/zinc/16/31/55/1033163155.db2.gz MDXPWIVYLUEXEE-UHFFFAOYSA-N 1 1 344.411 3.936 20 10 EHCDMO C[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)Cc1ccccc1[N+](=O)[O-] ZINC000046477471 1033163162 /nfs/dbraw/zinc/16/31/62/1033163162.db2.gz MDXPWIVYLUEXEE-UHFFFAOYSA-N 1 1 344.411 3.936 20 10 EHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc(OC)c(OC)c2O)C1 ZINC000892027117 1024391130 /nfs/dbraw/zinc/39/11/30/1024391130.db2.gz CSLYMTSVFBNVDT-CQSZACIVSA-N 1 1 325.474 3.517 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1(c2ccc3c(c2)OCCO3)CC1 ZINC000897862173 1033212132 /nfs/dbraw/zinc/21/21/32/1033212132.db2.gz AGTPWDNNEBPJGU-UHFFFAOYSA-N 1 1 349.789 3.735 20 10 EHCDMO CCN(C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2)C(C)C ZINC000435548907 1024994076 /nfs/dbraw/zinc/99/40/76/1024994076.db2.gz HPKVARUENDWBQE-UHFFFAOYSA-N 1 1 341.499 3.665 20 10 EHCDMO [O-]c1cccc(F)c1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000896644658 1025779034 /nfs/dbraw/zinc/77/90/34/1025779034.db2.gz YPKCVLWDVVZOMJ-BZSNNMDCSA-N 1 1 340.442 3.674 20 10 EHCDMO O=C1C[C@H](c2ccccc2)[N@@H+](Cc2c(O)ccc3ccccc32)CCN1 ZINC000122030952 1026159356 /nfs/dbraw/zinc/15/93/56/1026159356.db2.gz XMBZLGDZDNCQPM-HXUWFJFHSA-N 1 1 346.430 3.609 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1ccc(F)cc1F ZINC000174371935 1033910466 /nfs/dbraw/zinc/91/04/66/1033910466.db2.gz BYSLZLUGTCSGQJ-CYBMUJFWSA-N 1 1 348.393 3.910 20 10 EHCDMO CN(Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1O ZINC000174451728 1033940860 /nfs/dbraw/zinc/94/08/60/1033940860.db2.gz OCGFCDHHCHCMAF-UHFFFAOYSA-N 1 1 336.435 3.907 20 10 EHCDMO C[C@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1ccc(F)cc1O ZINC000310051186 1034203471 /nfs/dbraw/zinc/20/34/71/1034203471.db2.gz GUJFWMDZLIYJKO-LBPRGKRZSA-N 1 1 338.423 3.581 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000186113595 1035584966 /nfs/dbraw/zinc/58/49/66/1035584966.db2.gz ATNMATIGVHYOAU-CHWSQXEVSA-N 1 1 326.375 3.524 20 10 EHCDMO C[N@H+](Cc1ccc(I)cc1O)CC1CCCC1 ZINC001232980350 1035625173 /nfs/dbraw/zinc/62/51/73/1035625173.db2.gz QKYSJIBQYHKNFO-UHFFFAOYSA-N 1 1 345.224 3.619 20 10 EHCDMO C[N@H+](Cc1cc(O)c(O)cc1O)Cc1cccc(Cl)c1Cl ZINC001233486058 1037712783 /nfs/dbraw/zinc/71/27/83/1037712783.db2.gz WPILQNFPIBFMNF-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO C[N@@H+](Cc1cc(O)c(O)cc1O)Cc1cccc(Cl)c1Cl ZINC001233486058 1037712801 /nfs/dbraw/zinc/71/28/01/1037712801.db2.gz WPILQNFPIBFMNF-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO Cc1noc(C)c1C[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000756457910 1038824800 /nfs/dbraw/zinc/82/48/00/1038824800.db2.gz HYTRJAICEMERTL-SSDOTTSWSA-N 1 1 343.196 3.749 20 10 EHCDMO CCC[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@@H]21)Cc1ccccc1O ZINC000728927195 1039503757 /nfs/dbraw/zinc/50/37/57/1039503757.db2.gz MAZJKAONMUWZFJ-HKUYNNGSSA-N 1 1 344.499 3.785 20 10 EHCDMO CCC[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccccc1O ZINC000728927196 1039504568 /nfs/dbraw/zinc/50/45/68/1039504568.db2.gz MAZJKAONMUWZFJ-IEBWSBKVSA-N 1 1 344.499 3.785 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC([C@@H](O)c2ccccc2)CC1 ZINC000893918191 1039824787 /nfs/dbraw/zinc/82/47/87/1039824787.db2.gz IEYNXJMYEHVQOU-SFHVURJKSA-N 1 1 333.378 3.616 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(F)cc1O ZINC000310090610 1041308323 /nfs/dbraw/zinc/30/83/23/1041308323.db2.gz QSYCTGNHKPXGET-YZVOILCLSA-N 1 1 328.431 3.845 20 10 EHCDMO Cc1ccc([C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)N2CCCC2)o1 ZINC000185297943 1126857446 /nfs/dbraw/zinc/85/74/46/1126857446.db2.gz WGVUKILOUFRYPV-YOEHRIQHSA-N 1 1 332.419 3.920 20 10 EHCDMO C[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccccc1C(F)(F)F ZINC000171936517 1127632855 /nfs/dbraw/zinc/63/28/55/1127632855.db2.gz VJZUZBWAURQOFL-MRXNPFEDSA-N 1 1 325.330 3.576 20 10 EHCDMO C[C@@H]1CCC[C@@](CNC/C=C/c2ccc(N(C)C)cc2)([NH+](C)C)C1 ZINC001648895158 1120062481 /nfs/dbraw/zinc/06/24/81/1120062481.db2.gz DSAPRAZBNGQMCI-GYBSMXBJSA-N 1 1 329.532 3.866 20 10 EHCDMO C[C@@H]1CCC[C@@](CNC/C=C\c2ccc(N(C)C)cc2)([NH+](C)C)C1 ZINC001648895159 1120062757 /nfs/dbraw/zinc/06/27/57/1120062757.db2.gz DSAPRAZBNGQMCI-TXJPBUDTSA-N 1 1 329.532 3.866 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)CN2C[C@H](C)C[C@@H](C)C2)cc1 ZINC001648903186 1120064406 /nfs/dbraw/zinc/06/44/06/1120064406.db2.gz JFKZQMZWBNHALN-GUDVDZBRSA-N 1 1 331.548 3.989 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]4OCCC[C@@H]4C3)c2c1 ZINC000129159605 1120142225 /nfs/dbraw/zinc/14/22/25/1120142225.db2.gz AGZCBVWEZFWRJR-QRWLVFNGSA-N 1 1 327.424 3.555 20 10 EHCDMO Cc1ccc[nH+]c1NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000916838828 1122365021 /nfs/dbraw/zinc/36/50/21/1122365021.db2.gz FWORTYICYNNYNZ-UHFFFAOYSA-N 1 1 326.400 3.901 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccccc1F ZINC000917014465 1122438457 /nfs/dbraw/zinc/43/84/57/1122438457.db2.gz UMJDTLMKVLOKDC-HXUWFJFHSA-N 1 1 330.447 3.836 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1COc2ccccc2O1 ZINC000917074650 1122471399 /nfs/dbraw/zinc/47/13/99/1122471399.db2.gz FIXWVUYBMINOAO-LJQANCHMSA-N 1 1 340.467 3.803 20 10 EHCDMO C[N@H+](Cc1cnn(-c2ccccc2)n1)Cc1c(O)ccc2ccccc21 ZINC000917453747 1122611169 /nfs/dbraw/zinc/61/11/69/1122611169.db2.gz NIPVHKXSMKDLNV-UHFFFAOYSA-N 1 1 344.418 3.758 20 10 EHCDMO C[N@@H+](Cc1cnn(-c2ccccc2)n1)Cc1c(O)ccc2ccccc21 ZINC000917453747 1122611173 /nfs/dbraw/zinc/61/11/73/1122611173.db2.gz NIPVHKXSMKDLNV-UHFFFAOYSA-N 1 1 344.418 3.758 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000922586890 1129585255 /nfs/dbraw/zinc/58/52/55/1129585255.db2.gz SVRNOYPZRPAADK-HNNXBMFYSA-N 1 1 333.229 3.791 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC000186952646 1129936510 /nfs/dbraw/zinc/93/65/10/1129936510.db2.gz QLBJZRFAAOCDOY-SFHVURJKSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC000186952646 1129936512 /nfs/dbraw/zinc/93/65/12/1129936512.db2.gz QLBJZRFAAOCDOY-SFHVURJKSA-N 1 1 333.378 3.861 20 10 EHCDMO CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)cc1[O-] ZINC000700973332 1130086255 /nfs/dbraw/zinc/08/62/55/1130086255.db2.gz GOKUKDJPGBICCL-CYBMUJFWSA-N 1 1 343.309 3.755 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)c1nnc2n1CCCCC2 ZINC000730938173 1130751635 /nfs/dbraw/zinc/75/16/35/1130751635.db2.gz XKFXHZYZMAQNOA-MRXNPFEDSA-N 1 1 328.460 3.562 20 10 EHCDMO COc1cc(C)c(C[N@@H+](C)Cc2cc(C)cc(C)c2O)cc1OC ZINC000732414109 1130925485 /nfs/dbraw/zinc/92/54/85/1130925485.db2.gz CZSIQYFWFZVPFX-UHFFFAOYSA-N 1 1 329.440 3.967 20 10 EHCDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000734146926 1131204115 /nfs/dbraw/zinc/20/41/15/1131204115.db2.gz RNLQRAMXYVNIKX-QGZVFWFLSA-N 1 1 325.408 3.636 20 10 EHCDMO Cc1ccc(CC[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cc1 ZINC000736309443 1131415793 /nfs/dbraw/zinc/41/57/93/1131415793.db2.gz AAHAUKAXYAWZJY-HXUWFJFHSA-N 1 1 325.452 3.924 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCCN(C(=O)C(C)C)CC2)cc1C(C)C ZINC000738088840 1131460041 /nfs/dbraw/zinc/46/00/41/1131460041.db2.gz HDXMBQSPPXNLKB-UHFFFAOYSA-N 1 1 332.488 3.514 20 10 EHCDMO COC(=O)[C@@H](C)C[N@@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000740758889 1131540004 /nfs/dbraw/zinc/54/00/04/1131540004.db2.gz MJLKFEWCAXTOMS-KRWDZBQOSA-N 1 1 341.451 3.820 20 10 EHCDMO CCc1cc(C[N@H+]2CCCC[C@@H]2C2OCCO2)c(O)c(C(C)(C)C)c1 ZINC000740758882 1131540284 /nfs/dbraw/zinc/54/02/84/1131540284.db2.gz MBYNEGTZVKRDPD-GOSISDBHSA-N 1 1 347.499 3.980 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)Nc2ccccc2C)cc1 ZINC000741675252 1131633906 /nfs/dbraw/zinc/63/39/06/1131633906.db2.gz DOPRHMLQTASQFI-UHFFFAOYSA-N 1 1 339.483 3.912 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2C)cc1 ZINC000741675252 1131633908 /nfs/dbraw/zinc/63/39/08/1131633908.db2.gz DOPRHMLQTASQFI-UHFFFAOYSA-N 1 1 339.483 3.912 20 10 EHCDMO CC(C)OC(=O)CC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172761831 1131838093 /nfs/dbraw/zinc/83/80/93/1131838093.db2.gz GSKGDKYJHBYTEN-QGZVFWFLSA-N 1 1 332.488 3.839 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@H](C(=O)OC)CC1 ZINC001172807159 1131847899 /nfs/dbraw/zinc/84/78/99/1131847899.db2.gz MMKCFKHELPFOQP-HKUYNNGSSA-N 1 1 332.488 3.696 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1cccc(F)c1 ZINC000743870507 1131996229 /nfs/dbraw/zinc/99/62/29/1131996229.db2.gz VBOGVCPSCPVLRC-CQSZACIVSA-N 1 1 330.403 3.771 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1COc2cccc(OC)c2C1 ZINC001173168087 1131998916 /nfs/dbraw/zinc/99/89/16/1131998916.db2.gz MWEDYYSPPMYRSR-GOSISDBHSA-N 1 1 340.467 3.587 20 10 EHCDMO C[C@]1(C[NH2+]Cc2cc(F)ccc2O)CCN(Cc2ccccc2)C1 ZINC000379772890 1132518610 /nfs/dbraw/zinc/51/86/10/1132518610.db2.gz RXBVFVULUJZELO-HXUWFJFHSA-N 1 1 328.431 3.533 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(CO)c1)c1cccc(C(F)(F)F)c1O ZINC000798181931 1133085702 /nfs/dbraw/zinc/08/57/02/1133085702.db2.gz CJDYPKWKUDTKRK-LLVKDONJSA-N 1 1 325.330 3.754 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1Cl ZINC000768170910 1133104291 /nfs/dbraw/zinc/10/42/91/1133104291.db2.gz YGHLAOUUBKIHRY-UHFFFAOYSA-N 1 1 348.849 3.948 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1Cl ZINC000768170910 1133104295 /nfs/dbraw/zinc/10/42/95/1133104295.db2.gz YGHLAOUUBKIHRY-UHFFFAOYSA-N 1 1 348.849 3.948 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)c(OC)c1 ZINC000768168561 1133104586 /nfs/dbraw/zinc/10/45/86/1133104586.db2.gz JVEHVNGMSXCKKI-UHFFFAOYSA-N 1 1 332.419 3.541 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000768193232 1133111541 /nfs/dbraw/zinc/11/15/41/1133111541.db2.gz XFORVSNDTDSGLD-INIZCTEOSA-N 1 1 341.407 3.509 20 10 EHCDMO CCOc1ccc(C[N@@H+](Cc2ccccc2OC)C2CC2)c(O)c1 ZINC000768258139 1133118366 /nfs/dbraw/zinc/11/83/66/1133118366.db2.gz QCQSYCMKQFJQKX-UHFFFAOYSA-N 1 1 327.424 3.964 20 10 EHCDMO C[N@@H+](Cc1csc2ccccc12)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768439123 1133138209 /nfs/dbraw/zinc/13/82/09/1133138209.db2.gz HVZNTVFHWCUKHU-KRWDZBQOSA-N 1 1 341.432 3.665 20 10 EHCDMO COc1cc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c(O)cc1C ZINC000768441192 1133138892 /nfs/dbraw/zinc/13/88/92/1133138892.db2.gz XBDKTVIPJWDLEI-IBGZPJMESA-N 1 1 341.451 3.890 20 10 EHCDMO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768439267 1133139501 /nfs/dbraw/zinc/13/95/01/1133139501.db2.gz JHYGFARUWCCFDA-VBKZILBWSA-N 1 1 339.435 3.619 20 10 EHCDMO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cc3c(cc2O)OC[C@@H]3O)cc1 ZINC000768445697 1133140536 /nfs/dbraw/zinc/14/05/36/1133140536.db2.gz IGIOJVYEDDIQSQ-ICSRJNTNSA-N 1 1 339.435 3.854 20 10 EHCDMO Oc1cc2c(cc1CN1CCC[C@@H]([NH+]3CCCC3)CC1)CCCC2 ZINC000768448826 1133140716 /nfs/dbraw/zinc/14/07/16/1133140716.db2.gz XTYQASCOVSEHJZ-HXUWFJFHSA-N 1 1 328.500 3.721 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](Cc3ccccc3)[C@H]2C)cc1OC ZINC000768466605 1133145486 /nfs/dbraw/zinc/14/54/86/1133145486.db2.gz SXLUQXNJKHMDFM-NVXWUHKLSA-N 1 1 341.451 3.863 20 10 EHCDMO COc1ccc(-n2c(C)cc(C[N@@H+](C)C[C@H]3CCCOC3)c2C)cc1 ZINC000768530823 1133151180 /nfs/dbraw/zinc/15/11/80/1133151180.db2.gz QSFPXQWCXVORLD-GOSISDBHSA-N 1 1 342.483 3.961 20 10 EHCDMO COc1cccc(C[N@@H+]2CCc3c(Br)cccc3C2)c1O ZINC000769228927 1133247452 /nfs/dbraw/zinc/24/74/52/1133247452.db2.gz CWPCOJYMZQYTJY-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cccc(C[N@H+]2CCc3c(Br)cccc3C2)c1O ZINC000769228927 1133247456 /nfs/dbraw/zinc/24/74/56/1133247456.db2.gz CWPCOJYMZQYTJY-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c1O ZINC000769244188 1133250749 /nfs/dbraw/zinc/25/07/49/1133250749.db2.gz MFOCWCUOBZUOTL-ICSRJNTNSA-N 1 1 341.451 3.879 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@H]2C2CC2)c1O ZINC000769327348 1133262348 /nfs/dbraw/zinc/26/23/48/1133262348.db2.gz AULVGZPYODNFFJ-ZDUSSCGKSA-N 1 1 326.234 3.538 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCc3cc(OC)ccc3C2)c1O ZINC000769328478 1133262681 /nfs/dbraw/zinc/26/26/81/1133262681.db2.gz IUVAOVYKMIYUEX-UHFFFAOYSA-N 1 1 327.424 3.748 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H](N2CCCCC2)C1 ZINC000769330079 1133263270 /nfs/dbraw/zinc/26/32/70/1133263270.db2.gz NRXAGJXZLULMIB-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H](N2CCCCC2)C1 ZINC000769330079 1133263274 /nfs/dbraw/zinc/26/32/74/1133263274.db2.gz NRXAGJXZLULMIB-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@](C)(c3ccccc3)C2)c(O)c1 ZINC000769399396 1133275814 /nfs/dbraw/zinc/27/58/14/1133275814.db2.gz QEZUSLJWOSZGRW-HXUWFJFHSA-N 1 1 327.424 3.539 20 10 EHCDMO COc1cccc(C[N@@H+]2CCc3cccc(Br)c3C2)c1O ZINC000769452034 1133293890 /nfs/dbraw/zinc/29/38/90/1133293890.db2.gz OYSYYESPPYRYSM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cccc(C[N@H+]2CCc3cccc(Br)c3C2)c1O ZINC000769452034 1133293892 /nfs/dbraw/zinc/29/38/92/1133293892.db2.gz OYSYYESPPYRYSM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO Cn1cccc1C[N@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769469439 1133297479 /nfs/dbraw/zinc/29/74/79/1133297479.db2.gz XVDIFWDNGKWIIH-UHFFFAOYSA-N 1 1 342.443 3.556 20 10 EHCDMO Cn1cccc1C[N@@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769469439 1133297482 /nfs/dbraw/zinc/29/74/82/1133297482.db2.gz XVDIFWDNGKWIIH-UHFFFAOYSA-N 1 1 342.443 3.556 20 10 EHCDMO C[N@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514985 1133306768 /nfs/dbraw/zinc/30/67/68/1133306768.db2.gz MZBSPYWGRGCWMK-NRFANRHFSA-N 1 1 341.543 3.841 20 10 EHCDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514985 1133306774 /nfs/dbraw/zinc/30/67/74/1133306774.db2.gz MZBSPYWGRGCWMK-NRFANRHFSA-N 1 1 341.543 3.841 20 10 EHCDMO CCOC(=O)C1([N@@H+](C)Cc2ccc(Cl)cc2O)CCCCC1 ZINC001180057156 1133322049 /nfs/dbraw/zinc/32/20/49/1133322049.db2.gz CITSFUQQISWIQY-UHFFFAOYSA-N 1 1 325.836 3.743 20 10 EHCDMO COc1ccc(C[C@H]2CC[N@H+]2Cc2cc(F)c(N(C)C)cc2F)cc1 ZINC001180117487 1133334284 /nfs/dbraw/zinc/33/42/84/1133334284.db2.gz XZSQZTKXYQYXCP-MRXNPFEDSA-N 1 1 346.421 3.856 20 10 EHCDMO COC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001180183774 1133336674 /nfs/dbraw/zinc/33/66/74/1133336674.db2.gz GSSVDJZQPCRKGY-SFHVURJKSA-N 1 1 344.480 3.522 20 10 EHCDMO COC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001180183774 1133336683 /nfs/dbraw/zinc/33/66/83/1133336683.db2.gz GSSVDJZQPCRKGY-SFHVURJKSA-N 1 1 344.480 3.522 20 10 EHCDMO CCOCC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000769767948 1133339408 /nfs/dbraw/zinc/33/94/08/1133339408.db2.gz DDCOQHVAPKQWSE-YLJYHZDGSA-N 1 1 343.467 3.743 20 10 EHCDMO CCN(C)c1ccc(C[NH2+][C@H](C)c2cn(-c3ccccc3)nn2)cc1 ZINC000773840757 1133343977 /nfs/dbraw/zinc/34/39/77/1133343977.db2.gz UHULPKPXVQQXAW-MRXNPFEDSA-N 1 1 335.455 3.574 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](OCc3c(C)noc3C)C2)cc1 ZINC000773843496 1133346208 /nfs/dbraw/zinc/34/62/08/1133346208.db2.gz BPJACHYXEQBBEW-IBGZPJMESA-N 1 1 343.471 3.539 20 10 EHCDMO C[C@@H]([NH2+]Cc1ncccc1N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815627416 1133352003 /nfs/dbraw/zinc/35/20/03/1133352003.db2.gz ACVZGFPSBAKAAA-LLVKDONJSA-N 1 1 339.361 3.723 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CC(=O)OC(C)C)C2)cc1Cl ZINC001180585854 1133395362 /nfs/dbraw/zinc/39/53/62/1133395362.db2.gz OXBMFUXNAMHLKJ-AWEZNQCLSA-N 1 1 339.863 3.908 20 10 EHCDMO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)C[N@H+](C)C1CCCC1 ZINC001180633963 1133400731 /nfs/dbraw/zinc/40/07/31/1133400731.db2.gz XDKFZYOUFIUZRG-FQEVSTJZSA-N 1 1 344.499 3.623 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000770324485 1133411122 /nfs/dbraw/zinc/41/11/22/1133411122.db2.gz NPGRZEYICOXKAD-FXAWDEMLSA-N 1 1 326.488 3.812 20 10 EHCDMO C[C@H]1CCC[N@@H+](Cc2ccccc2O)[C@H]1CNC(=O)OC(C)(C)C ZINC000770510909 1133437245 /nfs/dbraw/zinc/43/72/45/1133437245.db2.gz VBLHOEWXTNKORN-HOCLYGCPSA-N 1 1 334.460 3.517 20 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/nfs/dbraw/zinc/72/75/10/1133727510.db2.gz JYGIJVXSMQFWLK-SREVYHEPSA-N 1 1 344.499 3.820 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+](CC(=O)OC(C)(C)C)CC2CC2)cc1 ZINC001182742816 1133727515 /nfs/dbraw/zinc/72/75/15/1133727515.db2.gz JYGIJVXSMQFWLK-SREVYHEPSA-N 1 1 344.499 3.820 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001182909367 1133748155 /nfs/dbraw/zinc/74/81/55/1133748155.db2.gz GMZPCVJFKZPGMP-GOSISDBHSA-N 1 1 335.806 3.668 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001182909367 1133748159 /nfs/dbraw/zinc/74/81/59/1133748159.db2.gz GMZPCVJFKZPGMP-GOSISDBHSA-N 1 1 335.806 3.668 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2cnccc2c1 ZINC000787069873 1133945506 /nfs/dbraw/zinc/94/55/06/1133945506.db2.gz ZEMYTIJUUQNWAL-UHFFFAOYSA-N 1 1 347.462 3.703 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000787288762 1133983943 /nfs/dbraw/zinc/98/39/43/1133983943.db2.gz BYUNPIQAPNQWTE-AWEZNQCLSA-N 1 1 336.794 3.623 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)c1cccc(C(F)(F)F)c1O ZINC000788753146 1134165349 /nfs/dbraw/zinc/16/53/49/1134165349.db2.gz IQAVMIKZASMCKF-NOZJJQNGSA-N 1 1 331.359 3.857 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@@H]1CC[C@H](C)O1 ZINC000789327845 1134257953 /nfs/dbraw/zinc/25/79/53/1134257953.db2.gz QSMMZHNSGQWYNL-FZMZJTMJSA-N 1 1 328.250 3.544 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc2cccnc2c1 ZINC000775153232 1134401219 /nfs/dbraw/zinc/40/12/19/1134401219.db2.gz SBDLQBRTYLZJRG-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(C)cc(Br)c1O ZINC000775175163 1134475741 /nfs/dbraw/zinc/47/57/41/1134475741.db2.gz GBLIDULQXAZHRX-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc(C)cc(Br)c1O ZINC000775175163 1134475747 /nfs/dbraw/zinc/47/57/47/1134475747.db2.gz GBLIDULQXAZHRX-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)Cc2cnn(C)c2C)cc1 ZINC000790939010 1134487865 /nfs/dbraw/zinc/48/78/65/1134487865.db2.gz YFOJXNBLOWSNHR-UHFFFAOYSA-N 1 1 328.504 3.987 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1cccc2c1OCCCO2 ZINC000790977439 1134495048 /nfs/dbraw/zinc/49/50/48/1134495048.db2.gz MHLUXWFZYRTXEW-UHFFFAOYSA-N 1 1 337.778 3.636 20 10 EHCDMO CC(C)c1cccc(C[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000775340348 1134651795 /nfs/dbraw/zinc/65/17/95/1134651795.db2.gz KXEMSQXATHWTLN-UHFFFAOYSA-N 1 1 337.511 3.852 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(-c3ccccc3C)no2)c1 ZINC000775363459 1134666891 /nfs/dbraw/zinc/66/68/91/1134666891.db2.gz LIHFUYJQFMTACM-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO CC[NH+](CC)[C@H](C)CNCc1ccc(OCc2ccccc2)cc1O ZINC000793240952 1134886054 /nfs/dbraw/zinc/88/60/54/1134886054.db2.gz VQYBVOYBNZNJGJ-QGZVFWFLSA-N 1 1 342.483 3.791 20 10 EHCDMO CC[C@H]([NH2+]Cc1n[nH]cc1Br)c1cc(Cl)ccc1O ZINC000775510036 1134973440 /nfs/dbraw/zinc/97/34/40/1134973440.db2.gz UNUVKVDDRJRKPH-NSHDSACASA-N 1 1 344.640 3.772 20 10 EHCDMO CCOC(=O)CCCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC001192014173 1134956039 /nfs/dbraw/zinc/95/60/39/1134956039.db2.gz QKUDGLQWIKOMQH-UHFFFAOYSA-N 1 1 331.412 3.721 20 10 EHCDMO CN(Cc1ccc(Cl)s1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775645711 1135388697 /nfs/dbraw/zinc/38/86/97/1135388697.db2.gz FXUOGJBQOIBZBD-UHFFFAOYSA-N 1 1 349.931 3.785 20 10 EHCDMO COC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(Cl)c1F ZINC000806137691 1135389710 /nfs/dbraw/zinc/38/97/10/1135389710.db2.gz QVECVSWKMJQYNQ-MRXNPFEDSA-N 1 1 335.806 3.891 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3ccccc3)cc2)CC1 ZINC000775645416 1135392443 /nfs/dbraw/zinc/39/24/43/1135392443.db2.gz KUUXUKJSQLIJAZ-QFIPXVFZSA-N 1 1 335.495 3.776 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+]3CCC[C@H]3c3ccccc3)cc2)CC1 ZINC000775645416 1135392448 /nfs/dbraw/zinc/39/24/48/1135392448.db2.gz KUUXUKJSQLIJAZ-QFIPXVFZSA-N 1 1 335.495 3.776 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](CO)c1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000806178531 1135411694 /nfs/dbraw/zinc/41/16/94/1135411694.db2.gz HHMDRQZKFLKROK-PWSUYJOCSA-N 1 1 341.238 3.521 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cc1 ZINC001195500100 1135435079 /nfs/dbraw/zinc/43/50/79/1135435079.db2.gz ZXZSJSVQVJWSPT-APWZRJJASA-N 1 1 346.515 3.942 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)c1 ZINC000775720950 1135570912 /nfs/dbraw/zinc/57/09/12/1135570912.db2.gz QQNGAMJQNMOMBK-IIBYNOLFSA-N 1 1 341.451 3.980 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1O ZINC000775725977 1135577590 /nfs/dbraw/zinc/57/75/90/1135577590.db2.gz VQQQFVREURKYKM-GFCCVEGCSA-N 1 1 325.836 3.518 20 10 EHCDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000808218867 1135630779 /nfs/dbraw/zinc/63/07/79/1135630779.db2.gz QVSGGQMGBIMCNG-KRWDZBQOSA-N 1 1 346.515 3.736 20 10 EHCDMO C[NH+](C)CCN(Cc1ccccc1)Cc1cc(Cl)cc(F)c1O ZINC000809728001 1135872677 /nfs/dbraw/zinc/87/26/77/1135872677.db2.gz GZTPONKHAYNUBR-UHFFFAOYSA-N 1 1 336.838 3.749 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000809715371 1135876984 /nfs/dbraw/zinc/87/69/84/1135876984.db2.gz IDNKPNKENSYQSG-GUYCJALGSA-N 1 1 342.395 3.892 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)c1 ZINC000809752849 1135886122 /nfs/dbraw/zinc/88/61/22/1135886122.db2.gz WJACYSZMDRLTCD-KRWDZBQOSA-N 1 1 348.450 3.865 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1OC ZINC000776012891 1135917940 /nfs/dbraw/zinc/91/79/40/1135917940.db2.gz KLYHYEGZIJUGGP-CMPLNLGQSA-N 1 1 333.350 3.572 20 10 EHCDMO CCCOc1cc(CNc2ccc3c(c2)[nH+]cn3C)ccc1OC ZINC001201114942 1135984834 /nfs/dbraw/zinc/98/48/34/1135984834.db2.gz SFXPXRNCXFYPRM-UHFFFAOYSA-N 1 1 325.412 3.983 20 10 EHCDMO COc1ccc2c(c1)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)CCO2 ZINC001201919566 1136075117 /nfs/dbraw/zinc/07/51/17/1136075117.db2.gz GIEHQILDYBXYNF-QGZVFWFLSA-N 1 1 348.393 3.653 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CC[C@@H](n2cccn2)C1)CCCC3 ZINC000812294234 1136195512 /nfs/dbraw/zinc/19/55/12/1136195512.db2.gz IEPJKWUZDSYPRH-CQSZACIVSA-N 1 1 337.423 3.661 20 10 EHCDMO COCC[C@@H]1COCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000812300206 1136196368 /nfs/dbraw/zinc/19/63/68/1136196368.db2.gz UMHYZNOZARXGSD-OAHLLOKOSA-N 1 1 341.407 3.529 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H](C)c2ccccn2)c1 ZINC000850342646 1136237646 /nfs/dbraw/zinc/23/76/46/1136237646.db2.gz MFLIWVQPINLCHN-GFCCVEGCSA-N 1 1 335.245 3.751 20 10 EHCDMO CO[C@](C)(C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O)C1CC1 ZINC000812734889 1136239374 /nfs/dbraw/zinc/23/93/74/1136239374.db2.gz ULQHAXLGRHQHKO-BJOHPYRUSA-N 1 1 346.240 3.760 20 10 EHCDMO CCOCc1cc(CN[C@@H]2CC[N@H+](C3CCCCC3)C2)ccc1OC ZINC000850382443 1136246932 /nfs/dbraw/zinc/24/69/32/1136246932.db2.gz SCFQASNRTJIJPK-LJQANCHMSA-N 1 1 346.515 3.728 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H]2CCN(C3CCCCC3)C2)ccc1OC ZINC000850382443 1136246933 /nfs/dbraw/zinc/24/69/33/1136246933.db2.gz SCFQASNRTJIJPK-LJQANCHMSA-N 1 1 346.515 3.728 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2C(C)(C)C2(F)F)c1 ZINC000850394284 1136248112 /nfs/dbraw/zinc/24/81/12/1136248112.db2.gz ORVDMFNHWZPGOB-LLVKDONJSA-N 1 1 334.204 3.844 20 10 EHCDMO C[C@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000850522794 1136277045 /nfs/dbraw/zinc/27/70/45/1136277045.db2.gz MFCRWMNMYDXISI-MNOVXSKESA-N 1 1 325.330 3.928 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccc(F)c1F)C[C@H]1CCCO1 ZINC000109761553 1136339328 /nfs/dbraw/zinc/33/93/28/1136339328.db2.gz JYFWWFJMSAAIAI-MRXNPFEDSA-N 1 1 333.378 3.852 20 10 EHCDMO Cc1ccoc1C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000813883999 1136372537 /nfs/dbraw/zinc/37/25/37/1136372537.db2.gz ZDMURHJTLXNULG-AWEZNQCLSA-N 1 1 334.847 3.929 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@H]1CC[C@@H](OC)C1 ZINC000851791742 1136407485 /nfs/dbraw/zinc/40/74/85/1136407485.db2.gz CMJQBXAYAKAPBX-UONOGXRCSA-N 1 1 328.250 3.544 20 10 EHCDMO COc1cc(Cl)cc(C[NH2+]Cc2cc(-c3ccccc3)on2)c1O ZINC000814171760 1136415396 /nfs/dbraw/zinc/41/53/96/1136415396.db2.gz RVCKOYHGNYVDRZ-UHFFFAOYSA-N 1 1 344.798 3.999 20 10 EHCDMO CCc1ccc([C@H]2CC[N@@H+](Cc3cc(OC)c(OC)cc3O)C2)cc1 ZINC000814224689 1136425379 /nfs/dbraw/zinc/42/53/79/1136425379.db2.gz LQUZDRJFPWXTGO-KRWDZBQOSA-N 1 1 341.451 3.961 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815012854 1136536749 /nfs/dbraw/zinc/53/67/49/1136536749.db2.gz NJCZGZPDTNTYOC-UHFFFAOYSA-N 1 1 339.483 3.694 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815012854 1136536751 /nfs/dbraw/zinc/53/67/51/1136536751.db2.gz NJCZGZPDTNTYOC-UHFFFAOYSA-N 1 1 339.483 3.694 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCO[C@@](C)(C4CC4)C3)c2c1 ZINC000853528399 1136541389 /nfs/dbraw/zinc/54/13/89/1136541389.db2.gz OVMOVADUQUSMLZ-HXUWFJFHSA-N 1 1 327.424 3.555 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@@H]1c1ccco1)[C@@H](O)CO2 ZINC000853538697 1136542054 /nfs/dbraw/zinc/54/20/54/1136542054.db2.gz JFGGTWAPCGCYHQ-LPHOPBHVSA-N 1 1 341.407 3.528 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000853624376 1136550180 /nfs/dbraw/zinc/55/01/80/1136550180.db2.gz OBARJGFSGCOVAA-OYRHEFFESA-N 1 1 345.483 3.788 20 10 EHCDMO Cc1cc(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C)ccc1N(C)C ZINC000815118872 1136551969 /nfs/dbraw/zinc/55/19/69/1136551969.db2.gz UAMBHVILJJURNY-RDJZCZTQSA-N 1 1 347.503 3.549 20 10 EHCDMO Fc1cc(CNc2cccc(C3CC3)[nH+]2)ccc1N1CCOCC1 ZINC000815143974 1136561524 /nfs/dbraw/zinc/56/15/24/1136561524.db2.gz QYSBGJZWEBAJBM-UHFFFAOYSA-N 1 1 327.403 3.547 20 10 EHCDMO CC[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)N1CCCC1 ZINC000815559106 1136610672 /nfs/dbraw/zinc/61/06/72/1136610672.db2.gz XXYVFKXDBZHGAX-CHWSQXEVSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815581235 1136614180 /nfs/dbraw/zinc/61/41/80/1136614180.db2.gz ZMVALAKJKVCSGB-PXAZEXFGSA-N 1 1 339.357 3.969 20 10 EHCDMO Oc1c(C[N@H+]2CCCN(c3nccs3)CC2)ccc2ccccc21 ZINC000816496633 1136725276 /nfs/dbraw/zinc/72/52/76/1136725276.db2.gz QEUDBUMWBDZECO-UHFFFAOYSA-N 1 1 339.464 3.714 20 10 EHCDMO [O-]c1cc(F)c(Cl)cc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000816529895 1136730055 /nfs/dbraw/zinc/73/00/55/1136730055.db2.gz LOBLMCRKQLVGLK-UHFFFAOYSA-N 1 1 348.849 3.939 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccccc1Cn1cccn1 ZINC000816531309 1136730696 /nfs/dbraw/zinc/73/06/96/1136730696.db2.gz NHYLQYMNTRQVLX-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO Oc1c(C[N@@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)ccc2ccccc21 ZINC000816592382 1136735410 /nfs/dbraw/zinc/73/54/10/1136735410.db2.gz IILAFPLJMWYKOY-PBHICJAKSA-N 1 1 339.357 3.681 20 10 EHCDMO Cn1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(-c2ccccc2)n1 ZINC000816567213 1136738464 /nfs/dbraw/zinc/73/84/64/1136738464.db2.gz UIUVLXIGWKXKNV-UHFFFAOYSA-N 1 1 345.805 3.875 20 10 EHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000817938258 1136847699 /nfs/dbraw/zinc/84/76/99/1136847699.db2.gz HNWOJODDCHVWBO-SGTLLEGYSA-N 1 1 335.854 3.896 20 10 EHCDMO Cc1ccc2c(c1)OCCC[C@@H]2NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940812 1136848549 /nfs/dbraw/zinc/84/85/49/1136848549.db2.gz HZDDJKNDNZZJFZ-PMACEKPBSA-N 1 1 339.483 3.564 20 10 EHCDMO CSc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1F ZINC000817943819 1136849008 /nfs/dbraw/zinc/84/90/08/1136849008.db2.gz VSWYRORWTHRJAO-SCLBCKFNSA-N 1 1 347.503 3.964 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Br)ccc1[O-] ZINC000817976813 1136854466 /nfs/dbraw/zinc/85/44/66/1136854466.db2.gz UYMUZNPYXPPWTH-BXUZGUMPSA-N 1 1 329.282 3.713 20 10 EHCDMO CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817981340 1136854915 /nfs/dbraw/zinc/85/49/15/1136854915.db2.gz REMXTAFGKBCAPA-DZGCQCFKSA-N 1 1 341.293 3.728 20 10 EHCDMO CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817981343 1136854956 /nfs/dbraw/zinc/85/49/56/1136854956.db2.gz REMXTAFGKBCAPA-ZFWWWQNUSA-N 1 1 341.293 3.728 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)cc1 ZINC000858013482 1136930684 /nfs/dbraw/zinc/93/06/84/1136930684.db2.gz CYLWKFBWHCEPPU-HXUWFJFHSA-N 1 1 337.467 3.678 20 10 EHCDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3cc(Cl)c(C)cc3O)C2)nc1 ZINC000858014066 1136930690 /nfs/dbraw/zinc/93/06/90/1136930690.db2.gz LPPJPACETDLNGM-HNNXBMFYSA-N 1 1 332.831 3.711 20 10 EHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(F)c(Br)c1)CC2 ZINC001137558175 1136946412 /nfs/dbraw/zinc/94/64/12/1136946412.db2.gz FIRAXRZGSBCCQB-UHFFFAOYSA-N 1 1 336.204 3.852 20 10 EHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(F)c(Br)c1)CC2 ZINC001137558175 1136946415 /nfs/dbraw/zinc/94/64/15/1136946415.db2.gz FIRAXRZGSBCCQB-UHFFFAOYSA-N 1 1 336.204 3.852 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cnn(CC)n2)cc1 ZINC000858205392 1136949379 /nfs/dbraw/zinc/94/93/79/1136949379.db2.gz YNWMOPQLSXEYFU-UHFFFAOYSA-N 1 1 349.482 3.614 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(N(C)C(C)=O)cc1)c1ccc(F)cc1O ZINC000858499435 1136974255 /nfs/dbraw/zinc/97/42/55/1136974255.db2.gz ZQRZDCUCVWYMNB-GOSISDBHSA-N 1 1 330.403 3.755 20 10 EHCDMO COc1ccc([C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C2CC2)cn1 ZINC000858605834 1136982256 /nfs/dbraw/zinc/98/22/56/1136982256.db2.gz ZTGPVYZFPNBLHH-BMLIUANNSA-N 1 1 334.366 3.876 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859613145 1137022898 /nfs/dbraw/zinc/02/28/98/1137022898.db2.gz YPGUPTOWOUTEFT-QAPCUYQASA-N 1 1 332.488 3.552 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822530246 1137062409 /nfs/dbraw/zinc/06/24/09/1137062409.db2.gz VLHOVVPLCKIJJR-KRWDZBQOSA-N 1 1 339.838 3.966 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822530246 1137062411 /nfs/dbraw/zinc/06/24/11/1137062411.db2.gz VLHOVVPLCKIJJR-KRWDZBQOSA-N 1 1 339.838 3.966 20 10 EHCDMO CCn1nc(C)c(C[N@@H+](Cc2ccccc2O)C2CCCCC2)n1 ZINC000823375471 1137096877 /nfs/dbraw/zinc/09/68/77/1137096877.db2.gz VDZCLFUXRBVVBO-UHFFFAOYSA-N 1 1 328.460 3.647 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000824344048 1137133536 /nfs/dbraw/zinc/13/35/36/1137133536.db2.gz BEETXRBMWXQMHD-UHFFFAOYSA-N 1 1 328.481 3.749 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000824344048 1137133537 /nfs/dbraw/zinc/13/35/37/1137133537.db2.gz BEETXRBMWXQMHD-UHFFFAOYSA-N 1 1 328.481 3.749 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(F)c(N(C)C)cc1F ZINC000862250494 1137135227 /nfs/dbraw/zinc/13/52/27/1137135227.db2.gz PKWBMZJYDNIYNE-UHFFFAOYSA-N 1 1 325.428 3.552 20 10 EHCDMO CC(C)[N@H+](Cc1ccnn1-c1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000824566868 1137143153 /nfs/dbraw/zinc/14/31/53/1137143153.db2.gz ORIZBYDXZAYUDE-UHFFFAOYSA-N 1 1 349.482 3.744 20 10 EHCDMO CC(C)[N@@H+](Cc1ccnn1-c1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000824566868 1137143154 /nfs/dbraw/zinc/14/31/54/1137143154.db2.gz ORIZBYDXZAYUDE-UHFFFAOYSA-N 1 1 349.482 3.744 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824596181 1137144446 /nfs/dbraw/zinc/14/44/46/1137144446.db2.gz CEIHBFRKNVGANK-AWEZNQCLSA-N 1 1 343.471 3.801 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3ccc(OC)c(F)c3)C2)c1O ZINC000862540417 1137148881 /nfs/dbraw/zinc/14/88/81/1137148881.db2.gz DJLYXEGFJJOQNO-OAHLLOKOSA-N 1 1 345.414 3.928 20 10 EHCDMO Cn1ncc(C2CC2)c1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000824776027 1137151655 /nfs/dbraw/zinc/15/16/55/1137151655.db2.gz FALMTJCIVIUWQT-UHFFFAOYSA-N 1 1 325.456 3.948 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000824952462 1137159310 /nfs/dbraw/zinc/15/93/10/1137159310.db2.gz AVJCACDRFZJKHG-WBMJQRKESA-N 1 1 336.794 3.590 20 10 EHCDMO Cc1cc([O-])c(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000825125474 1137166748 /nfs/dbraw/zinc/16/67/48/1137166748.db2.gz LEJVSZBSPXDBBI-UHFFFAOYSA-N 1 1 348.874 3.584 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3cc(F)cc(F)c3C)CC2)cc1 ZINC001143757976 1137197720 /nfs/dbraw/zinc/19/77/20/1137197720.db2.gz SVVHYDVCSGFRNY-UHFFFAOYSA-N 1 1 332.394 3.604 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cc3n(n2)CCCC3)cc1 ZINC000844270879 1137207693 /nfs/dbraw/zinc/20/76/93/1137207693.db2.gz NMKGIBROCSIRJH-UHFFFAOYSA-N 1 1 326.488 3.698 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc3n(n2)CCCC3)cc1 ZINC000844270879 1137207695 /nfs/dbraw/zinc/20/76/95/1137207695.db2.gz NMKGIBROCSIRJH-UHFFFAOYSA-N 1 1 326.488 3.698 20 10 EHCDMO COc1ccc(N(C)CC[N@H+](C)Cc2cc(-c3ccco3)on2)cc1 ZINC000844399766 1137217334 /nfs/dbraw/zinc/21/73/34/1137217334.db2.gz OEVURJSCYBYATP-UHFFFAOYSA-N 1 1 341.411 3.511 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2cc(-c3ccco3)on2)cc1 ZINC000844399766 1137217336 /nfs/dbraw/zinc/21/73/36/1137217336.db2.gz OEVURJSCYBYATP-UHFFFAOYSA-N 1 1 341.411 3.511 20 10 EHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@@H](C)c1cccc(OC)c1 ZINC000120162457 1137239415 /nfs/dbraw/zinc/23/94/15/1137239415.db2.gz LIHVDBKYCSMZGV-ZDUSSCGKSA-N 1 1 329.396 3.713 20 10 EHCDMO COCCC1CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144300048 1137268846 /nfs/dbraw/zinc/26/88/46/1137268846.db2.gz PWJYWKVYLMWZBR-UHFFFAOYSA-N 1 1 346.240 3.542 20 10 EHCDMO CC[C@]1(CO)CCC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000825567402 1137275722 /nfs/dbraw/zinc/27/57/22/1137275722.db2.gz IVJZEQSDIKKYPK-FQEVSTJZSA-N 1 1 335.488 3.683 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3ccncc3Br)ccc21 ZINC000865438022 1137283694 /nfs/dbraw/zinc/28/36/94/1137283694.db2.gz XHVJTCJDGHHFMR-UHFFFAOYSA-N 1 1 346.272 3.516 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@@H]2CCSC2)c1 ZINC000865651901 1137301919 /nfs/dbraw/zinc/30/19/19/1137301919.db2.gz IXRWFGCCLDSKPL-LLVKDONJSA-N 1 1 330.291 3.696 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2c(O)cc(O)cc2O)CCc2ccc(Cl)cc21 ZINC001144515380 1137304388 /nfs/dbraw/zinc/30/43/88/1137304388.db2.gz LYJMUHBOCTVAJV-NSHDSACASA-N 1 1 333.815 3.619 20 10 EHCDMO COc1cccc([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)c1O ZINC000846144486 1137339026 /nfs/dbraw/zinc/33/90/26/1137339026.db2.gz GXMVXQHRLRZNBI-OAHLLOKOSA-N 1 1 332.488 3.849 20 10 EHCDMO C[C@@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1ccc(Cl)cc1O ZINC000846180485 1137339781 /nfs/dbraw/zinc/33/97/81/1137339781.db2.gz KYPKATVIHCZPQT-BFUOFWGJSA-N 1 1 331.843 3.573 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccc4scnc4c3)CC2)cc1 ZINC001144733143 1137339880 /nfs/dbraw/zinc/33/98/80/1137339880.db2.gz YPVJSFITEXEFRX-UHFFFAOYSA-N 1 1 339.464 3.627 20 10 EHCDMO C[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc(C(F)(F)F)c1O ZINC000866568260 1137365688 /nfs/dbraw/zinc/36/56/88/1137365688.db2.gz SJGYOXTUUHEJRZ-MRVPVSSYSA-N 1 1 349.303 3.933 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc3cnccc3o2)c1 ZINC000866621807 1137370465 /nfs/dbraw/zinc/37/04/65/1137370465.db2.gz VIDPGLBFGVSBQU-VXGBXAGGSA-N 1 1 340.379 3.732 20 10 EHCDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@H]2CCCC[C@H]12 ZINC001171810026 1137514172 /nfs/dbraw/zinc/51/41/72/1137514172.db2.gz MLYHIPOPJTYYHT-GGPKGHCWSA-N 1 1 344.499 3.615 20 10 EHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1c[nH]c3c1cccc3F)CCC2 ZINC001137058916 1137578833 /nfs/dbraw/zinc/57/88/33/1137578833.db2.gz FCCYKKIMEDHNMV-UHFFFAOYSA-N 1 1 326.371 3.667 20 10 EHCDMO C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1[O-] ZINC000873241848 1137595106 /nfs/dbraw/zinc/59/51/06/1137595106.db2.gz GPGAXSZBZYNENR-AAEUAGOBSA-N 1 1 341.293 3.584 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1[O-] ZINC000873246113 1137595153 /nfs/dbraw/zinc/59/51/53/1137595153.db2.gz WYTIIOGWHJPLER-YPMHNXCESA-N 1 1 341.293 3.584 20 10 EHCDMO COc1cc(CN2CCC[C@@H]([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000825699292 1137607379 /nfs/dbraw/zinc/60/73/79/1137607379.db2.gz SZTXSKWMWQQJSM-MRXNPFEDSA-N 1 1 334.504 3.614 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccn(C(F)F)c2=O)cc1 ZINC000876551381 1137655259 /nfs/dbraw/zinc/65/52/59/1137655259.db2.gz PYPLHPAKESJZGN-UHFFFAOYSA-N 1 1 349.425 3.722 20 10 EHCDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876733016 1137659903 /nfs/dbraw/zinc/65/99/03/1137659903.db2.gz MEHRZHKIUMUBQC-MMOPVJDHSA-N 1 1 328.500 3.801 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c(O)c1 ZINC000877194858 1137672636 /nfs/dbraw/zinc/67/26/36/1137672636.db2.gz DFORJEBPTHYTSF-CQSZACIVSA-N 1 1 339.361 3.753 20 10 EHCDMO Cc1cc(O)c(CNc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc1Cl ZINC000825955019 1137674467 /nfs/dbraw/zinc/67/44/67/1137674467.db2.gz DMJVLLQYAGORPZ-KRWDZBQOSA-N 1 1 346.858 3.533 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2O)n1 ZINC000877473317 1137677395 /nfs/dbraw/zinc/67/73/95/1137677395.db2.gz GJRAZLLFMJAZDP-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@H+]2Cc2c(C)cccc2O)n1 ZINC000877473317 1137677396 /nfs/dbraw/zinc/67/73/96/1137677396.db2.gz GJRAZLLFMJAZDP-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO CC(C)CC(=O)N1CCC[N@@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000877773998 1137689349 /nfs/dbraw/zinc/68/93/49/1137689349.db2.gz COSOTKKFZMGGPI-UHFFFAOYSA-N 1 1 340.467 3.626 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC000877810545 1137690912 /nfs/dbraw/zinc/69/09/12/1137690912.db2.gz WBDRIGQKZAQWOJ-GFCCVEGCSA-N 1 1 330.428 3.755 20 10 EHCDMO CCCC[N@@H+](Cc1cnc(C(=O)OCC)s1)Cc1ccccc1O ZINC000878565518 1137720444 /nfs/dbraw/zinc/72/04/44/1137720444.db2.gz ORSRDCZFGKZMNJ-UHFFFAOYSA-N 1 1 348.468 3.828 20 10 EHCDMO CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000882889281 1137837006 /nfs/dbraw/zinc/83/70/06/1137837006.db2.gz WCDCNFFIOYOBNI-UHFFFAOYSA-N 1 1 334.410 3.800 20 10 EHCDMO C[N@H+](CCCn1ccnc1)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000130629991 1137840303 /nfs/dbraw/zinc/84/03/03/1137840303.db2.gz ZKBRUCUALRYZLV-UHFFFAOYSA-N 1 1 339.439 3.736 20 10 EHCDMO C[N@@H+](CCCn1ccnc1)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000130629991 1137840304 /nfs/dbraw/zinc/84/03/04/1137840304.db2.gz ZKBRUCUALRYZLV-UHFFFAOYSA-N 1 1 339.439 3.736 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)c1O ZINC000130736800 1137841464 /nfs/dbraw/zinc/84/14/64/1137841464.db2.gz UINBNZZUUPJSPK-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Br)cc1O ZINC000883312063 1137854121 /nfs/dbraw/zinc/85/41/21/1137854121.db2.gz SJBSMPFGVSHMQK-NSHDSACASA-N 1 1 348.244 3.675 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1C(F)(F)F)c1c(O)cccc1F ZINC000886512720 1138087172 /nfs/dbraw/zinc/08/71/72/1138087172.db2.gz LQQQPBCGFVQZCC-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+][C@@H](Cc1nccn1C)c1ccccc1)c1c(O)cccc1F ZINC000886535169 1138092086 /nfs/dbraw/zinc/09/20/86/1138092086.db2.gz VXDWANWLRPDGSE-PBHICJAKSA-N 1 1 339.414 3.899 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(N2CCCC2)n1 ZINC000886587911 1138100038 /nfs/dbraw/zinc/10/00/38/1138100038.db2.gz IDXUCMSDMKNEAQ-CQSZACIVSA-N 1 1 329.419 3.686 20 10 EHCDMO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000886710844 1138122131 /nfs/dbraw/zinc/12/21/31/1138122131.db2.gz HKWYXTSFWPCYLM-ZBFHGGJFSA-N 1 1 337.435 3.548 20 10 EHCDMO Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n[nH]1 ZINC000090531356 1138211575 /nfs/dbraw/zinc/21/15/75/1138211575.db2.gz QOPYMRRCQJILNM-RDJZCZTQSA-N 1 1 326.488 3.990 20 10 EHCDMO COc1cccc(C[N@H+](C)Cc2ccc(SC)c(OC)c2)c1O ZINC000092674423 1138230088 /nfs/dbraw/zinc/23/00/88/1138230088.db2.gz MQZXOISIHHENKU-UHFFFAOYSA-N 1 1 333.453 3.763 20 10 EHCDMO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)NC(=O)OC(C)(C)C ZINC000301809247 1138650952 /nfs/dbraw/zinc/65/09/52/1138650952.db2.gz FSTQPOCPEINSMU-SWLSCSKDSA-N 1 1 340.439 3.731 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)Cc1cc(C)ccc1O ZINC000179628055 1139770708 /nfs/dbraw/zinc/77/07/08/1139770708.db2.gz UOVKYOXTDRENIG-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCN(CCC(F)(F)F)CC2)cc1 ZINC000777401020 1140063798 /nfs/dbraw/zinc/06/37/98/1140063798.db2.gz JJALUPCOEBXENX-UHFFFAOYSA-N 1 1 343.437 3.601 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(N(C)C)nc2ccccc12)c1ccc(F)cc1O ZINC000185613607 1140158920 /nfs/dbraw/zinc/15/89/20/1140158920.db2.gz BUUOKORFGVPUJN-ZDUSSCGKSA-N 1 1 339.414 3.996 20 10 EHCDMO C[C@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(F)cc1O ZINC000186152341 1140189127 /nfs/dbraw/zinc/18/91/27/1140189127.db2.gz PGBYNFYZGGCTOK-GJZGRUSLSA-N 1 1 343.446 3.803 20 10 EHCDMO COc1ccc(C[NH2+]C(C)(C)c2cn(-c3ccccc3)nn2)cc1C ZINC000268032993 1140871135 /nfs/dbraw/zinc/87/11/35/1140871135.db2.gz LOENNWUREDBMOP-UHFFFAOYSA-N 1 1 336.439 3.609 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1O ZINC000271245872 1141333150 /nfs/dbraw/zinc/33/31/50/1141333150.db2.gz HBFPLGFZGCHSEI-LSDHHAIUSA-N 1 1 333.453 3.550 20 10 EHCDMO COc1cc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)c(O)cc1C ZINC000160179732 1014200741 /nfs/dbraw/zinc/20/07/41/1014200741.db2.gz SGGADOHEBRXUCQ-HNNXBMFYSA-N 1 1 332.469 3.984 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)[C@@H](C)CO1 ZINC001204432506 1015571141 /nfs/dbraw/zinc/57/11/41/1015571141.db2.gz TWNNAJFRJWPXPJ-HOTGVXAUSA-N 1 1 330.497 3.994 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cnc2ccccn12 ZINC000160279723 1016476411 /nfs/dbraw/zinc/47/64/11/1016476411.db2.gz JQJIRULGQNUGDS-UHFFFAOYSA-N 1 1 333.391 3.835 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cnc2ccccn12 ZINC000160279723 1016476421 /nfs/dbraw/zinc/47/64/21/1016476421.db2.gz JQJIRULGQNUGDS-UHFFFAOYSA-N 1 1 333.391 3.835 20 10 EHCDMO CCc1c[nH]c2nc[nH+]c(N3CC=C(c4c[nH]c5ncccc45)CC3)c12 ZINC000891660599 1022244494 /nfs/dbraw/zinc/24/44/94/1022244494.db2.gz BIAKTXREUKAZQQ-UHFFFAOYSA-N 1 1 344.422 3.690 20 10 EHCDMO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3cc(F)ccc3O)n2)cc1 ZINC000276772592 1022772993 /nfs/dbraw/zinc/77/29/93/1022772993.db2.gz PCHIOBCAQDYHNK-GFCCVEGCSA-N 1 1 341.386 3.995 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nnc([C@@H](C)CC)[nH]2)c(O)c1 ZINC000277060388 1023728387 /nfs/dbraw/zinc/72/83/87/1023728387.db2.gz BRYZESOXSVVCNS-QWHCGFSZSA-N 1 1 332.448 3.663 20 10 EHCDMO CCOc1cccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1O ZINC000280838586 1024407309 /nfs/dbraw/zinc/40/73/09/1024407309.db2.gz BQXCLXSUZRHVAG-UHFFFAOYSA-N 1 1 329.293 3.637 20 10 EHCDMO C[C@@H]([NH2+]CC1([S@@](C)=O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000281145873 1024672864 /nfs/dbraw/zinc/67/28/64/1024672864.db2.gz UWSMPKKDAJJGLR-GSDQLPOLSA-N 1 1 336.284 3.651 20 10 EHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 ZINC000729545331 1024658146 /nfs/dbraw/zinc/65/81/46/1024658146.db2.gz UUXSLGAIQCVGOH-IAGOWNOFSA-N 1 1 345.531 3.610 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1Cc2ccccc2OC2(CCOCC2)C1 ZINC000896441833 1025450788 /nfs/dbraw/zinc/45/07/88/1025450788.db2.gz NMRNTWFRZMSWGN-UHFFFAOYSA-N 1 1 339.435 3.644 20 10 EHCDMO [O-]c1c(Cl)cccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192935211 1026647129 /nfs/dbraw/zinc/64/71/29/1026647129.db2.gz HIFPWTDNPMIFRW-MRXNPFEDSA-N 1 1 330.859 3.657 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000273160554 1027287253 /nfs/dbraw/zinc/28/72/53/1027287253.db2.gz KJKGMWMFAAFXJR-LJQANCHMSA-N 1 1 349.434 3.862 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c1 ZINC000273511677 1027468018 /nfs/dbraw/zinc/46/80/18/1027468018.db2.gz RVJNOYFPYNAVKS-HOCLYGCPSA-N 1 1 347.455 3.711 20 10 EHCDMO Cc1cccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)n1 ZINC000127229298 1027628527 /nfs/dbraw/zinc/62/85/27/1027628527.db2.gz BAUJWPYIPSVUCS-HNNXBMFYSA-N 1 1 345.874 3.731 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C)[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874311 1027862048 /nfs/dbraw/zinc/86/20/48/1027862048.db2.gz RFPFCDWPSHWPCC-UVFQYZLESA-N 1 1 328.431 3.875 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2Cn2ccnc2C(C)C)c1 ZINC000359878278 1027862896 /nfs/dbraw/zinc/86/28/96/1027862896.db2.gz QNUGVZBBIZUZDB-KRWDZBQOSA-N 1 1 343.471 3.775 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000359879024 1027866023 /nfs/dbraw/zinc/86/60/23/1027866023.db2.gz YYVNJXBPSOXZMU-WJPUGNRLSA-N 1 1 340.467 3.744 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](CCC1OCCO1)Cc1ccccc1O ZINC000125279741 1029472510 /nfs/dbraw/zinc/47/25/10/1029472510.db2.gz RUUFREFOPLVIRU-MRXNPFEDSA-N 1 1 327.424 3.718 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000179563131 1031787418 /nfs/dbraw/zinc/78/74/18/1031787418.db2.gz SDSYGQSAWQDKAG-SJPCQFCGSA-N 1 1 346.471 3.755 20 10 EHCDMO C[C@@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278654398 1031842641 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349.522 3.864 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCN(c3ccc(C)cc3)CC2)c1 ZINC000771941151 1133618250 /nfs/dbraw/zinc/61/82/50/1133618250.db2.gz YUOAXKBHCZILPU-UHFFFAOYSA-N 1 1 340.467 3.812 20 10 EHCDMO C[C@H]([NH2+]CCN(C)CC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774180096 1133636493 /nfs/dbraw/zinc/63/64/93/1133636493.db2.gz BJSZZWIOXBAJGS-QMMMGPOBSA-N 1 1 345.192 3.844 20 10 EHCDMO CCO[C@@H]1COCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774349811 1133668716 /nfs/dbraw/zinc/66/87/16/1133668716.db2.gz VUASHNKVCSXVPG-JBCWJZNQSA-N 1 1 334.243 3.544 20 10 EHCDMO COc1cc(C[N@H+]2CCOC[C@@H]2C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001182532280 1133697845 /nfs/dbraw/zinc/69/78/45/1133697845.db2.gz BMURZUOYTMYGBG-GOSISDBHSA-N 1 1 333.472 3.699 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2cc3ccncc3s2)cc1 ZINC001182726728 1133725343 /nfs/dbraw/zinc/72/53/43/1133725343.db2.gz YEJQZLCPFOODJH-UHFFFAOYSA-N 1 1 341.480 3.873 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000774701615 1133883026 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EHCDMO CC(C)(C)[C@@H](Cn1ccnc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790954528 1134484604 /nfs/dbraw/zinc/48/46/04/1134484604.db2.gz UJZGFVUSSCWIGC-CQSZACIVSA-N 1 1 325.815 3.586 20 10 EHCDMO CCN(CC)[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccco1 ZINC000790961885 1134485934 /nfs/dbraw/zinc/48/59/34/1134485934.db2.gz CEYQVVFKPIKSFA-CQSZACIVSA-N 1 1 340.826 3.950 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792173145 1134662528 /nfs/dbraw/zinc/66/25/28/1134662528.db2.gz ROWJLXBWFDUDHR-LBPRGKRZSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173145 1134662532 /nfs/dbraw/zinc/66/25/32/1134662532.db2.gz ROWJLXBWFDUDHR-LBPRGKRZSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173145 1134662534 /nfs/dbraw/zinc/66/25/34/1134662534.db2.gz ROWJLXBWFDUDHR-LBPRGKRZSA-N 1 1 343.826 3.740 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nnc(-c3cccs3)o2)c1 ZINC000775375937 1134684009 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C[C@@H](c1cccs1)[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775648924 1135405185 /nfs/dbraw/zinc/40/51/85/1135405185.db2.gz HYNCEIRIJNHAGB-INIZCTEOSA-N 1 1 329.513 3.693 20 10 EHCDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775648924 1135405188 /nfs/dbraw/zinc/40/51/88/1135405188.db2.gz HYNCEIRIJNHAGB-INIZCTEOSA-N 1 1 329.513 3.693 20 10 EHCDMO CCC[N@H+](Cc1cn(-c2ccccc2C)nn1)Cc1ccccc1O ZINC000809557790 1135856513 /nfs/dbraw/zinc/85/65/13/1135856513.db2.gz SXBBPPNRAOGZHI-UHFFFAOYSA-N 1 1 336.439 3.694 20 10 EHCDMO CCC[N@@H+](Cc1cn(-c2ccccc2C)nn1)Cc1ccccc1O ZINC000809557790 1135856515 /nfs/dbraw/zinc/85/65/15/1135856515.db2.gz SXBBPPNRAOGZHI-UHFFFAOYSA-N 1 1 336.439 3.694 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@H]2CCCO2)cc1 ZINC000809697968 1135868422 /nfs/dbraw/zinc/86/84/22/1135868422.db2.gz SOUBIUHDPMDSDV-NHCUHLMSSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCOC[C@@H]2[C@H]2CCCO2)cc1 ZINC000809697968 1135868425 /nfs/dbraw/zinc/86/84/25/1135868425.db2.gz SOUBIUHDPMDSDV-NHCUHLMSSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCCO2)cc1 ZINC000809697969 1135868612 /nfs/dbraw/zinc/86/86/12/1135868612.db2.gz SOUBIUHDPMDSDV-RTWAWAEBSA-N 1 1 346.515 3.693 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCO2)cc1 ZINC000809697969 1135868616 /nfs/dbraw/zinc/86/86/16/1135868616.db2.gz SOUBIUHDPMDSDV-RTWAWAEBSA-N 1 1 346.515 3.693 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1O ZINC000809700567 1135868807 /nfs/dbraw/zinc/86/88/07/1135868807.db2.gz JILCGCXASGFSQM-DOMZBBRYSA-N 1 1 327.852 3.570 20 10 EHCDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)Cc1cccc(C)c1O ZINC000809736412 1135874386 /nfs/dbraw/zinc/87/43/86/1135874386.db2.gz TWOHHVAHSDIDQT-HXUWFJFHSA-N 1 1 339.483 3.582 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000809768144 1135880593 /nfs/dbraw/zinc/88/05/93/1135880593.db2.gz DAHLBKRWTZEBFS-MRXNPFEDSA-N 1 1 325.387 3.546 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+](CCc2ccccn2)Cc2ccncc2)c1 ZINC000809763217 1135888538 /nfs/dbraw/zinc/88/85/38/1135888538.db2.gz LVNONZMPGVUTAG-UHFFFAOYSA-N 1 1 333.435 3.736 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2N(C)C)c1O ZINC000809787372 1135891318 /nfs/dbraw/zinc/89/13/18/1135891318.db2.gz ANULNTXZFRPNSG-UHFFFAOYSA-N 1 1 334.847 3.752 20 10 EHCDMO OC[C@@]1(Cc2ccc(F)cc2)CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000809791108 1135893398 /nfs/dbraw/zinc/89/33/98/1135893398.db2.gz UGVLWTUDWOEPMH-LJQANCHMSA-N 1 1 349.833 3.612 20 10 EHCDMO CC[N@@H+](Cc1oc(C)nc1C)Cc1cc(Br)ccc1O ZINC000809950808 1135905437 /nfs/dbraw/zinc/90/54/37/1135905437.db2.gz PLMHBXDGAJBZGW-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000776003989 1135915635 /nfs/dbraw/zinc/91/56/35/1135915635.db2.gz YYQONYNALUAEFU-MFKMUULPSA-N 1 1 328.250 3.784 20 10 EHCDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC/C=C\c1ccc(N(C)C)cc1 ZINC001199677956 1135919523 /nfs/dbraw/zinc/91/95/23/1135919523.db2.gz IEAPQEMXVBCCPS-TYTUHHLSSA-N 1 1 329.532 3.722 20 10 EHCDMO C[C@@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001199677956 1135919524 /nfs/dbraw/zinc/91/95/24/1135919524.db2.gz IEAPQEMXVBCCPS-TYTUHHLSSA-N 1 1 329.532 3.722 20 10 EHCDMO C[C@@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(N3CCCC3)cc2)C1 ZINC001199732829 1135924031 /nfs/dbraw/zinc/92/40/31/1135924031.db2.gz SAPKGEUYBNZIHA-GOSISDBHSA-N 1 1 329.532 3.887 20 10 EHCDMO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2ccc(N3CCCC3)cc2)C1 ZINC001199732829 1135924035 /nfs/dbraw/zinc/92/40/35/1135924035.db2.gz SAPKGEUYBNZIHA-GOSISDBHSA-N 1 1 329.532 3.887 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC(C)(C)[C@H]3[C@H]3CCCO3)c2c1 ZINC000811777887 1136134345 /nfs/dbraw/zinc/13/43/45/1136134345.db2.gz KPEBBMCFJBQBQW-WOJBJXKFSA-N 1 1 341.451 3.943 20 10 EHCDMO CCOC(=O)CC[N@@H+](Cc1cc(C)cc(C(C)(C)C)c1O)C1CC1 ZINC000747786385 1136198567 /nfs/dbraw/zinc/19/85/67/1136198567.db2.gz KHVCZROFLMOMCN-UHFFFAOYSA-N 1 1 333.472 3.916 20 10 EHCDMO C=Cc1ccc(CC[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)cc1 ZINC000812734854 1136239304 /nfs/dbraw/zinc/23/93/04/1136239304.db2.gz STKBQQMECMKVOK-CQSZACIVSA-N 1 1 325.408 3.715 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2C[C@H](O)c3ccccc32)c1 ZINC000850371253 1136243483 /nfs/dbraw/zinc/24/34/83/1136243483.db2.gz HYTOJELEVANVLA-HOTGVXAUSA-N 1 1 348.240 3.731 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)c1nccn1C ZINC000850409625 1136252315 /nfs/dbraw/zinc/25/23/15/1136252315.db2.gz DJYMEQHCTGQXKG-QGZVFWFLSA-N 1 1 346.478 3.834 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1CCOCC1 ZINC000850492409 1136271130 /nfs/dbraw/zinc/27/11/30/1136271130.db2.gz BETIMSULYVODSH-BONVTDFDSA-N 1 1 348.270 3.791 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccc(N2CCCCC2)cc1 ZINC000850498887 1136272277 /nfs/dbraw/zinc/27/22/77/1136272277.db2.gz FGMLYYPLDHLZSS-RVKKMQEKSA-N 1 1 325.460 3.625 20 10 EHCDMO C[C@@H]([NH2+]CCO[C@H]1CC1(F)F)c1cc(Cl)c(Cl)cc1O ZINC000850521165 1136276581 /nfs/dbraw/zinc/27/65/81/1136276581.db2.gz OJSNRSICMNVIPC-KRTXAFLBSA-N 1 1 326.170 3.774 20 10 EHCDMO C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000850581087 1136292092 /nfs/dbraw/zinc/29/20/92/1136292092.db2.gz CXRUYMRDEOKKDH-SUMWQHHRSA-N 1 1 332.463 3.791 20 10 EHCDMO CCOCc1cc(CN[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1OC ZINC000747854588 1136326425 /nfs/dbraw/zinc/32/64/25/1136326425.db2.gz PYWHFEQCZCRIIB-FGTMMUONSA-N 1 1 348.531 3.688 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](C)CN2C[C@H](C)C[C@H](C)C2)ccc1OC ZINC000747854588 1136326428 /nfs/dbraw/zinc/32/64/28/1136326428.db2.gz PYWHFEQCZCRIIB-FGTMMUONSA-N 1 1 348.531 3.688 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccc(F)c1F)C[C@@H]1CCCO1 ZINC000109761550 1136339470 /nfs/dbraw/zinc/33/94/70/1136339470.db2.gz JYFWWFJMSAAIAI-INIZCTEOSA-N 1 1 333.378 3.852 20 10 EHCDMO CC[N@@H+](Cc1cccc(F)n1)Cc1cc(Br)ccc1O ZINC000851791934 1136407546 /nfs/dbraw/zinc/40/75/46/1136407546.db2.gz FPHCRBYKKQETHR-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1O ZINC000852760020 1136483648 /nfs/dbraw/zinc/48/36/48/1136483648.db2.gz UFZVSZKXGXHGLV-KDURUIRLSA-N 1 1 349.858 3.641 20 10 EHCDMO COc1cc(C)cc(C[N@H+](C)Cc2cc(OC)c(OC)cc2C)c1O ZINC000111702605 1136572881 /nfs/dbraw/zinc/57/28/81/1136572881.db2.gz FWRWIEASGOKQEV-UHFFFAOYSA-N 1 1 345.439 3.667 20 10 EHCDMO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H](C)c2ccc(C)cc2O)cc1 ZINC000854224142 1136599731 /nfs/dbraw/zinc/59/97/31/1136599731.db2.gz KSEKWPGARJQAKI-YSSFQJQWSA-N 1 1 340.467 3.506 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000815593553 1136615855 /nfs/dbraw/zinc/61/58/55/1136615855.db2.gz PXJQIYDONMFSMZ-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO CO[C@@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(F)(F)F ZINC000815605366 1136622387 /nfs/dbraw/zinc/62/23/87/1136622387.db2.gz RYKUSFDKFHGDAX-XCBNKYQSSA-N 1 1 331.256 3.639 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1cc[nH]c(=O)c1 ZINC000815642716 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329.875 3.683 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817944377 1136849256 /nfs/dbraw/zinc/84/92/56/1136849256.db2.gz ZZNYHCXFQOTMQK-MOPGFXCFSA-N 1 1 329.875 3.683 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000818356703 1136875846 /nfs/dbraw/zinc/87/58/46/1136875846.db2.gz PVBFUAMMNGDZJK-RKDXNWHRSA-N 1 1 340.832 3.701 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C)[nH]1 ZINC000857757271 1136905734 /nfs/dbraw/zinc/90/57/34/1136905734.db2.gz AJRQHQQFDIOOHI-UHFFFAOYSA-N 1 1 339.483 3.937 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C)[nH]1 ZINC000857757271 1136905736 /nfs/dbraw/zinc/90/57/36/1136905736.db2.gz AJRQHQQFDIOOHI-UHFFFAOYSA-N 1 1 339.483 3.937 20 10 EHCDMO COc1ccccc1C1([NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000858181996 1136947395 /nfs/dbraw/zinc/94/73/95/1136947395.db2.gz CUQHVMKJLAYHTE-UHFFFAOYSA-N 1 1 332.394 3.818 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@H]1C1CCOCC1)CCC2 ZINC000819905357 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342.468 3.637 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)cc1Cl ZINC000825955786 1137674208 /nfs/dbraw/zinc/67/42/08/1137674208.db2.gz RZGYORNUNRFZES-ZDUSSCGKSA-N 1 1 326.227 3.651 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000877544736 1137680639 /nfs/dbraw/zinc/68/06/39/1137680639.db2.gz VPUALRKQWHOQQY-NRFANRHFSA-N 1 1 325.452 3.518 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@@H](C(F)(F)F)CC2)ccc2ccccc21 ZINC000877821766 1137691731 /nfs/dbraw/zinc/69/17/31/1137691731.db2.gz NABPHCXMRYOELT-OAHLLOKOSA-N 1 1 325.330 3.699 20 10 EHCDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Br)cc(F)c2O)s1 ZINC000883193750 1137848098 /nfs/dbraw/zinc/84/80/98/1137848098.db2.gz DKRDFRIOWAGABP-SSDOTTSWSA-N 1 1 345.237 3.910 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1cccs1 ZINC000883289335 1137852849 /nfs/dbraw/zinc/85/28/49/1137852849.db2.gz LEKPYGSKORAYES-GOSISDBHSA-N 1 1 329.513 3.741 20 10 EHCDMO C[C@H]([NH2+]Cc1ccccc1CN1CCCC1=O)c1c(O)cccc1F ZINC000886501222 1138084591 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C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc(C(F)(F)F)cs1 ZINC000274557266 1014229410 /nfs/dbraw/zinc/22/94/10/1014229410.db2.gz FIPITZJQYGOGBL-SECBINFHSA-N 1 1 328.359 3.948 20 10 EHCDMO COc1cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c(O)cc1C ZINC000160291911 1017202102 /nfs/dbraw/zinc/20/21/02/1017202102.db2.gz GJWJPULAPVGWQY-VLIAUNLRSA-N 1 1 345.414 3.810 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@H](c3ccccc3F)C1)CCC2 ZINC000066794225 1018013976 /nfs/dbraw/zinc/01/39/76/1018013976.db2.gz LZLFVXJAGTVKLC-FQEVSTJZSA-N 1 1 327.399 3.594 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3ccccc3F)C1)CCC2 ZINC000066794225 1018013991 /nfs/dbraw/zinc/01/39/91/1018013991.db2.gz LZLFVXJAGTVKLC-FQEVSTJZSA-N 1 1 327.399 3.594 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@@H](c3cccc(F)c3)C1)CCC2 ZINC000066794530 1018029342 /nfs/dbraw/zinc/02/93/42/1018029342.db2.gz KXAJWDPYIALJED-HXUWFJFHSA-N 1 1 327.399 3.594 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3cccc(F)c3)C1)CCC2 ZINC000066794530 1018029353 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CCCN(CCC)c1ccc(C[NH2+]Cc2nnc(C(C)C)[nH]2)cc1 ZINC000294884345 1023120459 /nfs/dbraw/zinc/12/04/59/1023120459.db2.gz VVLUJTKDYRZEEV-UHFFFAOYSA-N 1 1 329.492 3.844 20 10 EHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c(OC)c2O)C1 ZINC000892197831 1025372585 /nfs/dbraw/zinc/37/25/85/1025372585.db2.gz YKTARHAMEQJCKQ-KGLIPLIRSA-N 1 1 325.474 3.515 20 10 EHCDMO COCC[C@@H]([NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O)c1ccc(C)o1 ZINC000273384712 1027405871 /nfs/dbraw/zinc/40/58/71/1027405871.db2.gz CQRHLCZFOCJOSY-XJKSGUPXSA-N 1 1 347.411 3.509 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](Cc3nc(C)cs3)C2)c1O ZINC000897301573 1027410524 /nfs/dbraw/zinc/41/05/24/1027410524.db2.gz MVHAZBPWWOWYLK-CQSZACIVSA-N 1 1 332.469 3.539 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000273426686 1027422606 /nfs/dbraw/zinc/42/26/06/1027422606.db2.gz ULEZLOZYVSWCFD-QWHCGFSZSA-N 1 1 329.396 3.599 20 10 EHCDMO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cc(OC)c1OC ZINC000273441946 1027428649 /nfs/dbraw/zinc/42/86/49/1027428649.db2.gz YVYZXBXSJDKFAI-NWDGAFQWSA-N 1 1 349.402 3.969 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1ccc(F)cc1O ZINC000273467857 1027442350 /nfs/dbraw/zinc/44/23/50/1027442350.db2.gz JGOHQMYZXQVLEH-OCCSQVGLSA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(Br)cc1O ZINC000273500948 1027462272 /nfs/dbraw/zinc/46/22/72/1027462272.db2.gz QCBOZNIIJVSEAG-TVQRCGJNSA-N 1 1 336.233 3.606 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000273584242 1027505426 /nfs/dbraw/zinc/50/54/26/1027505426.db2.gz NHRAEBHFSGGVLF-PIGZYNQJSA-N 1 1 329.371 3.656 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](c3noc(C4CC4)n3)C2)c1O ZINC000271813593 1029185326 /nfs/dbraw/zinc/18/53/26/1029185326.db2.gz MKSGUPCQBYLERH-CYBMUJFWSA-N 1 1 347.846 3.994 20 10 EHCDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093706020 1029396161 /nfs/dbraw/zinc/39/61/61/1029396161.db2.gz VMKMXICKOBZUQY-INIZCTEOSA-N 1 1 330.497 3.648 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000278494566 1031104416 /nfs/dbraw/zinc/10/44/16/1031104416.db2.gz MAFILSGFHCRGNG-PXAZEXFGSA-N 1 1 342.395 3.722 20 10 EHCDMO Cc1ncccc1C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000527988033 1031604761 /nfs/dbraw/zinc/60/47/61/1031604761.db2.gz RHSDYVYNWKOKJC-JTQLQIEISA-N 1 1 339.208 3.848 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[O-] ZINC000195136720 1032047855 /nfs/dbraw/zinc/04/78/55/1032047855.db2.gz TVTGWUHIIANSEE-WBVHZDCISA-N 1 1 328.431 3.704 20 10 EHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071215 1033322675 /nfs/dbraw/zinc/32/26/75/1033322675.db2.gz HMTHNXAQDBSDBL-SNVBAGLBSA-N 1 1 326.824 3.706 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071215 1033322689 /nfs/dbraw/zinc/32/26/89/1033322689.db2.gz HMTHNXAQDBSDBL-SNVBAGLBSA-N 1 1 326.824 3.706 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cnn(CC2CCC2)c1 ZINC000898181456 1033381969 /nfs/dbraw/zinc/38/19/69/1033381969.db2.gz HTBONCOKWYMIQQ-ZDUSSCGKSA-N 1 1 348.441 3.878 20 10 EHCDMO CCC(CC)(CNC(=O)OC(C)(C)C)[NH2+]Cc1cccc(F)c1O ZINC000310051423 1034203651 /nfs/dbraw/zinc/20/36/51/1034203651.db2.gz JXLRCBJJPFCCFP-UHFFFAOYSA-N 1 1 340.439 3.704 20 10 EHCDMO C[C@H]([NH2+]CC1(NC(=O)OC(C)(C)C)CCC1)c1ccc(F)cc1O ZINC000310056462 1034211031 /nfs/dbraw/zinc/21/10/31/1034211031.db2.gz LMNBUPWNPXNRCM-LBPRGKRZSA-N 1 1 338.423 3.629 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c1O ZINC000761196070 1034401539 /nfs/dbraw/zinc/40/15/39/1034401539.db2.gz VGAXDKSSYQXANS-SFHVURJKSA-N 1 1 347.842 3.800 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccccc3C)C2)c1O ZINC000761202787 1034406948 /nfs/dbraw/zinc/40/69/48/1034406948.db2.gz LUGCYESHSMGABB-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccccc3C)C2)c1O ZINC000761202787 1034406956 /nfs/dbraw/zinc/40/69/56/1034406956.db2.gz LUGCYESHSMGABB-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO Oc1c(Cl)cc(Cl)cc1CNc1ccc2c(c1)OCC[NH2+]C2 ZINC000530180653 1035035099 /nfs/dbraw/zinc/03/50/99/1035035099.db2.gz BJQQHCJGJAGVSS-UHFFFAOYSA-N 1 1 339.222 3.793 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000164431898 1035609137 /nfs/dbraw/zinc/60/91/37/1035609137.db2.gz MIJOBXRKWGHJQS-CRAIPNDOSA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000164431898 1035609146 /nfs/dbraw/zinc/60/91/46/1035609146.db2.gz MIJOBXRKWGHJQS-CRAIPNDOSA-N 1 1 327.424 3.671 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1nc(-c2cccc(F)c2)no1 ZINC000190040454 1036186467 /nfs/dbraw/zinc/18/64/67/1036186467.db2.gz FSRSBAWBZOWUIV-SNVBAGLBSA-N 1 1 331.322 3.571 20 10 EHCDMO CC[N@@H+](Cc1ncc(C)s1)Cc1cc(Br)ccc1O ZINC000180524278 1036921353 /nfs/dbraw/zinc/92/13/53/1036921353.db2.gz GKFXHJKIASUFLM-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO CC[N@H+](Cc1ncc(C)s1)Cc1cc(Br)ccc1O ZINC000180524278 1036921349 /nfs/dbraw/zinc/92/13/49/1036921349.db2.gz GKFXHJKIASUFLM-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c(O)cc1C ZINC000905679918 1039035734 /nfs/dbraw/zinc/03/57/34/1039035734.db2.gz ZHTQHDDILICTQZ-CQSZACIVSA-N 1 1 333.325 3.576 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@]3(C)COC(=O)N3)C2)cc1C(C)C ZINC000905707664 1039045303 /nfs/dbraw/zinc/04/53/03/1039045303.db2.gz LBAFMEJAWIKPDI-UZLBHIALSA-N 1 1 346.471 3.535 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1O ZINC000905733514 1039068095 /nfs/dbraw/zinc/06/80/95/1039068095.db2.gz IRMRZTLINLQJQK-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164230425 1041222669 /nfs/dbraw/zinc/22/26/69/1041222669.db2.gz MXFUDQSGDMNJKF-IAGOWNOFSA-N 1 1 332.488 3.526 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c(O)c1OC ZINC000893684589 1043872047 /nfs/dbraw/zinc/87/20/47/1043872047.db2.gz DIOQVDPBSWBLDL-PWSUYJOCSA-N 1 1 333.350 3.572 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000186003122 1127220659 /nfs/dbraw/zinc/22/06/59/1127220659.db2.gz BSAJDVLRJGRUAR-HWPZZCPQSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H](NC[C@@H](C1CC1)[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765145470 1127580013 /nfs/dbraw/zinc/58/00/13/1127580013.db2.gz DPVOSYFEBDHZIE-YWZLYKJASA-N 1 1 333.495 3.807 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cncc(Br)c2)cc1 ZINC000172188793 1127802698 /nfs/dbraw/zinc/80/26/98/1127802698.db2.gz JCBHNUVSFSJYGP-UHFFFAOYSA-N 1 1 334.261 3.542 20 10 EHCDMO CCCC[N@H+](Cc1nccn1CC(F)(F)F)Cc1ccccc1O ZINC000282322046 1128993510 /nfs/dbraw/zinc/99/35/10/1128993510.db2.gz AELTWBQZLNWFBR-UHFFFAOYSA-N 1 1 341.377 3.953 20 10 EHCDMO CCCC[N@@H+](Cc1nccn1CC(F)(F)F)Cc1ccccc1O ZINC000282322046 1128993512 /nfs/dbraw/zinc/99/35/12/1128993512.db2.gz AELTWBQZLNWFBR-UHFFFAOYSA-N 1 1 341.377 3.953 20 10 EHCDMO CC(C)(C)c1cc(C[N@H+]2CCC[C@H](C(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000915829743 1121681305 /nfs/dbraw/zinc/68/13/05/1121681305.db2.gz GPZRSBHIOALRDG-AWEZNQCLSA-N 1 1 346.515 3.685 20 10 EHCDMO Cc1cc(C(=O)N2CC[NH+](C)CC2)c(C)n1-c1cccc(C(C)C)c1 ZINC000916093723 1122045658 /nfs/dbraw/zinc/04/56/58/1122045658.db2.gz VDVXJBGSLFEXTI-UHFFFAOYSA-N 1 1 339.483 3.605 20 10 EHCDMO CC(C)N(C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)C(C)C ZINC000917075157 1122472134 /nfs/dbraw/zinc/47/21/34/1122472134.db2.gz QTYSHZBQDBGTNX-UHFFFAOYSA-N 1 1 333.520 3.608 20 10 EHCDMO CCOc1ccccc1C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000917090080 1122487923 /nfs/dbraw/zinc/48/79/23/1122487923.db2.gz ZQJWCLYIHCZLPN-UHFFFAOYSA-N 1 1 340.467 3.806 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2csc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000918021892 1122731186 /nfs/dbraw/zinc/73/11/86/1122731186.db2.gz SPBACBGMKJHOET-UHFFFAOYSA-N 1 1 331.441 3.887 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000918021892 1122731190 /nfs/dbraw/zinc/73/11/90/1122731190.db2.gz SPBACBGMKJHOET-UHFFFAOYSA-N 1 1 331.441 3.887 20 10 EHCDMO COc1ccc(N2CC[NH+]([C@@H](C)c3ccc(F)c(F)c3)CC2)cc1 ZINC000918734806 1122900802 /nfs/dbraw/zinc/90/08/02/1122900802.db2.gz DXGSTKMWEUDYRB-AWEZNQCLSA-N 1 1 332.394 3.857 20 10 EHCDMO Cc1cccc2c1C[N@@H+](Cc1ccc(N3CCOCC3)c(F)c1)CC2 ZINC000763509004 1125212247 /nfs/dbraw/zinc/21/22/47/1125212247.db2.gz WZSLWAHLDJEDQB-UHFFFAOYSA-N 1 1 340.442 3.529 20 10 EHCDMO CN(CC[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O)c1ccccc1 ZINC000730804004 1130739134 /nfs/dbraw/zinc/73/91/34/1130739134.db2.gz PCNOMNCHSFJJCZ-UHFFFAOYSA-N 1 1 342.483 3.964 20 10 EHCDMO COC(=O)c1coc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000732204247 1130899812 /nfs/dbraw/zinc/89/98/12/1130899812.db2.gz GTODJJKBLXOMBL-UHFFFAOYSA-N 1 1 329.396 3.717 20 10 EHCDMO C[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1cc2c(cc1O)CCC2 ZINC000732526884 1130932055 /nfs/dbraw/zinc/93/20/55/1130932055.db2.gz UOTNLUFOCLZLOF-UHFFFAOYSA-N 1 1 333.435 3.699 20 10 EHCDMO Cc1cc(C(=O)NC[C@H]2CCC[N@@H+]2C)c(C)n1-c1ccc(Cl)cc1 ZINC000733169495 1131003648 /nfs/dbraw/zinc/00/36/48/1131003648.db2.gz VSPCQGFPDSGOHX-QGZVFWFLSA-N 1 1 345.874 3.572 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCOC[C@H]3CC(C)C)c2c1 ZINC000733790095 1131080273 /nfs/dbraw/zinc/08/02/73/1131080273.db2.gz FQMIGQFFBTWONV-MRXNPFEDSA-N 1 1 329.440 3.801 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1C ZINC000740856035 1131549381 /nfs/dbraw/zinc/54/93/81/1131549381.db2.gz LVODNHPNGIERLS-NVXWUHKLSA-N 1 1 348.487 3.744 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)NC2CCC(C)CC2)cc1 ZINC000741678171 1131634627 /nfs/dbraw/zinc/63/46/27/1131634627.db2.gz KWPUPCQYRXQTDU-UHFFFAOYSA-N 1 1 345.531 3.660 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)NC2CCC(C)CC2)cc1 ZINC000741678171 1131634630 /nfs/dbraw/zinc/63/46/30/1131634630.db2.gz KWPUPCQYRXQTDU-UHFFFAOYSA-N 1 1 345.531 3.660 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)C(=O)NC2CCCCC2)cc1 ZINC000741678064 1131634684 /nfs/dbraw/zinc/63/46/84/1131634684.db2.gz IUBPRRBWSPTQRN-QGZVFWFLSA-N 1 1 345.531 3.802 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2c(O)c(C(=O)OC)cc3ccccc32)CCS1 ZINC000743397604 1131911474 /nfs/dbraw/zinc/91/14/74/1131911474.db2.gz OOTPNOSSWLOMOK-AWEZNQCLSA-N 1 1 345.464 3.659 20 10 EHCDMO C[C@@H]1CC[C@H]([N@H+]2CCc3cccc(O)c3C2)CN1C(=O)OC(C)(C)C ZINC001173073986 1131955831 /nfs/dbraw/zinc/95/58/31/1131955831.db2.gz FSGXZMSSUFJIFF-ZBFHGGJFSA-N 1 1 346.471 3.538 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)NCc1ccccc1C ZINC000743869899 1131995763 /nfs/dbraw/zinc/99/57/63/1131995763.db2.gz FSLBXEZXHITONJ-KRWDZBQOSA-N 1 1 340.467 3.618 20 10 EHCDMO COc1ccc(Br)c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001177586967 1133083217 /nfs/dbraw/zinc/08/32/17/1133083217.db2.gz QKEBNNGXENQKIT-UHFFFAOYSA-N 1 1 348.240 3.682 20 10 EHCDMO C[N@H+](CC(=O)Nc1ccccc1Cl)Cc1cc(Cl)ccc1O ZINC000768168979 1133104569 /nfs/dbraw/zinc/10/45/69/1133104569.db2.gz BCFOWHGLGSEEMX-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO C[N@@H+](CC(=O)Nc1ccccc1Cl)Cc1cc(Cl)ccc1O ZINC000768168979 1133104573 /nfs/dbraw/zinc/10/45/73/1133104573.db2.gz BCFOWHGLGSEEMX-UHFFFAOYSA-N 1 1 339.222 3.770 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c(O)c1 ZINC000768207784 1133108055 /nfs/dbraw/zinc/10/80/55/1133108055.db2.gz IUQUYTIAOIJVRF-UHFFFAOYSA-N 1 1 337.423 3.609 20 10 EHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2c(O)cccc2OC)c(OC)c1 ZINC000768205973 1133108094 /nfs/dbraw/zinc/10/80/94/1133108094.db2.gz CSIXAMNAFUKUGA-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO CO[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1Cl ZINC001177999191 1133123022 /nfs/dbraw/zinc/12/30/22/1133123022.db2.gz ACVRRDXKBWCKFS-HNNXBMFYSA-N 1 1 327.758 3.801 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)[C@@H](O)CO2 ZINC000768440923 1133139602 /nfs/dbraw/zinc/13/96/02/1133139602.db2.gz HUHGMJDTKWGKMS-AEFFLSMTSA-N 1 1 345.826 3.809 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1O ZINC000768554238 1133155110 /nfs/dbraw/zinc/15/51/10/1133155110.db2.gz FQLJVUXWSYMCPY-SFHVURJKSA-N 1 1 342.414 3.810 20 10 EHCDMO CC[C@H]1CCC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000768847346 1133191873 /nfs/dbraw/zinc/19/18/73/1133191873.db2.gz UCAXUMBXQCMDQZ-NSHDSACASA-N 1 1 328.250 3.785 20 10 EHCDMO COc1cccc(C[N@@H+](C)CCCOc2ccc(Cl)cc2)c1O ZINC000768922003 1133203774 /nfs/dbraw/zinc/20/37/74/1133203774.db2.gz KPLCCRVJDVJHAM-UHFFFAOYSA-N 1 1 335.831 3.955 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@@H](C)[C@H]2C)c1O ZINC000769221877 1133245903 /nfs/dbraw/zinc/24/59/03/1133245903.db2.gz FZPVPJCSNYVICQ-GHMZBOCLSA-N 1 1 328.250 3.784 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccccc2OC)c(O)c1 ZINC000769326913 1133262529 /nfs/dbraw/zinc/26/25/29/1133262529.db2.gz QVXNRZMKIANVPA-HNNXBMFYSA-N 1 1 329.440 3.863 20 10 EHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769405732 1133277984 /nfs/dbraw/zinc/27/79/84/1133277984.db2.gz XEINQSLVGBPDCL-SZVBFZGTSA-N 1 1 332.463 3.815 20 10 EHCDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3c(O)cccc3OC)C2)cc1 ZINC000769394112 1133285630 /nfs/dbraw/zinc/28/56/30/1133285630.db2.gz ISNYCVXTLJFIGX-KRWDZBQOSA-N 1 1 341.451 3.864 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)ccc2O)CC[C@H]1NC(=O)OC(C)(C)C ZINC000769485711 1133289256 /nfs/dbraw/zinc/28/92/56/1133289256.db2.gz NZTIFHWAIWJUMW-DOTOQJQBSA-N 1 1 348.487 3.826 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c1O ZINC000769445632 1133291522 /nfs/dbraw/zinc/29/15/22/1133291522.db2.gz JDBTTZHLJKPEHK-QWRGUYRKSA-N 1 1 328.250 3.784 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3C)C2)c(O)c1 ZINC000769446708 1133291813 /nfs/dbraw/zinc/29/18/13/1133291813.db2.gz RRZFDIPPHOHRRD-HXUWFJFHSA-N 1 1 327.424 3.673 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000769473202 1133299001 /nfs/dbraw/zinc/29/90/01/1133299001.db2.gz MBFPFKWUTIJYPZ-BFUOFWGJSA-N 1 1 331.387 3.502 20 10 EHCDMO C[N@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514988 1133307422 /nfs/dbraw/zinc/30/74/22/1133307422.db2.gz MZBSPYWGRGCWMK-OAQYLSRUSA-N 1 1 341.543 3.841 20 10 EHCDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514988 1133307424 /nfs/dbraw/zinc/30/74/24/1133307424.db2.gz MZBSPYWGRGCWMK-OAQYLSRUSA-N 1 1 341.543 3.841 20 10 EHCDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2c(O)cccc2OC)cc1 ZINC000769519246 1133308229 /nfs/dbraw/zinc/30/82/29/1133308229.db2.gz MVWSDOWJPPDSIL-HNNXBMFYSA-N 1 1 329.440 3.720 20 10 EHCDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2CNC(=O)OC(C)(C)C)c(O)c1 ZINC001180235549 1133349039 /nfs/dbraw/zinc/34/90/39/1133349039.db2.gz YRXWSSCTHFYURZ-DOTOQJQBSA-N 1 1 348.487 3.826 20 10 EHCDMO Clc1cnc(C[NH2+]Cc2ccc(N3CCSCC3)cc2)s1 ZINC000769909292 1133357765 /nfs/dbraw/zinc/35/77/65/1133357765.db2.gz LIWWQRVTKLZLKG-UHFFFAOYSA-N 1 1 339.917 3.640 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(OC)c(OC)c1F ZINC001180480007 1133374553 /nfs/dbraw/zinc/37/45/53/1133374553.db2.gz VHYSHLZWMWXTBE-UHFFFAOYSA-N 1 1 346.446 3.931 20 10 EHCDMO CCc1cccc(C[N@H+]2CCC[C@@H]2C(=O)OCc2ccccc2)c1O ZINC001180541094 1133389928 /nfs/dbraw/zinc/38/99/28/1133389928.db2.gz ZNRWSTAUOOBATC-LJQANCHMSA-N 1 1 339.435 3.662 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c1 ZINC000770306251 1133409110 /nfs/dbraw/zinc/40/91/10/1133409110.db2.gz XNIMTYKKFIRAGC-LJQANCHMSA-N 1 1 341.451 3.625 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000770376654 1133415999 /nfs/dbraw/zinc/41/59/99/1133415999.db2.gz WRDGNDAVQVWISN-VQTJNVASSA-N 1 1 328.500 3.925 20 10 EHCDMO CC[N@@H+](Cc1cccc(Br)c1)Cc1ccc(O)cc1O ZINC001204281513 1133418570 /nfs/dbraw/zinc/41/85/70/1133418570.db2.gz SZAYCHBKBCYDTJ-UHFFFAOYSA-N 1 1 336.229 3.882 20 10 EHCDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccccc1O ZINC000770508760 1133436305 /nfs/dbraw/zinc/43/63/05/1133436305.db2.gz GZOMOJFJYXTEIC-UHFFFAOYSA-N 1 1 339.414 3.986 20 10 EHCDMO CCc1cccc(C[N@H+]2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)c1O ZINC001181284526 1133474980 /nfs/dbraw/zinc/47/49/80/1133474980.db2.gz CGFIYTHQCFMFOQ-OALUTQOASA-N 1 1 339.435 3.833 20 10 EHCDMO C[C@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000774211120 1133635669 /nfs/dbraw/zinc/63/56/69/1133635669.db2.gz CRQCXOKKKNVOBW-BONVTDFDSA-N 1 1 349.327 3.787 20 10 EHCDMO C[C@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000774211123 1133635749 /nfs/dbraw/zinc/63/57/49/1133635749.db2.gz CRQCXOKKKNVOBW-ZUZCIYMTSA-N 1 1 349.327 3.787 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774220377 1133641133 /nfs/dbraw/zinc/64/11/33/1133641133.db2.gz XTZYJKYWAJTUAF-OUAUKWLOSA-N 1 1 329.271 3.975 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nc2ccccc2c(=O)[nH]1 ZINC000774480392 1133687297 /nfs/dbraw/zinc/68/72/97/1133687297.db2.gz BMAZOJDPMJAINR-UONOGXRCSA-N 1 1 336.439 3.813 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@](O)(c3ccccc3)C2)c1 ZINC001182910319 1133749225 /nfs/dbraw/zinc/74/92/25/1133749225.db2.gz MUOZWLIRFCWJFL-OAQYLSRUSA-N 1 1 325.452 3.999 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1cc(F)cc(F)c1O ZINC000787025740 1133939242 /nfs/dbraw/zinc/93/92/42/1133939242.db2.gz LVMXLLKYUSPVIH-ANRSDYALSA-N 1 1 345.748 3.847 20 10 EHCDMO CC[C@H]([NH2+]Cc1cccc(C(=O)NC2CC2)c1)c1ccc(F)cc1O ZINC000796731610 1133987836 /nfs/dbraw/zinc/98/78/36/1133987836.db2.gz XWAGWKOJKVYMOE-SFHVURJKSA-N 1 1 342.414 3.664 20 10 EHCDMO CCC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774821831 1134033028 /nfs/dbraw/zinc/03/30/28/1134033028.db2.gz GXEYBRSIUFIQAZ-UHFFFAOYSA-N 1 1 330.384 3.721 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774821831 1134033034 /nfs/dbraw/zinc/03/30/34/1134033034.db2.gz GXEYBRSIUFIQAZ-UHFFFAOYSA-N 1 1 330.384 3.721 20 10 EHCDMO CC[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000774942664 1134140271 /nfs/dbraw/zinc/14/02/71/1134140271.db2.gz RFRDIDBLTZUKQH-ZDUSSCGKSA-N 1 1 330.384 3.592 20 10 EHCDMO CCn1cccc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)c1=O ZINC000788609565 1134145539 /nfs/dbraw/zinc/14/55/39/1134145539.db2.gz WAHVQSYCZKEALB-SNVBAGLBSA-N 1 1 341.238 3.731 20 10 EHCDMO C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788629214 1134153688 /nfs/dbraw/zinc/15/36/88/1134153688.db2.gz SENJEDGCETUGKH-ZETOZRRWSA-N 1 1 328.378 3.544 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000774997083 1134195273 /nfs/dbraw/zinc/19/52/73/1134195273.db2.gz KDFWLOGRCIGLOB-ZDUSSCGKSA-N 1 1 330.384 3.777 20 10 EHCDMO COc1c(O)c(C[NH2+]C2(c3ccc(Cl)cc3)CC2)ccc1[N+](=O)[O-] ZINC000775012343 1134203930 /nfs/dbraw/zinc/20/39/30/1134203930.db2.gz GLCIYAQUDKNCMR-UHFFFAOYSA-N 1 1 348.786 3.741 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCCN(c2ccccc2)C1 ZINC000790964844 1134486105 /nfs/dbraw/zinc/48/61/05/1134486105.db2.gz OEGUQKSKDDCRLF-ZDUSSCGKSA-N 1 1 334.822 3.943 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H](Cn1cccn1)c1ccccc1 ZINC000790970760 1134487669 /nfs/dbraw/zinc/48/76/69/1134487669.db2.gz FOTYJCINPDYSSP-INIZCTEOSA-N 1 1 345.805 3.912 20 10 EHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000775201202 1134511387 /nfs/dbraw/zinc/51/13/87/1134511387.db2.gz CMGGKYZTFVEGKR-QGZVFWFLSA-N 1 1 327.852 3.835 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H](N3CCCC3=O)C2)cc1 ZINC000792185129 1134665556 /nfs/dbraw/zinc/66/55/56/1134665556.db2.gz HSPKHKNGPWLPKZ-HXUWFJFHSA-N 1 1 343.515 3.510 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(-c3ccccc3C)no2)c1 ZINC000775363457 1134667260 /nfs/dbraw/zinc/66/72/60/1134667260.db2.gz LIHFUYJQFMTACM-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccnn2-c2ccc(F)cc2)cc1 ZINC000792761325 1134786433 /nfs/dbraw/zinc/78/64/33/1134786433.db2.gz LCHRGTWHQNQQSB-UHFFFAOYSA-N 1 1 338.430 3.709 20 10 EHCDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792834361 1134798693 /nfs/dbraw/zinc/79/86/93/1134798693.db2.gz HRFHDURRRIYNFR-CYBMUJFWSA-N 1 1 330.394 3.630 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c(C(F)(F)F)c1 ZINC000792843523 1134806280 /nfs/dbraw/zinc/80/62/80/1134806280.db2.gz ONOZGMWCJPSKEO-WMLDXEAASA-N 1 1 342.405 3.772 20 10 EHCDMO CC(=O)c1cc(F)cc(C[NH+]2CCC(CC(F)(F)F)CC2)c1O ZINC000792934162 1134828913 /nfs/dbraw/zinc/82/89/13/1134828913.db2.gz SRZPWPDGTLOLRH-UHFFFAOYSA-N 1 1 333.325 3.898 20 10 EHCDMO CC[C@@H]([NH2+]Cc1n[nH]cc1Br)c1cc(Cl)ccc1O ZINC000775510032 1134972162 /nfs/dbraw/zinc/97/21/62/1134972162.db2.gz UNUVKVDDRJRKPH-LLVKDONJSA-N 1 1 344.640 3.772 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1 ZINC000793614204 1134972987 /nfs/dbraw/zinc/97/29/87/1134972987.db2.gz OSSPXGAZCSSJSS-LSDHHAIUSA-N 1 1 330.255 3.807 20 10 EHCDMO Cc1cccc(C[N@H+](C)[C@H](c2cnn(C)c2)c2cccc(F)c2)c1O ZINC000775670505 1135466465 /nfs/dbraw/zinc/46/64/65/1135466465.db2.gz JTHXPOJEIIOSGB-IBGZPJMESA-N 1 1 339.414 3.795 20 10 EHCDMO Cc1cccc(C[N@H+](C)[C@@H](c2cnn(C)c2)c2cccc(F)c2)c1O ZINC000775670506 1135466642 /nfs/dbraw/zinc/46/66/42/1135466642.db2.gz JTHXPOJEIIOSGB-LJQANCHMSA-N 1 1 339.414 3.795 20 10 EHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701887 1135539250 /nfs/dbraw/zinc/53/92/50/1135539250.db2.gz OHUVFLGSJSFSFS-YFVAEKQCSA-N 1 1 327.516 3.591 20 10 EHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775701887 1135539253 /nfs/dbraw/zinc/53/92/53/1135539253.db2.gz OHUVFLGSJSFSFS-YFVAEKQCSA-N 1 1 327.516 3.591 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)c1O ZINC000775734409 1135588062 /nfs/dbraw/zinc/58/80/62/1135588062.db2.gz OPYGMWVSLAIIJD-HXUWFJFHSA-N 1 1 325.452 3.924 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000775739183 1135596913 /nfs/dbraw/zinc/59/69/13/1135596913.db2.gz MJXJLNZTSKVEAU-SJKOYZFVSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000775739183 1135596917 /nfs/dbraw/zinc/59/69/17/1135596917.db2.gz MJXJLNZTSKVEAU-SJKOYZFVSA-N 1 1 338.854 3.633 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000775739183 1135596920 /nfs/dbraw/zinc/59/69/20/1135596920.db2.gz MJXJLNZTSKVEAU-SJKOYZFVSA-N 1 1 338.854 3.633 20 10 EHCDMO C[C@H]([NH2+]Cc1nc(-c2cccs2)no1)c1ccc(N(C)C)cc1 ZINC000775830492 1135787519 /nfs/dbraw/zinc/78/75/19/1135787519.db2.gz KFTFOUWVZBPYMU-LBPRGKRZSA-N 1 1 328.441 3.715 20 10 EHCDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000809711051 1135875909 /nfs/dbraw/zinc/87/59/09/1135875909.db2.gz IFVUDTKEQIATLJ-QGZVFWFLSA-N 1 1 327.424 3.753 20 10 EHCDMO CCOc1ccc(C[N@@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)c(O)c1 ZINC000809775002 1135881973 /nfs/dbraw/zinc/88/19/73/1135881973.db2.gz WWQHKGDAXCEUMW-SJORKVTESA-N 1 1 343.467 3.777 20 10 EHCDMO C[NH+](C)CCN(Cc1cccs1)Cc1cc(Cl)cc(F)c1O ZINC000809745822 1135884478 /nfs/dbraw/zinc/88/44/78/1135884478.db2.gz GKPHFHXLFGEZKJ-UHFFFAOYSA-N 1 1 342.867 3.810 20 10 EHCDMO CSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2[O-])CC[NH+](C)CC1 ZINC000810252176 1135948921 /nfs/dbraw/zinc/94/89/21/1135948921.db2.gz KQTILLTYJZNONS-LBPRGKRZSA-N 1 1 328.909 3.524 20 10 EHCDMO CC(C)[N@@H+](C)C[C@H](C)NCc1ccc(OCc2ccccc2)cc1O ZINC000811512782 1136103331 /nfs/dbraw/zinc/10/33/31/1136103331.db2.gz SCUDDVXKYMJIRE-KRWDZBQOSA-N 1 1 342.483 3.790 20 10 EHCDMO CC(C)[N@H+](C)C[C@H](C)NCc1ccc(OCc2ccccc2)cc1O ZINC000811512782 1136103333 /nfs/dbraw/zinc/10/33/33/1136103333.db2.gz SCUDDVXKYMJIRE-KRWDZBQOSA-N 1 1 342.483 3.790 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1O ZINC000811778248 1136134164 /nfs/dbraw/zinc/13/41/64/1136134164.db2.gz JFNAQOFFFHDTEM-GFCCVEGCSA-N 1 1 349.377 3.809 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](n3cc(C)cn3)C2)c(O)c(C(C)(C)C)c1 ZINC000811800226 1136138484 /nfs/dbraw/zinc/13/84/84/1136138484.db2.gz MPFMNEZIPZNFEV-INIZCTEOSA-N 1 1 343.471 3.650 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1Cl ZINC000825537352 1136164986 /nfs/dbraw/zinc/16/49/86/1136164986.db2.gz WLLJLGLEEOBGDT-IBGZPJMESA-N 1 1 329.827 3.985 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@H](n3cccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000812295155 1136195863 /nfs/dbraw/zinc/19/58/63/1136195863.db2.gz XBYVLTDOCYGWDX-KRWDZBQOSA-N 1 1 327.472 3.896 20 10 EHCDMO COc1cc(CNC2CC[NH+](CC(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850024840 1136200313 /nfs/dbraw/zinc/20/03/13/1136200313.db2.gz FCRKPLWYBYOGGL-UHFFFAOYSA-N 1 1 348.531 3.908 20 10 EHCDMO COc1cc(C[NH2+]C2CCN(CC(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850024840 1136200316 /nfs/dbraw/zinc/20/03/16/1136200316.db2.gz FCRKPLWYBYOGGL-UHFFFAOYSA-N 1 1 348.531 3.908 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]23CCCN(C(=O)OC(C)(C)C)C3)c1 ZINC000812761632 1136239020 /nfs/dbraw/zinc/23/90/20/1136239020.db2.gz CZJAIEWANYAUCI-HXUWFJFHSA-N 1 1 346.471 3.676 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCOC(C)(C)C)c1 ZINC000850369382 1136242641 /nfs/dbraw/zinc/24/26/41/1136242641.db2.gz JEHRBRBJEYQOGJ-UHFFFAOYSA-N 1 1 330.266 3.758 20 10 EHCDMO COc1cc(C[NH2+]Cc2nccc(OC)c2F)c(O)c(C(C)(C)C)c1 ZINC000850380737 1136246081 /nfs/dbraw/zinc/24/60/81/1136246081.db2.gz KWCUYNIIIPWLLM-UHFFFAOYSA-N 1 1 348.418 3.531 20 10 EHCDMO COC[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1cccc(OC)c1 ZINC000850514028 1136274818 /nfs/dbraw/zinc/27/48/18/1136274818.db2.gz KSJUITLHZJHZRI-APPDUMDISA-N 1 1 337.366 3.717 20 10 EHCDMO CCOCc1cc(CNC[C@]2([NH+](C)C)CCC[C@@H](C)C2)ccc1OC ZINC000747854031 1136326195 /nfs/dbraw/zinc/32/61/95/1136326195.db2.gz LLDBLHCMBAAWDO-UTKZUKDTSA-N 1 1 348.531 3.832 20 10 EHCDMO C[C@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1ccc2ccccc2c1 ZINC000109770275 1136339657 /nfs/dbraw/zinc/33/96/57/1136339657.db2.gz GEYIJMKJTWEMDO-INIZCTEOSA-N 1 1 348.446 3.855 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815031421 1136542641 /nfs/dbraw/zinc/54/26/41/1136542641.db2.gz SXCRAEFEXOPALI-IEBWSBKVSA-N 1 1 345.531 3.578 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC4(CCC4)OC[C@H]3C)c2c1 ZINC000853542024 1136542803 /nfs/dbraw/zinc/54/28/03/1136542803.db2.gz KSKPSMZNLBQLSJ-CQSZACIVSA-N 1 1 327.424 3.697 20 10 EHCDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC2 ZINC000815075998 1136547720 /nfs/dbraw/zinc/54/77/20/1136547720.db2.gz RXQLHYXRNQEPDX-UHFFFAOYSA-N 1 1 336.479 3.864 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)ccc1N(C)C ZINC000815105792 1136556724 /nfs/dbraw/zinc/55/67/24/1136556724.db2.gz LNXZGLDUGXABHL-NRSPTQNISA-N 1 1 330.516 3.967 20 10 EHCDMO CCN(CC)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccco1 ZINC000816543710 1136731708 /nfs/dbraw/zinc/73/17/08/1136731708.db2.gz LFFCNKYFHZYWKT-HNNXBMFYSA-N 1 1 340.826 3.950 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCN1CC(F)(F)F ZINC000816522215 1136733147 /nfs/dbraw/zinc/73/31/47/1136733147.db2.gz OZNKBYMGFBWURN-ZDUSSCGKSA-N 1 1 338.373 3.614 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000816586596 1136734615 /nfs/dbraw/zinc/73/46/15/1136734615.db2.gz MKOORCBCJDYELH-AWEZNQCLSA-N 1 1 325.742 3.937 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC[C@@H]1COc2ccccc2O1 ZINC000816558453 1136736670 /nfs/dbraw/zinc/73/66/70/1136736670.db2.gz ZKXIJCTXXIAYOQ-GFCCVEGCSA-N 1 1 337.778 3.504 20 10 EHCDMO Oc1c(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)ccc2ccccc21 ZINC000816560294 1136736687 /nfs/dbraw/zinc/73/66/87/1136736687.db2.gz KTESDBSWQAWYOC-NRFANRHFSA-N 1 1 337.394 3.778 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC[C@H]1COc2ccccc2O1 ZINC000816558454 1136736948 /nfs/dbraw/zinc/73/69/48/1136736948.db2.gz ZKXIJCTXXIAYOQ-LBPRGKRZSA-N 1 1 337.778 3.504 20 10 EHCDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(Cl)c(F)cc1O ZINC000816601079 1136739848 /nfs/dbraw/zinc/73/98/48/1136739848.db2.gz QIRRCOMWIPDWGA-UHFFFAOYSA-N 1 1 338.766 3.767 20 10 EHCDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(Cl)c(F)cc1O ZINC000816601079 1136739849 /nfs/dbraw/zinc/73/98/49/1136739849.db2.gz QIRRCOMWIPDWGA-UHFFFAOYSA-N 1 1 338.766 3.767 20 10 EHCDMO OC[C@]1(c2ccccc2)CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816600593 1136739881 /nfs/dbraw/zinc/73/98/81/1136739881.db2.gz CCOPAIIXNYPBLH-IBGZPJMESA-N 1 1 349.833 3.711 20 10 EHCDMO OC[C@]1(c2ccccc2)CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816600593 1136739883 /nfs/dbraw/zinc/73/98/83/1136739883.db2.gz CCOPAIIXNYPBLH-IBGZPJMESA-N 1 1 349.833 3.711 20 10 EHCDMO COc1cc(Cl)cc(CN2CC[N@@H+](C)Cc3ccccc32)c1O ZINC000816617592 1136741623 /nfs/dbraw/zinc/74/16/23/1136741623.db2.gz DHFZPEOLLORFGY-UHFFFAOYSA-N 1 1 332.831 3.506 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccncc1 ZINC000816622028 1136742199 /nfs/dbraw/zinc/74/21/99/1136742199.db2.gz VJPZXNNSGRUUOR-HXUWFJFHSA-N 1 1 337.467 3.501 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)cc1 ZINC000816656139 1136745451 /nfs/dbraw/zinc/74/54/51/1136745451.db2.gz HARUUYLKBBFHKY-FQEVSTJZSA-N 1 1 328.500 3.924 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000817938256 1136847530 /nfs/dbraw/zinc/84/75/30/1136847530.db2.gz HNWOJODDCHVWBO-KPZWWZAWSA-N 1 1 335.854 3.896 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCc3c2cccc3Cl)cc1 ZINC000817939133 1136847970 /nfs/dbraw/zinc/84/79/70/1136847970.db2.gz ZJJZFUMHENEDBA-OALUTQOASA-N 1 1 329.875 3.683 20 10 EHCDMO CC(C)C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817941428 1136848417 /nfs/dbraw/zinc/84/84/17/1136848417.db2.gz JSFUBQRLUPXXIC-QUCCMNQESA-N 1 1 326.488 3.524 20 10 EHCDMO CCC(=O)Nc1cccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC000858098364 1136939623 /nfs/dbraw/zinc/93/96/23/1136939623.db2.gz KUEJGEXHRRZFDK-UHFFFAOYSA-N 1 1 347.409 3.669 20 10 EHCDMO CC[C@H]([NH2+]CC[C@@H](O)COCc1ccccc1)c1ccc(F)cc1O ZINC000858594319 1136981272 /nfs/dbraw/zinc/98/12/72/1136981272.db2.gz BZJYMWFLRIMKRR-MJGOQNOKSA-N 1 1 347.430 3.540 20 10 EHCDMO CN(Cc1cccs1)c1ccc(CN2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000823447042 1137099844 /nfs/dbraw/zinc/09/98/44/1137099844.db2.gz BRDIHJJRQLMOJZ-GOSISDBHSA-N 1 1 343.540 3.768 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000862023891 1137127423 /nfs/dbraw/zinc/12/74/23/1137127423.db2.gz KDJMAHOQZXSORT-IAGOWNOFSA-N 1 1 333.520 3.658 20 10 EHCDMO CC[C@@]1(O)CC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000824214874 1137128500 /nfs/dbraw/zinc/12/85/00/1137128500.db2.gz IKCHPUOCHYQHMY-LJQANCHMSA-N 1 1 330.497 3.731 20 10 EHCDMO CC[C@H](COCC(F)(F)F)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824554124 1137142551 /nfs/dbraw/zinc/14/25/51/1137142551.db2.gz BDWOZWYOCNMHIX-MRVPVSSYSA-N 1 1 329.721 3.632 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824696825 1137147124 /nfs/dbraw/zinc/14/71/24/1137147124.db2.gz UULXIVHCPJGUPR-DFBGVHRSSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824696825 1137147125 /nfs/dbraw/zinc/14/71/25/1137147125.db2.gz UULXIVHCPJGUPR-DFBGVHRSSA-N 1 1 327.827 3.700 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@@H]1C ZINC000824815692 1137153567 /nfs/dbraw/zinc/15/35/67/1137153567.db2.gz WYSJJCDQRHAGSZ-HRAATJIYSA-N 1 1 341.451 3.828 20 10 EHCDMO Cc1cnc(CC[N@H+](C)Cc2ccc(Br)cc2O)s1 ZINC000824894435 1137155879 /nfs/dbraw/zinc/15/58/79/1137155879.db2.gz FBFBQYQASBGPNX-UHFFFAOYSA-N 1 1 341.274 3.594 20 10 EHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1 ZINC000825321995 1137172871 /nfs/dbraw/zinc/17/28/71/1137172871.db2.gz UJZHVNINXJGTDX-ZDUSSCGKSA-N 1 1 342.277 3.712 20 10 EHCDMO Cc1cc(O)c(C[NH2+]Cc2nnc(C(C)(C)C)s2)cc1Cl ZINC000825336757 1137173457 /nfs/dbraw/zinc/17/34/57/1137173457.db2.gz DISKJHSEOPNKFL-UHFFFAOYSA-N 1 1 325.865 3.793 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000863302401 1137180503 /nfs/dbraw/zinc/18/05/03/1137180503.db2.gz KKLFDTJTIKVWHH-ZBFHGGJFSA-N 1 1 349.471 3.509 20 10 EHCDMO C[C@H](CCO)[N@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000844447670 1137220896 /nfs/dbraw/zinc/22/08/96/1137220896.db2.gz QWMKZPULAQJJKJ-OAHLLOKOSA-N 1 1 340.427 3.743 20 10 EHCDMO C[C@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000844447670 1137220897 /nfs/dbraw/zinc/22/08/97/1137220897.db2.gz QWMKZPULAQJJKJ-OAHLLOKOSA-N 1 1 340.427 3.743 20 10 EHCDMO C[N@@H+](Cc1cc(Br)c(F)cc1O)CC1CC(F)(F)C1 ZINC001144306593 1137270773 /nfs/dbraw/zinc/27/07/73/1137270773.db2.gz IELCJFHJIRNMHE-UHFFFAOYSA-N 1 1 338.167 3.771 20 10 EHCDMO C[N@H+](Cc1cc(Br)c(F)cc1O)CC1CC(F)(F)C1 ZINC001144306593 1137270774 /nfs/dbraw/zinc/27/07/74/1137270774.db2.gz IELCJFHJIRNMHE-UHFFFAOYSA-N 1 1 338.167 3.771 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000845971542 1137322221 /nfs/dbraw/zinc/32/22/21/1137322221.db2.gz LDGFEUJGZLHKCD-VIFPVBQESA-N 1 1 325.767 3.750 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000845973324 1137322682 /nfs/dbraw/zinc/32/26/82/1137322682.db2.gz YZUQNXNJBNRMDQ-VIFPVBQESA-N 1 1 325.767 3.750 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@](O)(c2ccc(Cl)cc2)C1 ZINC000846009462 1137325498 /nfs/dbraw/zinc/32/54/98/1137325498.db2.gz ACJULKNUMDGNIW-IBGZPJMESA-N 1 1 347.842 3.538 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](Cc2ccccc2)c2nccn2C)cc1C ZINC000846058558 1137327477 /nfs/dbraw/zinc/32/74/77/1137327477.db2.gz QOMZHTPEWCKTPK-IBGZPJMESA-N 1 1 335.451 3.811 20 10 EHCDMO COc1cccc([C@H](C)NC[C@H]2CCC[N@@H+]2C2CCCCC2)c1O ZINC000846167959 1137337503 /nfs/dbraw/zinc/33/75/03/1137337503.db2.gz PKFDGGKGCSDCLP-DOTOQJQBSA-N 1 1 332.488 3.849 20 10 EHCDMO COc1cccc([C@H](C)NC[C@H]2CCC[N@H+]2C2CCCCC2)c1O ZINC000846167959 1137337504 /nfs/dbraw/zinc/33/75/04/1137337504.db2.gz PKFDGGKGCSDCLP-DOTOQJQBSA-N 1 1 332.488 3.849 20 10 EHCDMO COc1cccc([C@@H](C)N[C@@H](C[NH+]2CCCC2)c2ccccc2)c1O ZINC000846136668 1137338258 /nfs/dbraw/zinc/33/82/58/1137338258.db2.gz MVVUJCBOIOWWLW-APWZRJJASA-N 1 1 340.467 3.889 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cc3cnccc3o2)c1 ZINC000866621805 1137370423 /nfs/dbraw/zinc/37/04/23/1137370423.db2.gz VIDPGLBFGVSBQU-RYUDHWBXSA-N 1 1 340.379 3.732 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000773009255 1137458686 /nfs/dbraw/zinc/45/86/86/1137458686.db2.gz NHRSEZSRHREKKG-UGSOOPFHSA-N 1 1 334.410 3.805 20 10 EHCDMO CC(C)(C)OC(=O)C1CCC([N@H+]2CCc3cccc(O)c3C2)CC1 ZINC001171931200 1137521454 /nfs/dbraw/zinc/52/14/54/1137521454.db2.gz YNBPNGXJZDRIDE-UHFFFAOYSA-N 1 1 331.456 3.651 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1)C(C)C ZINC000871200565 1137526621 /nfs/dbraw/zinc/52/66/21/1137526621.db2.gz GOLZEFMNLCPIOX-UHFFFAOYSA-N 1 1 338.451 3.779 20 10 EHCDMO CCC1([NH+]2CCCC2)CC[NH+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000872646812 1137582418 /nfs/dbraw/zinc/58/24/18/1137582418.db2.gz IWVGYQFBHIKBAC-UHFFFAOYSA-N 1 1 339.483 3.781 20 10 EHCDMO CCC1([NH+]2CCCC2)CCN(Cc2c(O)ccc3ccncc32)CC1 ZINC000872646812 1137582419 /nfs/dbraw/zinc/58/24/19/1137582419.db2.gz IWVGYQFBHIKBAC-UHFFFAOYSA-N 1 1 339.483 3.781 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1[N+](=O)[O-] ZINC000873183347 1137592952 /nfs/dbraw/zinc/59/29/52/1137592952.db2.gz HBEBGKPFJSYBTL-NSHDSACASA-N 1 1 335.354 3.790 20 10 EHCDMO C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1[O-] ZINC000873246110 1137595150 /nfs/dbraw/zinc/59/51/50/1137595150.db2.gz WYTIIOGWHJPLER-AAEUAGOBSA-N 1 1 341.293 3.584 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000876531274 1137654728 /nfs/dbraw/zinc/65/47/28/1137654728.db2.gz AWENODLQWSMJBQ-QGZVFWFLSA-N 1 1 327.424 3.587 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)c1ccccc1 ZINC000876682573 1137658881 /nfs/dbraw/zinc/65/88/81/1137658881.db2.gz JYSFUZJPNHIVSY-SFHVURJKSA-N 1 1 338.495 3.883 20 10 EHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876729937 1137659853 /nfs/dbraw/zinc/65/98/53/1137659853.db2.gz BCWMYIFQWBODQG-HXUWFJFHSA-N 1 1 348.556 3.755 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](C)C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000876795864 1137661543 /nfs/dbraw/zinc/66/15/43/1137661543.db2.gz WBHHOIOLBGTHSV-UHFFFAOYSA-N 1 1 348.487 3.968 20 10 EHCDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877474877 1137677599 /nfs/dbraw/zinc/67/75/99/1137677599.db2.gz IPOVTCWBFGMSAR-UHFFFAOYSA-N 1 1 342.458 3.727 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@@H](C)c1cccnc1 ZINC000877529970 1137679996 /nfs/dbraw/zinc/67/99/96/1137679996.db2.gz ARRGWOOCDAAVQA-KRWDZBQOSA-N 1 1 339.483 3.626 20 10 EHCDMO CC1CC(n2nnc3c2C[N@H+](Cc2ccc4ccccc4c2O)CC3)C1 ZINC000877692592 1137685982 /nfs/dbraw/zinc/68/59/82/1137685982.db2.gz JYVRPJYDESFPAC-UHFFFAOYSA-N 1 1 348.450 3.666 20 10 EHCDMO CC1CC(n2nnc3c2C[N@@H+](Cc2ccc4ccccc4c2O)CC3)C1 ZINC000877692592 1137685983 /nfs/dbraw/zinc/68/59/83/1137685983.db2.gz JYVRPJYDESFPAC-UHFFFAOYSA-N 1 1 348.450 3.666 20 10 EHCDMO COc1cc(-c2noc(C[NH2+][C@H](C)c3ccccc3O)n2)ccc1C ZINC000879648910 1137753556 /nfs/dbraw/zinc/75/35/56/1137753556.db2.gz FZACNASNVVGWJV-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO C[C@@H]([NH2+]Cc1nccn1Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000129430245 1137820556 /nfs/dbraw/zinc/82/05/56/1137820556.db2.gz LEWVEJUQWZEZRM-QGZVFWFLSA-N 1 1 334.467 3.848 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]CC1(c2ccccc2)CCOCC1 ZINC000882887966 1137836866 /nfs/dbraw/zinc/83/68/66/1137836866.db2.gz KWOYIEBADMLEPG-UHFFFAOYSA-N 1 1 333.378 3.508 20 10 EHCDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)CCO2 ZINC000883090990 1137844435 /nfs/dbraw/zinc/84/44/35/1137844435.db2.gz AGCOCWJDXJGKPQ-MRXNPFEDSA-N 1 1 335.350 3.683 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(OC)c(OC)c1 ZINC000883117119 1137845319 /nfs/dbraw/zinc/84/53/19/1137845319.db2.gz QWCZNVRVYYHICN-HNNXBMFYSA-N 1 1 337.366 3.929 20 10 EHCDMO CCc1cc(C[N@H+]2CCOC3(CCOCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000131264796 1137849575 /nfs/dbraw/zinc/84/95/75/1137849575.db2.gz ZGXUOJOEZNHDGH-UHFFFAOYSA-N 1 1 347.499 3.634 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000883289906 1137852914 /nfs/dbraw/zinc/85/29/14/1137852914.db2.gz DOKHFUWWECIWPV-QFIPXVFZSA-N 1 1 335.495 3.679 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000121017094 1137954418 /nfs/dbraw/zinc/95/44/18/1137954418.db2.gz KWASGUNPRFAHHO-MGPUTAFESA-N 1 1 339.483 3.506 20 10 EHCDMO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886528812 1138090658 /nfs/dbraw/zinc/09/06/58/1138090658.db2.gz RTSNNIKLADEQCJ-SCLBCKFNSA-N 1 1 333.403 3.703 20 10 EHCDMO CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2c(O)cccc2F)c2ccccc21 ZINC000886556744 1138095846 /nfs/dbraw/zinc/09/58/46/1138095846.db2.gz JJRHZYCRJWZMTF-LRDDRELGSA-N 1 1 328.387 3.680 20 10 EHCDMO COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)c3c(O)cccc3F)C2)cc1 ZINC000886627975 1138103609 /nfs/dbraw/zinc/10/36/09/1138103609.db2.gz BTBMBPKBUQSATG-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1c(O)cccc1F ZINC000886713348 1138123383 /nfs/dbraw/zinc/12/33/83/1138123383.db2.gz ZUWBRBCCIZIIQA-HUUCEWRRSA-N 1 1 337.435 3.548 20 10 EHCDMO Cc1ccc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3F)no2)c(O)c1 ZINC000886714136 1138123700 /nfs/dbraw/zinc/12/37/00/1138123700.db2.gz CJQUNNQDQLIWST-ZDUSSCGKSA-N 1 1 341.386 3.664 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cc1OC ZINC000179661250 1139772226 /nfs/dbraw/zinc/77/22/26/1139772226.db2.gz BHPDGYIJZOJPNY-NSHDSACASA-N 1 1 337.366 3.881 20 10 EHCDMO COc1ccc(O)c([C@H](C)N[C@H](C[NH+]2CCCC2)c2ccccc2)c1 ZINC000184919688 1140125953 /nfs/dbraw/zinc/12/59/53/1140125953.db2.gz UQOGDCNJDSDTDB-OXJNMPFZSA-N 1 1 340.467 3.889 20 10 EHCDMO COc1ccc(OC(F)F)c(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185700623 1140164967 /nfs/dbraw/zinc/16/49/67/1140164967.db2.gz GCRIZMXZJQQHLQ-JTQLQIEISA-N 1 1 341.329 3.992 20 10 EHCDMO COC(=O)CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185999049 1140181626 /nfs/dbraw/zinc/18/16/26/1140181626.db2.gz JAHSYKQTCJGOFB-GUYCJALGSA-N 1 1 331.387 3.876 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)cc1C ZINC000191593595 1140474328 /nfs/dbraw/zinc/47/43/28/1140474328.db2.gz KAWQKZFFIPUXQI-HNNXBMFYSA-N 1 1 337.423 3.834 20 10 EHCDMO C[C@@H]([NH2+]CCCO[C@@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000192951902 1140555845 /nfs/dbraw/zinc/55/58/45/1140555845.db2.gz NEVAKFYQEGKKMF-GHMZBOCLSA-N 1 1 334.243 3.545 20 10 EHCDMO C[C@H](OC[C@@H](O)C[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000269618397 1141127167 /nfs/dbraw/zinc/12/71/67/1141127167.db2.gz HIMVCSPJNHIHHR-KSSFIOAISA-N 1 1 349.858 3.616 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)c(O)c1 ZINC000271274381 1141337210 /nfs/dbraw/zinc/33/72/10/1141337210.db2.gz OCMHJFSYIQEWHQ-VQIMIIECSA-N 1 1 345.439 3.862 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644086 522866752 /nfs/dbraw/zinc/86/67/52/522866752.db2.gz RHZLUOHKCQRDTP-IUODEOHRSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1cc(Br)ccc1[O-] ZINC000037644086 522866759 /nfs/dbraw/zinc/86/67/59/522866759.db2.gz RHZLUOHKCQRDTP-IUODEOHRSA-N 1 1 341.293 3.537 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000821109272 945636400 /nfs/dbraw/zinc/63/64/00/945636400.db2.gz FIRQHWVMDLQIKG-CQSZACIVSA-N 1 1 337.427 3.546 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cnc(C2CC2)s1)C[C@H]1CCCO1 ZINC000160203428 1014356577 /nfs/dbraw/zinc/35/65/77/1014356577.db2.gz RMTBEXNUQOOUAP-MRXNPFEDSA-N 1 1 344.480 3.907 20 10 EHCDMO Cn1ccc([C@@H]([NH2+]Cc2ccccc2O)c2ccc(Cl)cc2)n1 ZINC000376897344 1017187070 /nfs/dbraw/zinc/18/70/70/1017187070.db2.gz RCAVXOOAODIVHI-SFHVURJKSA-N 1 1 327.815 3.658 20 10 EHCDMO COc1cc(C[N@@H+]2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)c(O)cc1C ZINC000160291768 1017202148 /nfs/dbraw/zinc/20/21/48/1017202148.db2.gz GJWJPULAPVGWQY-XOBRGWDASA-N 1 1 345.414 3.810 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000760407222 1032939260 /nfs/dbraw/zinc/93/92/60/1032939260.db2.gz HEIOBCSEJGINAT-QGZVFWFLSA-N 1 1 326.421 3.575 20 10 EHCDMO Cc1ccnc(C2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)n1 ZINC000366791461 1021408412 /nfs/dbraw/zinc/40/84/12/1021408412.db2.gz LTCNPJWKQLPLDG-UHFFFAOYSA-N 1 1 335.810 3.663 20 10 EHCDMO CC(C)c1noc(Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)n1 ZINC000519776117 1021683324 /nfs/dbraw/zinc/68/33/24/1021683324.db2.gz FMQNIUVORYKYSK-UHFFFAOYSA-N 1 1 338.455 3.963 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](Cc3nc(C)cs3)C2)c1 ZINC000895823405 1024876695 /nfs/dbraw/zinc/87/66/95/1024876695.db2.gz QHUGGTFRXDKQBU-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO CC[C@@H](C)N(C)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435607190 1025030574 /nfs/dbraw/zinc/03/05/74/1025030574.db2.gz LHFNCANBWAMZEC-MRXNPFEDSA-N 1 1 341.499 3.665 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c1O ZINC000161130241 1025146741 /nfs/dbraw/zinc/14/67/41/1025146741.db2.gz DAHGUQKZWBBRGY-IBGZPJMESA-N 1 1 345.414 3.730 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c1O ZINC000161130241 1025146754 /nfs/dbraw/zinc/14/67/54/1025146754.db2.gz DAHGUQKZWBBRGY-IBGZPJMESA-N 1 1 345.414 3.730 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)COc1ccc(C)cc1C ZINC000727830752 1025221180 /nfs/dbraw/zinc/22/11/80/1025221180.db2.gz LXPNKJKZTFFFQJ-LJQANCHMSA-N 1 1 343.467 3.661 20 10 EHCDMO Cc1cccc(C[N@H+]2Cc3ccccc3OC3(CCOCC3)C2)c1O ZINC000896441826 1025449962 /nfs/dbraw/zinc/44/99/62/1025449962.db2.gz NBMXNOKUXIAFJY-UHFFFAOYSA-N 1 1 339.435 3.644 20 10 EHCDMO CCOc1c(Cl)cc(C[NH2+]Cc2c(O)cccc2F)cc1OC ZINC000896642462 1025774382 /nfs/dbraw/zinc/77/43/82/1025774382.db2.gz XEHVQBADODKINO-UHFFFAOYSA-N 1 1 339.794 3.882 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]C1CCN(c2ccc(F)cc2F)CC1 ZINC000896636811 1025788718 /nfs/dbraw/zinc/78/87/18/1025788718.db2.gz HVCWEZIHKZMYAJ-UHFFFAOYSA-N 1 1 336.357 3.568 20 10 EHCDMO [O-]c1cccc(Cl)c1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000113317915 1026548272 /nfs/dbraw/zinc/54/82/72/1026548272.db2.gz LMPJMNCEMVHIDO-UHFFFAOYSA-N 1 1 330.859 3.931 20 10 EHCDMO COc1cccc(C[N@@H+](C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000273348262 1027388521 /nfs/dbraw/zinc/38/85/21/1027388521.db2.gz AMGXVOWGDKKHMQ-IEBWSBKVSA-N 1 1 345.414 3.892 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@H](Cc3nc(C)cs3)C2)c1O ZINC000897299353 1027404827 /nfs/dbraw/zinc/40/48/27/1027404827.db2.gz ZOWSJMFRZVJIIH-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273437293 1027423942 /nfs/dbraw/zinc/42/39/42/1027423942.db2.gz MFXWBSKPSJTHEW-SOUVJXGZSA-N 1 1 347.459 3.604 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000840947083 1027886123 /nfs/dbraw/zinc/88/61/23/1027886123.db2.gz LIRWJZBMLGUYGN-AWEZNQCLSA-N 1 1 337.769 3.633 20 10 EHCDMO COC(=O)N1CCC([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000278225054 1029729011 /nfs/dbraw/zinc/72/90/11/1029729011.db2.gz JOCNEZYDJCXKQF-VIFPVBQESA-N 1 1 347.242 3.580 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cc(Br)cs1 ZINC000708480812 1032027141 /nfs/dbraw/zinc/02/71/41/1032027141.db2.gz LTTJQAANYKBSAI-UHFFFAOYSA-N 1 1 334.185 3.784 20 10 EHCDMO COc1c(O)c(C[NH2+]CCC2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000898031181 1033296136 /nfs/dbraw/zinc/29/61/36/1033296136.db2.gz BGHQVWMONHLZSJ-UHFFFAOYSA-N 1 1 344.358 3.614 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](CSc3ccccc3)C1)OCO2 ZINC000173400613 1033301272 /nfs/dbraw/zinc/30/12/72/1033301272.db2.gz KIPGQNZUDFSMGF-AWEZNQCLSA-N 1 1 343.448 3.735 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1ccccc1C ZINC000174375057 1033910058 /nfs/dbraw/zinc/91/00/58/1033910058.db2.gz GNCUZMOZORGZHK-MRXNPFEDSA-N 1 1 326.440 3.940 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@@H](CCC(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000066080612 1035213414 /nfs/dbraw/zinc/21/34/14/1035213414.db2.gz LDHFNMRGCDBJPV-INIZCTEOSA-N 1 1 346.515 3.730 20 10 EHCDMO COc1cc(C)cc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000164447859 1035612621 /nfs/dbraw/zinc/61/26/21/1035612621.db2.gz NHLWYNISKMBAOO-UHFFFAOYSA-N 1 1 332.469 3.677 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000164447859 1035612629 /nfs/dbraw/zinc/61/26/29/1035612629.db2.gz NHLWYNISKMBAOO-UHFFFAOYSA-N 1 1 332.469 3.677 20 10 EHCDMO COc1cccc([C@@H]2C[N@@H+](Cc3cc(C)cc(C)c3O)CCO2)c1 ZINC000164521814 1035652959 /nfs/dbraw/zinc/65/29/59/1035652959.db2.gz NMHIGCLREQDTDH-IBGZPJMESA-N 1 1 327.424 3.591 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000057625787 1037015967 /nfs/dbraw/zinc/01/59/67/1037015967.db2.gz YLUJJKAFJZGZMF-UHFFFAOYSA-N 1 1 342.439 3.689 20 10 EHCDMO CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000157499277 1037625990 /nfs/dbraw/zinc/62/59/90/1037625990.db2.gz MLWNWWSFNMOLCF-WIYYLYMNSA-N 1 1 329.532 3.743 20 10 EHCDMO CCN1CC[C@@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000157499277 1037625996 /nfs/dbraw/zinc/62/59/96/1037625996.db2.gz MLWNWWSFNMOLCF-WIYYLYMNSA-N 1 1 329.532 3.743 20 10 EHCDMO Cc1nn(C)c(C)c1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000157569104 1037739780 /nfs/dbraw/zinc/73/97/80/1037739780.db2.gz LPPCERMVMVTAFZ-UHFFFAOYSA-N 1 1 326.488 3.659 20 10 EHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccc(OC)c(OC)c1O ZINC000893907202 1039804612 /nfs/dbraw/zinc/80/46/12/1039804612.db2.gz IFKSUAYOCZLURU-UHFFFAOYSA-N 1 1 340.423 3.913 20 10 EHCDMO Cc1ccc(C[NH+]2CCOCC2)cc1NCc1cc(C)c(C)cc1O ZINC000151150192 1040602407 /nfs/dbraw/zinc/60/24/07/1040602407.db2.gz SDDXAWRPRPIPEH-UHFFFAOYSA-N 1 1 340.467 3.762 20 10 EHCDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)C1 ZINC000781928547 1041098658 /nfs/dbraw/zinc/09/86/58/1041098658.db2.gz MQWOZOYDXPDITR-OXQOHEQNSA-N 1 1 332.463 3.674 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164230749 1041227503 /nfs/dbraw/zinc/22/75/03/1041227503.db2.gz MXFUDQSGDMNJKF-IRXDYDNUSA-N 1 1 332.488 3.526 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000278951959 1043073806 /nfs/dbraw/zinc/07/38/06/1043073806.db2.gz ZPEOFQOHVATOKA-INIZCTEOSA-N 1 1 330.384 3.796 20 10 EHCDMO CC[C@H]([NH2+]Cc1ncnn1-c1ccccc1)c1ccc(N(C)C)cc1 ZINC000279477509 1044120275 /nfs/dbraw/zinc/12/02/75/1044120275.db2.gz KLEVCDUQZBNQFX-IBGZPJMESA-N 1 1 335.455 3.574 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cn(C)nc2-c2ccccc2)cc1 ZINC000183376308 1125542638 /nfs/dbraw/zinc/54/26/38/1125542638.db2.gz UFFQWENGRGIYFZ-UHFFFAOYSA-N 1 1 334.467 3.785 20 10 EHCDMO COc1cccc(N2CCC[C@@H]([NH2+][C@@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185480932 1126906626 /nfs/dbraw/zinc/90/66/26/1126906626.db2.gz PNBQRFVHAWFNNZ-GOEBONIOSA-N 1 1 344.430 3.860 20 10 EHCDMO COc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)c2ccccc2n1 ZINC000185573792 1126945364 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10 EHCDMO CCCCC[N@@H+](CC(=O)N(C)Cc1ccc(N(C)C)cc1)C(C)C ZINC000917053440 1122450754 /nfs/dbraw/zinc/45/07/54/1122450754.db2.gz NUSVGMWSGSVQKI-UHFFFAOYSA-N 1 1 333.520 3.612 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)oc1C ZINC000917074640 1122471291 /nfs/dbraw/zinc/47/12/91/1122471291.db2.gz DWQIFALMQMUNGG-UHFFFAOYSA-N 1 1 344.455 3.851 20 10 EHCDMO CC(C)[N@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc(N(C)C)cc1 ZINC000917074792 1122471405 /nfs/dbraw/zinc/47/14/05/1122471405.db2.gz GGUCWYIOFIUIIO-UHFFFAOYSA-N 1 1 330.476 3.844 20 10 EHCDMO CC(C)[N@@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc(N(C)C)cc1 ZINC000917074792 1122471409 /nfs/dbraw/zinc/47/14/09/1122471409.db2.gz GGUCWYIOFIUIIO-UHFFFAOYSA-N 1 1 330.476 3.844 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCO[C@@H]4CCCC[C@H]43)c2c1 ZINC000917471971 1122615901 /nfs/dbraw/zinc/61/59/01/1122615901.db2.gz FSJRVJRELLOLQC-UYAOXDASSA-N 1 1 327.424 3.697 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(-c3ccccn3)s2)cc1 ZINC000155180500 1123286561 /nfs/dbraw/zinc/28/65/61/1123286561.db2.gz JOYZQJPXNLJDSP-UHFFFAOYSA-N 1 1 338.480 3.903 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2cccs2)cc1 ZINC000155183254 1123290527 /nfs/dbraw/zinc/29/05/27/1123290527.db2.gz XPIHCQAFXSHKQR-UHFFFAOYSA-N 1 1 326.469 3.836 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)C[C@@H](c2ccccc2)O1 ZINC000920305262 1123352971 /nfs/dbraw/zinc/35/29/71/1123352971.db2.gz GBQAYQBZZCVMBF-BTYIYWSLSA-N 1 1 334.419 3.902 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000180275022 1123975172 /nfs/dbraw/zinc/97/51/72/1123975172.db2.gz NSLMDRPPXAJWDW-PKOBYXMFSA-N 1 1 333.378 3.759 20 10 EHCDMO Cn1ccnc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922217790 1129369756 /nfs/dbraw/zinc/36/97/56/1129369756.db2.gz BKUNNHKMVZZFNF-HXUWFJFHSA-N 1 1 347.462 3.819 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnn(-c2ccccc2)n1)C1CCCC1 ZINC000731845872 1130848951 /nfs/dbraw/zinc/84/89/51/1130848951.db2.gz LBDFLBYLORGLDV-UHFFFAOYSA-N 1 1 348.450 3.918 20 10 EHCDMO CC(C)C[C@@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1ccccc1 ZINC000732203084 1130900315 /nfs/dbraw/zinc/90/03/15/1130900315.db2.gz OHSUHFDGZHVOBH-LJQANCHMSA-N 1 1 340.467 3.728 20 10 EHCDMO Cc1cc(C(=O)NCC[N@H+](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 ZINC000733170828 1131003740 /nfs/dbraw/zinc/00/37/40/1131003740.db2.gz CANMBQIOIBFYLI-UHFFFAOYSA-N 1 1 347.890 3.818 20 10 EHCDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000736592868 1131428003 /nfs/dbraw/zinc/42/80/03/1131428003.db2.gz DNPKNUXMVJBUKB-OCCSQVGLSA-N 1 1 329.371 3.638 20 10 EHCDMO CN(C)[C@H]1CCC[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000738144414 1131463242 /nfs/dbraw/zinc/46/32/42/1131463242.db2.gz POGPHGLMUZTWIW-AWEZNQCLSA-N 1 1 328.456 3.543 20 10 EHCDMO CN(C)[C@H]1CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000738144414 1131463243 /nfs/dbraw/zinc/46/32/43/1131463243.db2.gz POGPHGLMUZTWIW-AWEZNQCLSA-N 1 1 328.456 3.543 20 10 EHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)CCO1 ZINC000742161267 1131695360 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EHCDMO CCCCOCC[N@@H+](CC)Cc1cc(Br)ccc1O ZINC000743871105 1131995141 /nfs/dbraw/zinc/99/51/41/1131995141.db2.gz QZXXKXOEZISYPC-UHFFFAOYSA-N 1 1 330.266 3.793 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@@H]1CCCCO1 ZINC000743870821 1131995371 /nfs/dbraw/zinc/99/53/71/1131995371.db2.gz CDXJWEILMCXXIO-AWEZNQCLSA-N 1 1 328.250 3.546 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)NCc1ccc(C)cc1 ZINC000743870311 1131996205 /nfs/dbraw/zinc/99/62/05/1131996205.db2.gz PQCBSUCZKOTDOB-KRWDZBQOSA-N 1 1 340.467 3.618 20 10 EHCDMO CCSC[C@H](C)N[C@H](c1ccccc1O)[C@H]([NH3+])c1ccccc1O ZINC001173298572 1132032277 /nfs/dbraw/zinc/03/22/77/1132032277.db2.gz NGLCNJWPPZJNRJ-MJXNMMHHSA-N 1 1 346.496 3.570 20 10 EHCDMO COC(=O)CCCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001173456072 1132082242 /nfs/dbraw/zinc/08/22/42/1132082242.db2.gz YUYABLOGKLKOEM-KRWDZBQOSA-N 1 1 332.488 3.841 20 10 EHCDMO CC(C)C[C@H]1CC(=O)N(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)C1 ZINC000744432119 1132096319 /nfs/dbraw/zinc/09/63/19/1132096319.db2.gz HWNGPAXXPBWFRP-IBGZPJMESA-N 1 1 345.531 3.815 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H]1CCN(CC(F)(F)F)C1 ZINC001174964108 1132521117 /nfs/dbraw/zinc/52/11/17/1132521117.db2.gz BZFWWQFBFBFPOK-INIZCTEOSA-N 1 1 343.437 3.520 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)O[C@H](C)C2)cc1 ZINC001175883013 1132780850 /nfs/dbraw/zinc/78/08/50/1132780850.db2.gz ODIUFWXFXAHXFB-CZUORRHYSA-N 1 1 330.394 3.684 20 10 EHCDMO C[C@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768439266 1133139523 /nfs/dbraw/zinc/13/95/23/1133139523.db2.gz JHYGFARUWCCFDA-JLTOFOAXSA-N 1 1 339.435 3.619 20 10 EHCDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768446489 1133140283 /nfs/dbraw/zinc/14/02/83/1133140283.db2.gz KQSPWIIGCJPCSL-MDOVXXIYSA-N 1 1 339.435 3.504 20 10 EHCDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768446493 1133140400 /nfs/dbraw/zinc/14/04/00/1133140400.db2.gz KQSPWIIGCJPCSL-STXHMFSFSA-N 1 1 339.435 3.504 20 10 EHCDMO CCC[N@@H+](CC)C[C@H](C)NCc1ccc(N(C)C)cc1C(F)(F)F ZINC001178855940 1133205069 /nfs/dbraw/zinc/20/50/69/1133205069.db2.gz UOFPNQDRDAKEQF-AWEZNQCLSA-N 1 1 345.453 3.981 20 10 EHCDMO CCCN(CC)C[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001178855940 1133205072 /nfs/dbraw/zinc/20/50/72/1133205072.db2.gz UOFPNQDRDAKEQF-AWEZNQCLSA-N 1 1 345.453 3.981 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c(O)c1 ZINC000769242882 1133243128 /nfs/dbraw/zinc/24/31/28/1133243128.db2.gz LYXRHKWGNPSCLW-CTNGQTDRSA-N 1 1 341.451 3.879 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](CO)c2ccc(OC)cc2)cc1 ZINC000769424503 1133282783 /nfs/dbraw/zinc/28/27/83/1133282783.db2.gz FXCVLSJSODGLCQ-NRFANRHFSA-N 1 1 342.483 3.707 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)ccc2O)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000769485714 1133288782 /nfs/dbraw/zinc/28/87/82/1133288782.db2.gz NZTIFHWAIWJUMW-WBVHZDCISA-N 1 1 348.487 3.826 20 10 EHCDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769513528 1133306375 /nfs/dbraw/zinc/30/63/75/1133306375.db2.gz BAIMBNAOERHVAT-MRXNPFEDSA-N 1 1 349.500 3.913 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCCc3c2cnn3C)cc1F ZINC000769538740 1133311241 /nfs/dbraw/zinc/31/12/41/1133311241.db2.gz VXISRCGBHHEJKL-SFHVURJKSA-N 1 1 344.478 3.915 20 10 EHCDMO CC[C@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1cc(C)ccc1O ZINC000769538980 1133311725 /nfs/dbraw/zinc/31/17/25/1133311725.db2.gz ZZXXCGKEKWIKQU-GOSISDBHSA-N 1 1 327.424 3.827 20 10 EHCDMO CC[C@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1cc(C)ccc1O ZINC000769538980 1133311730 /nfs/dbraw/zinc/31/17/30/1133311730.db2.gz ZZXXCGKEKWIKQU-GOSISDBHSA-N 1 1 327.424 3.827 20 10 EHCDMO C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000770509764 1133435954 /nfs/dbraw/zinc/43/59/54/1133435954.db2.gz TUPBYFQXJQYBCS-GOEBONIOSA-N 1 1 334.460 3.660 20 10 EHCDMO CC[C@@H]1C[N@@H+](CC)CCN1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001181764335 1133523396 /nfs/dbraw/zinc/52/33/96/1133523396.db2.gz NMWCKYBFBSXSPK-OAHLLOKOSA-N 1 1 343.437 3.688 20 10 EHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CCCC[C@@H]1CN1CCCC1 ZINC001204326256 1133594345 /nfs/dbraw/zinc/59/43/45/1133594345.db2.gz DOMKSPAXTMQALU-OAQYLSRUSA-N 1 1 327.516 3.737 20 10 EHCDMO c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@@H]1CN1CCCC1 ZINC001204326256 1133594347 /nfs/dbraw/zinc/59/43/47/1133594347.db2.gz DOMKSPAXTMQALU-OAQYLSRUSA-N 1 1 327.516 3.737 20 10 EHCDMO C[C@H]([NH2+]CCOCC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774147105 1133623138 /nfs/dbraw/zinc/62/31/38/1133623138.db2.gz KIUNJFWOOFQJEC-ZETCQYMHSA-N 1 1 332.149 3.929 20 10 EHCDMO COC(=O)N1CCC[C@@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000774168353 1133627490 /nfs/dbraw/zinc/62/74/90/1133627490.db2.gz HFOKPSXYOIJWAC-VHSXEESVSA-N 1 1 347.242 3.580 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(C(=O)OC)co2)cc1F ZINC000774177912 1133635305 /nfs/dbraw/zinc/63/53/05/1133635305.db2.gz FPOLXRQYUNZZJW-CYBMUJFWSA-N 1 1 348.418 3.902 20 10 EHCDMO CCO[C@@H](C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O)c1ccccc1 ZINC000774495527 1133689494 /nfs/dbraw/zinc/68/94/94/1133689494.db2.gz JGRZROODFZKWTH-LIRRHRJNSA-N 1 1 343.423 3.607 20 10 EHCDMO CCC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H]1CCCc2cccnc21 ZINC000774604893 1133781769 /nfs/dbraw/zinc/78/17/69/1133781769.db2.gz VZUQIVVTRLRCOZ-INIZCTEOSA-N 1 1 340.423 3.806 20 10 EHCDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC001183918709 1133878815 /nfs/dbraw/zinc/87/88/15/1133878815.db2.gz BWJSPFWOUMBYFF-CXAGYDPISA-N 1 1 344.386 3.941 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c1O ZINC000774706401 1133886887 /nfs/dbraw/zinc/88/68/87/1133886887.db2.gz UYOASTFVXJPJHY-OAQYLSRUSA-N 1 1 339.435 3.731 20 10 EHCDMO Oc1cc(F)c(F)cc1C[NH2+]Cc1ccc(Br)cc1F ZINC001184207654 1133907495 /nfs/dbraw/zinc/90/74/95/1133907495.db2.gz VKPCIRMYKFJIBD-UHFFFAOYSA-N 1 1 346.146 3.862 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000774834167 1134035952 /nfs/dbraw/zinc/03/59/52/1134035952.db2.gz AXNJXXCBXBYOJJ-HNNXBMFYSA-N 1 1 346.358 3.785 20 10 EHCDMO COc1c(O)c(C[NH+]2CCC3(CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000774875114 1134083026 /nfs/dbraw/zinc/08/30/26/1134083026.db2.gz HZOBUMHPMDCGKU-UHFFFAOYSA-N 1 1 334.416 3.855 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774910416 1134117858 /nfs/dbraw/zinc/11/78/58/1134117858.db2.gz XJTCXKSJEINHQD-BBRMVZONSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774910416 1134117862 /nfs/dbraw/zinc/11/78/62/1134117862.db2.gz XJTCXKSJEINHQD-BBRMVZONSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000774953717 1134146742 /nfs/dbraw/zinc/14/67/42/1134146742.db2.gz YFDIOMPMAKHQIA-CQSZACIVSA-N 1 1 342.395 3.519 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)cc1O ZINC000788582650 1134147934 /nfs/dbraw/zinc/14/79/34/1134147934.db2.gz HXCIIBGTZBEQFK-JTQLQIEISA-N 1 1 341.329 3.976 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000788624996 1134153038 /nfs/dbraw/zinc/15/30/38/1134153038.db2.gz IOWUXMXUACAIQD-SRVKXCTJSA-N 1 1 328.378 3.687 20 10 EHCDMO COc1c(O)c(C[NH2+]C2(c3ccc(F)cc3)CCC2)ccc1[N+](=O)[O-] ZINC000774989698 1134187108 /nfs/dbraw/zinc/18/71/08/1134187108.db2.gz OMCDVXKIVZBGDQ-UHFFFAOYSA-N 1 1 346.358 3.617 20 10 EHCDMO CCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775006265 1134203959 /nfs/dbraw/zinc/20/39/59/1134203959.db2.gz ZMTGDRYWMSPWKH-MRXNPFEDSA-N 1 1 344.411 3.810 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000775022377 1134221796 /nfs/dbraw/zinc/22/17/96/1134221796.db2.gz YAHIEOBPQJPSBK-UHFFFAOYSA-N 1 1 344.411 3.668 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000775028908 1134230453 /nfs/dbraw/zinc/23/04/53/1134230453.db2.gz UTLJERGEEBBTOZ-CYBMUJFWSA-N 1 1 330.384 3.511 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC001203645869 1134258310 /nfs/dbraw/zinc/25/83/10/1134258310.db2.gz UXVCCNZZMGXBAU-AWEZNQCLSA-N 1 1 328.250 3.544 20 10 EHCDMO COC(C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O)OC ZINC001203650748 1134277370 /nfs/dbraw/zinc/27/73/70/1134277370.db2.gz AHNKJXYSYXZREB-UHFFFAOYSA-N 1 1 335.831 3.667 20 10 EHCDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000789516369 1134296783 /nfs/dbraw/zinc/29/67/83/1134296783.db2.gz OZSOYCGCKCZREF-QGZVFWFLSA-N 1 1 346.515 3.879 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@]3(C2)CCCOC3)c(O)c(C(C)(C)C)c1 ZINC000789564658 1134296893 /nfs/dbraw/zinc/29/68/93/1134296893.db2.gz JAHCKRZYIUZWRV-FQEVSTJZSA-N 1 1 333.472 3.701 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000790408018 1134411861 /nfs/dbraw/zinc/41/18/61/1134411861.db2.gz SIOCSAUBSGCEFJ-MRUHUIDDSA-N 1 1 347.499 3.766 20 10 EHCDMO C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790947734 1134483053 /nfs/dbraw/zinc/48/30/53/1134483053.db2.gz AHMFJQSYHHGVEJ-ZDUSSCGKSA-N 1 1 328.859 3.929 20 10 EHCDMO COc1ccccc1O[C@@H](C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790971954 1134493463 /nfs/dbraw/zinc/49/34/63/1134493463.db2.gz BLSYWMXBSIZBHS-NSHDSACASA-N 1 1 339.794 3.750 20 10 EHCDMO COC(=O)[C@H](C)[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C1CCC1 ZINC000792184545 1134665511 /nfs/dbraw/zinc/66/55/11/1134665511.db2.gz HCQFGHKORAACQG-HNNXBMFYSA-N 1 1 339.435 3.975 20 10 EHCDMO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000775368988 1134668695 /nfs/dbraw/zinc/66/86/95/1134668695.db2.gz IJTIHPXGACFUIT-GJZGRUSLSA-N 1 1 342.277 3.838 20 10 EHCDMO COC(=O)[C@H]1CCCC[C@H]1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190446871 1134702012 /nfs/dbraw/zinc/70/20/12/1134702012.db2.gz QAWOTIXNWFZCDB-PXNSSMCTSA-N 1 1 344.499 3.696 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c(C(F)(F)F)c1 ZINC000792832864 1134798669 /nfs/dbraw/zinc/79/86/69/1134798669.db2.gz PUEXPIDSUATFCR-ZFWWWQNUSA-N 1 1 342.405 3.630 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)c(C(F)(F)F)c1 ZINC000792836518 1134799443 /nfs/dbraw/zinc/79/94/43/1134799443.db2.gz XJZQYDVPOZMNAO-OAHLLOKOSA-N 1 1 332.410 3.610 20 10 EHCDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793190718 1134871848 /nfs/dbraw/zinc/87/18/48/1134871848.db2.gz WESBPROGOJLLIO-CJNGLKHVSA-N 1 1 344.421 3.897 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)Cc1cccc(Cl)c1 ZINC000805742591 1135323901 /nfs/dbraw/zinc/32/39/01/1135323901.db2.gz OAGZFUYWNNMUIH-SFHVURJKSA-N 1 1 333.859 3.861 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1O ZINC000806174474 1135398815 /nfs/dbraw/zinc/39/88/15/1135398815.db2.gz JGEGSBWIQRYWOD-QFYYESIMSA-N 1 1 343.320 3.934 20 10 EHCDMO COc1cccc([C@@H]2C[N@H+](Cc3cc(Cl)cc(C)c3O)CCO2)c1 ZINC000775675808 1135493928 /nfs/dbraw/zinc/49/39/28/1135493928.db2.gz DPXUSGRKOSTQLI-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cccc([C@@H]2C[N@@H+](Cc3cc(Cl)cc(C)c3O)CCO2)c1 ZINC000775675808 1135493933 /nfs/dbraw/zinc/49/39/33/1135493933.db2.gz DPXUSGRKOSTQLI-SFHVURJKSA-N 1 1 347.842 3.936 20 10 EHCDMO c1ccc(C2=CC[N@@H+](Cc3ccc(N4CCOCC4)cc3)CC2)cc1 ZINC000159754177 1135509258 /nfs/dbraw/zinc/50/92/58/1135509258.db2.gz UXPAATARDKFEFW-UHFFFAOYSA-N 1 1 334.463 3.813 20 10 EHCDMO Cc1cccc(C[N@H+](C)C2CCC(NC(=O)OC(C)(C)C)CC2)c1O ZINC000775734908 1135590485 /nfs/dbraw/zinc/59/04/85/1135590485.db2.gz BXICZHJIKMFBPG-UHFFFAOYSA-N 1 1 348.487 3.968 20 10 EHCDMO Cc1cccc(C[N@H+](C)CC(C)(C)CNC(=O)OC(C)(C)C)c1O ZINC000775736522 1135594424 /nfs/dbraw/zinc/59/44/24/1135594424.db2.gz HVXZVYHXXLXABM-UHFFFAOYSA-N 1 1 336.476 3.683 20 10 EHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@H](CC(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000808229481 1135633962 /nfs/dbraw/zinc/63/39/62/1135633962.db2.gz RDCIFXWVCQPTAY-CQSZACIVSA-N 1 1 346.515 3.685 20 10 EHCDMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c1 ZINC001649139108 1135740624 /nfs/dbraw/zinc/74/06/24/1135740624.db2.gz RCWIEDAEVTUQKN-LJQANCHMSA-N 1 1 337.511 3.906 20 10 EHCDMO CCOc1ccc(C[N@H+](C)Cc2nc(-c3cccs3)no2)c(O)c1 ZINC000809687889 1135872149 /nfs/dbraw/zinc/87/21/49/1135872149.db2.gz UGSJPZVSZGBCOV-UHFFFAOYSA-N 1 1 345.424 3.534 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c(O)c1 ZINC000809687889 1135872151 /nfs/dbraw/zinc/87/21/51/1135872151.db2.gz UGSJPZVSZGBCOV-UHFFFAOYSA-N 1 1 345.424 3.534 20 10 EHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(Br)cc(C)c1O ZINC000809727282 1135872391 /nfs/dbraw/zinc/87/23/91/1135872391.db2.gz VNWRCBREGSPHRP-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000809728497 1135872643 /nfs/dbraw/zinc/87/26/43/1135872643.db2.gz AAINZYQKQDORAQ-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1F ZINC000809767403 1135879816 /nfs/dbraw/zinc/87/98/16/1135879816.db2.gz JYVJMLLHKBIOFR-MJGOQNOKSA-N 1 1 333.495 3.588 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1F ZINC000809767403 1135879820 /nfs/dbraw/zinc/87/98/20/1135879820.db2.gz JYVJMLLHKBIOFR-MJGOQNOKSA-N 1 1 333.495 3.588 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@]2(C)CCCO)c(C(F)(F)F)c1 ZINC000809757179 1135886985 /nfs/dbraw/zinc/88/69/85/1135886985.db2.gz KWCXACVHULGEET-KRWDZBQOSA-N 1 1 344.421 3.898 20 10 EHCDMO O=C(NC1CCCCC1)OC[C@@H]1CCCC[N@@H+]1Cc1ccccc1O ZINC000809780329 1135890143 /nfs/dbraw/zinc/89/01/43/1135890143.db2.gz USNOJSQUIMLITA-SFHVURJKSA-N 1 1 346.471 3.806 20 10 EHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000776003992 1135915692 /nfs/dbraw/zinc/91/56/92/1135915692.db2.gz YYQONYNALUAEFU-ZWNOBZJWSA-N 1 1 328.250 3.784 20 10 EHCDMO Cc1cc(C[NH2+]Cc2c(O)ccc(Cl)c2F)cc(N2CCCC2)n1 ZINC000810168765 1135929605 /nfs/dbraw/zinc/92/96/05/1135929605.db2.gz LSYMWYXRMUPEHI-UHFFFAOYSA-N 1 1 349.837 3.778 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](n4cc(C)cn4)C3)c2c1 ZINC000811799902 1136138347 /nfs/dbraw/zinc/13/83/47/1136138347.db2.gz DHMMBIVHOCQXAG-INIZCTEOSA-N 1 1 337.423 3.506 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CC[C@H](n2cccn2)C1)CCCC3 ZINC000812294233 1136195283 /nfs/dbraw/zinc/19/52/83/1136195283.db2.gz IEPJKWUZDSYPRH-AWEZNQCLSA-N 1 1 337.423 3.661 20 10 EHCDMO C=Cc1ccc(CC[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)cc1 ZINC000812734853 1136239256 /nfs/dbraw/zinc/23/92/56/1136239256.db2.gz STKBQQMECMKVOK-AWEZNQCLSA-N 1 1 325.408 3.715 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCCC23CCCC3)ccc1[N+](=O)[O-] ZINC000812781024 1136246547 /nfs/dbraw/zinc/24/65/47/1136246547.db2.gz XWDFAWNYKSVSFM-OAHLLOKOSA-N 1 1 334.416 3.902 20 10 EHCDMO Oc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(Br)c1O)CC2 ZINC000850385977 1136247006 /nfs/dbraw/zinc/24/70/06/1136247006.db2.gz DNWSSGOCJKQDFW-OAHLLOKOSA-N 1 1 334.213 3.637 20 10 EHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850849 1136261404 /nfs/dbraw/zinc/26/14/04/1136261404.db2.gz YNHXTMXTWDRZLO-YJYMSZOUSA-N 1 1 345.414 3.678 20 10 EHCDMO CC[C@@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(F)cc1O ZINC000850487482 1136268957 /nfs/dbraw/zinc/26/89/57/1136268957.db2.gz NOZXMLNZHWHBCQ-DNVCBOLYSA-N 1 1 344.430 3.860 20 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/nfs/dbraw/zinc/61/08/79/1136610879.db2.gz XXYVFKXDBZHGAX-QWHCGFSZSA-N 1 1 330.394 3.936 20 10 EHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2[O-])C1 ZINC000815564054 1136611390 /nfs/dbraw/zinc/61/13/90/1136611390.db2.gz WAPNTVVEDZXRKW-STQMWFEESA-N 1 1 330.394 3.794 20 10 EHCDMO OCC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCc2ccccc21 ZINC000816510626 1136728789 /nfs/dbraw/zinc/72/87/89/1136728789.db2.gz AZJKADXZUOJLEJ-KRWDZBQOSA-N 1 1 335.806 3.667 20 10 EHCDMO OCC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCc2ccccc21 ZINC000816510626 1136728790 /nfs/dbraw/zinc/72/87/90/1136728790.db2.gz AZJKADXZUOJLEJ-KRWDZBQOSA-N 1 1 335.806 3.667 20 10 EHCDMO Oc1c(CNc2cccc(C[NH+]3CCOCC3)c2)ccc2ccccc21 ZINC000816526015 1136733496 /nfs/dbraw/zinc/73/34/96/1136733496.db2.gz QHPXKSZDZVXBDI-UHFFFAOYSA-N 1 1 348.446 3.990 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000816611006 1136741269 /nfs/dbraw/zinc/74/12/69/1136741269.db2.gz FOPDABNAHSBGJK-STQMWFEESA-N 1 1 327.827 3.823 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000816611006 1136741271 /nfs/dbraw/zinc/74/12/71/1136741271.db2.gz FOPDABNAHSBGJK-STQMWFEESA-N 1 1 327.827 3.823 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1 ZINC000816642626 1136743469 /nfs/dbraw/zinc/74/34/69/1136743469.db2.gz FYIZRFGENRUBFV-INIZCTEOSA-N 1 1 347.377 3.723 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1 ZINC000816642626 1136743471 /nfs/dbraw/zinc/74/34/71/1136743471.db2.gz FYIZRFGENRUBFV-INIZCTEOSA-N 1 1 347.377 3.723 20 10 EHCDMO CCCOc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938277 1136847338 /nfs/dbraw/zinc/84/73/38/1136847338.db2.gz IFACHUFTOWMLIW-IIBYNOLFSA-N 1 1 341.499 3.892 20 10 EHCDMO Cc1nc(C(C)C)sc1[C@@H](C)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939569 1136847404 /nfs/dbraw/zinc/84/74/04/1136847404.db2.gz CQTUESWRJQTUGL-CXAGYDPISA-N 1 1 346.544 3.992 20 10 EHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000817940746 1136848474 /nfs/dbraw/zinc/84/84/74/1136848474.db2.gz HREVHNLLKKWHOZ-PMACEKPBSA-N 1 1 341.499 3.810 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817946913 1136849804 /nfs/dbraw/zinc/84/98/04/1136849804.db2.gz HSZKVOKKXLHLPU-HUBLWGQQSA-N 1 1 341.293 3.584 20 10 EHCDMO CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817979728 1136854926 /nfs/dbraw/zinc/85/49/26/1136854926.db2.gz DRHDKAOXKGSIGG-DZGCQCFKSA-N 1 1 330.394 3.984 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]C(C)(C)C(=O)Nc2ccccc2)cc1F ZINC000858132242 1136942332 /nfs/dbraw/zinc/94/23/32/1136942332.db2.gz XFCOCXJVQNVQML-UHFFFAOYSA-N 1 1 347.409 3.538 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](n3ccnn3)C1)oc1ccccc12 ZINC000819898331 1136965824 /nfs/dbraw/zinc/96/58/24/1136965824.db2.gz WWVUPOZZYMBOOC-OAHLLOKOSA-N 1 1 348.406 3.720 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1ccc(F)cc1O ZINC000858449956 1136969257 /nfs/dbraw/zinc/96/92/57/1136969257.db2.gz WLFAJQFLMNSHSY-OCCSQVGLSA-N 1 1 331.313 3.572 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000858484724 1136972139 /nfs/dbraw/zinc/97/21/39/1136972139.db2.gz ZMYMNDNRVUOSBK-ORAYPTAESA-N 1 1 340.423 3.766 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490946 1136972845 /nfs/dbraw/zinc/97/28/45/1136972845.db2.gz SYZKACALRYLDEN-OLZOCXBDSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Br)ccc1[O-] ZINC000858490946 1136972846 /nfs/dbraw/zinc/97/28/46/1136972846.db2.gz SYZKACALRYLDEN-OLZOCXBDSA-N 1 1 341.293 3.537 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c1O ZINC000859543141 1137018971 /nfs/dbraw/zinc/01/89/71/1137018971.db2.gz UYIOHUGNPNTRJU-KGLIPLIRSA-N 1 1 325.861 3.718 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1O ZINC000859543141 1137018973 /nfs/dbraw/zinc/01/89/73/1137018973.db2.gz UYIOHUGNPNTRJU-KGLIPLIRSA-N 1 1 325.861 3.718 20 10 EHCDMO Fc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1Br ZINC000823752456 1137112549 /nfs/dbraw/zinc/11/25/49/1137112549.db2.gz GHATZQVQLWOHGB-UHFFFAOYSA-N 1 1 336.204 3.813 20 10 EHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CCN1C ZINC000823955396 1137119151 /nfs/dbraw/zinc/11/91/51/1137119151.db2.gz KPYBWLVWBULAAF-SJLPKXTDSA-N 1 1 343.540 3.957 20 10 EHCDMO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000824120196 1137125074 /nfs/dbraw/zinc/12/50/74/1137125074.db2.gz UYICZAXGVYXTES-FUHWJXTLSA-N 1 1 344.524 3.977 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)cc1 ZINC000824237085 1137127864 /nfs/dbraw/zinc/12/78/64/1137127864.db2.gz OPJBNBKGLVAFTM-LJQANCHMSA-N 1 1 344.524 3.977 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000862398598 1137142609 /nfs/dbraw/zinc/14/26/09/1137142609.db2.gz MTBOOEFKFWCCSE-SWLSCSKDSA-N 1 1 340.261 3.546 20 10 EHCDMO O=[N+]([O-])c1cc(Cn2c[nH+]c3c2CCCC3)ccc1N1CCCCC1 ZINC000862431709 1137144049 /nfs/dbraw/zinc/14/40/49/1137144049.db2.gz QUOAUNJYDLFOJA-UHFFFAOYSA-N 1 1 340.427 3.709 20 10 EHCDMO C[N@@H+](Cc1c(O)cccc1Cl)[C@@H](CO)c1ccc(Cl)cc1 ZINC000824691150 1137148377 /nfs/dbraw/zinc/14/83/77/1137148377.db2.gz VKPFKWIWCJLBAJ-HNNXBMFYSA-N 1 1 326.223 3.864 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC=C(c3cn(C(C)C)nn3)CC2)cc1C ZINC000824737814 1137149065 /nfs/dbraw/zinc/14/90/65/1137149065.db2.gz FDHJXNUPHPVGFL-UHFFFAOYSA-N 1 1 340.471 3.861 20 10 EHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3cc(Br)ccc3O)C2)cc1 ZINC000862541626 1137149429 /nfs/dbraw/zinc/14/94/29/1137149429.db2.gz XZJAOBUXRHLKPK-CYBMUJFWSA-N 1 1 348.240 3.850 20 10 EHCDMO c1coc([C@H]2[N@@H+](Cc3ccc(N4CCOCC4)cc3)CC23CCC3)c1 ZINC000825104374 1137163525 /nfs/dbraw/zinc/16/35/25/1137163525.db2.gz VJTBMPCMWLMLTI-HXUWFJFHSA-N 1 1 338.451 3.843 20 10 EHCDMO Cc1cc(O)c(C[NH2+]Cc2ccc(F)c(CN(C)C)c2)cc1Cl ZINC000825286805 1137171539 /nfs/dbraw/zinc/17/15/39/1137171539.db2.gz GPYOBOQHJVRXPD-UHFFFAOYSA-N 1 1 336.838 3.845 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)cc1C ZINC000863303666 1137180436 /nfs/dbraw/zinc/18/04/36/1137180436.db2.gz YEZXBWMTKAKQLT-GOEBONIOSA-N 1 1 349.471 3.509 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1O ZINC000863302400 1137180444 /nfs/dbraw/zinc/18/04/44/1137180444.db2.gz KKLFDTJTIKVWHH-HOCLYGCPSA-N 1 1 349.471 3.509 20 10 EHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C2CC2)c(C)n1-c1ccc(F)cn1 ZINC000863384993 1137184467 /nfs/dbraw/zinc/18/44/67/1137184467.db2.gz GSDUELHWTGTJCC-UHFFFAOYSA-N 1 1 338.386 3.585 20 10 EHCDMO [NH3+]Cc1ccc(CNCc2ccc(N3CCCCC3)cc2)c(F)c1 ZINC000844905457 1137261610 /nfs/dbraw/zinc/26/16/10/1137261610.db2.gz ZUVFVNGPOHZBHB-UHFFFAOYSA-N 1 1 327.447 3.565 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)c(O)c1 ZINC001144514401 1137304108 /nfs/dbraw/zinc/30/41/08/1137304108.db2.gz BMULNPKYIXXDNK-NSHDSACASA-N 1 1 325.817 3.855 20 10 EHCDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)Cc1c(O)cc(O)cc1O ZINC001144514966 1137304234 /nfs/dbraw/zinc/30/42/34/1137304234.db2.gz ZJTVKNYYUGCIAR-UHFFFAOYSA-N 1 1 331.488 3.683 20 10 EHCDMO Cc1ncc([C@H](C)[NH2+]Cc2cccc(Br)c2O)s1 ZINC000865701519 1137305341 /nfs/dbraw/zinc/30/53/41/1137305341.db2.gz NHNUZZCWSBDOCU-QMMMGPOBSA-N 1 1 327.247 3.770 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1cc(Br)c(F)cc1O ZINC000846206042 1137339211 /nfs/dbraw/zinc/33/92/11/1137339211.db2.gz UHWRTRLJJHHJHA-VHSXEESVSA-N 1 1 346.240 3.760 20 10 EHCDMO CC(C)Nc1ccccc1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000871846112 1137560298 /nfs/dbraw/zinc/56/02/98/1137560298.db2.gz RKSXVYJOVFWGFR-UHFFFAOYSA-N 1 1 339.483 3.951 20 10 EHCDMO C[C@@H]([NH2+]CCC[C@H]1CCOC1=O)c1cc(Cl)c(Cl)cc1O ZINC000872113868 1137571952 /nfs/dbraw/zinc/57/19/52/1137571952.db2.gz RLNJEIXDIKLJPG-ZJUUUORDSA-N 1 1 332.227 3.693 20 10 EHCDMO C[C@H]([NH2+]CCC[C@H]1CCOC1=O)c1cc(Cl)c(Cl)cc1O ZINC000872113866 1137572070 /nfs/dbraw/zinc/57/20/70/1137572070.db2.gz RLNJEIXDIKLJPG-UWVGGRQHSA-N 1 1 332.227 3.693 20 10 EHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000125812655 1137646321 /nfs/dbraw/zinc/64/63/21/1137646321.db2.gz MAGILNZCXGNSFX-KRWDZBQOSA-N 1 1 340.467 3.725 20 10 EHCDMO CCCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)nn1 ZINC000876522642 1137654589 /nfs/dbraw/zinc/65/45/89/1137654589.db2.gz YEWDFRSAROPMJE-UHFFFAOYSA-N 1 1 328.460 3.729 20 10 EHCDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC000877192043 1137672642 /nfs/dbraw/zinc/67/26/42/1137672642.db2.gz IURDAOBRMVSAQO-UWJYYQICSA-N 1 1 328.500 3.660 20 10 EHCDMO COC(=O)c1nc([C@@H]2CCC[N@H+]2Cc2c(C)cccc2O)sc1C ZINC000877490418 1137678263 /nfs/dbraw/zinc/67/82/63/1137678263.db2.gz ZRZRQAIKJJMCOI-AWEZNQCLSA-N 1 1 346.452 3.589 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)c(O)c1 ZINC000877544762 1137680583 /nfs/dbraw/zinc/68/05/83/1137680583.db2.gz WOOPSSBPURDUDT-OAQYLSRUSA-N 1 1 325.452 3.518 20 10 EHCDMO Cc1nn(Cc2ccccc2)c(C)c1C[N@@H+]1Cc2cccc(O)c2C1 ZINC000877703399 1137686521 /nfs/dbraw/zinc/68/65/21/1137686521.db2.gz HDTAZVHQLVCDGC-UHFFFAOYSA-N 1 1 333.435 3.770 20 10 EHCDMO Cc1nn(Cc2ccccc2)c(C)c1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703399 1137686522 /nfs/dbraw/zinc/68/65/22/1137686522.db2.gz HDTAZVHQLVCDGC-UHFFFAOYSA-N 1 1 333.435 3.770 20 10 EHCDMO COc1ccc(-c2noc([C@H](C)[NH2+][C@@H](C)c3ccccc3O)n2)cc1 ZINC000879651250 1137753725 /nfs/dbraw/zinc/75/37/25/1137753725.db2.gz ONZSRYBDHJHHKM-STQMWFEESA-N 1 1 339.395 3.863 20 10 EHCDMO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883290966 1137852922 /nfs/dbraw/zinc/85/29/22/1137852922.db2.gz OJCWOMJLGKRNAV-KRWDZBQOSA-N 1 1 341.474 3.737 20 10 EHCDMO Cc1ccc(O)c(CNc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000883346065 1137856149 /nfs/dbraw/zinc/85/61/49/1137856149.db2.gz RBWOCTCOLJFKEE-FQEVSTJZSA-N 1 1 337.467 3.597 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000111911745 1137906061 /nfs/dbraw/zinc/90/60/61/1137906061.db2.gz BFMBPVRFYMOTEI-INIZCTEOSA-N 1 1 336.439 3.783 20 10 EHCDMO COc1cc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cc(OC)c1OC ZINC000886504138 1138085349 /nfs/dbraw/zinc/08/53/49/1138085349.db2.gz SPIRTBBKVDPJSN-RYUDHWBXSA-N 1 1 349.402 3.969 20 10 EHCDMO COC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(F)c(F)c1 ZINC000886562115 1138097532 /nfs/dbraw/zinc/09/75/32/1138097532.db2.gz QQYGOAWRVAXDKC-ZUZCIYMTSA-N 1 1 325.330 3.848 20 10 EHCDMO COCCOCc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886612412 1138102244 /nfs/dbraw/zinc/10/22/44/1138102244.db2.gz KSSIWDSCJYARGK-CQSZACIVSA-N 1 1 333.403 3.545 20 10 EHCDMO CCOCCO[C@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000138500212 1138103640 /nfs/dbraw/zinc/10/36/40/1138103640.db2.gz QBWJJNFCUQYMAU-KRWDZBQOSA-N 1 1 335.488 3.626 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@H](C)c1ccc(F)cc1O)O[C@H](C)C2 ZINC000184975081 1140129036 /nfs/dbraw/zinc/12/90/36/1140129036.db2.gz IDZZXMDOOMABPC-VXGBXAGGSA-N 1 1 331.387 3.714 20 10 EHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Br)cc2[O-])C1 ZINC000185112652 1140136770 /nfs/dbraw/zinc/13/67/70/1140136770.db2.gz PDWLMVLGEMBVLT-QWHCGFSZSA-N 1 1 341.293 3.537 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000274171253 1141481479 /nfs/dbraw/zinc/48/14/79/1141481479.db2.gz BBWWOOLBZYQZSE-LLVKDONJSA-N 1 1 335.350 3.967 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cccc4cnccc43)CC2)cc1 ZINC000183157826 1125458316 /nfs/dbraw/zinc/45/83/16/1125458316.db2.gz MNERCZOEYKMVOO-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@@H](c3ccccc3F)C1)CCC2 ZINC000066794226 1018014547 /nfs/dbraw/zinc/01/45/47/1018014547.db2.gz LZLFVXJAGTVKLC-HXUWFJFHSA-N 1 1 327.399 3.594 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3ccccc3F)C1)CCC2 ZINC000066794226 1018014563 /nfs/dbraw/zinc/01/45/63/1018014563.db2.gz LZLFVXJAGTVKLC-HXUWFJFHSA-N 1 1 327.399 3.594 20 10 EHCDMO Cc1noc(C[C@H]2CCC[N@@H+](Cc3c(O)cc(C)cc3Cl)C2)n1 ZINC000897577177 1032820424 /nfs/dbraw/zinc/82/04/24/1032820424.db2.gz OAGLGPFDDBYELT-CYBMUJFWSA-N 1 1 335.835 3.500 20 10 EHCDMO COc1cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c(O)cc1C ZINC000160516085 1019452304 /nfs/dbraw/zinc/45/23/04/1019452304.db2.gz DQDFAFORTDFZLW-FQEVSTJZSA-N 1 1 345.414 3.730 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c(O)cc1C ZINC000160516085 1019452310 /nfs/dbraw/zinc/45/23/10/1019452310.db2.gz DQDFAFORTDFZLW-FQEVSTJZSA-N 1 1 345.414 3.730 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@H](CC)c2ccc(C)cc2O)[C@@H](C)C1 ZINC000280054366 1020039510 /nfs/dbraw/zinc/03/95/10/1020039510.db2.gz JUZXNMPHUFRTPF-SXLOBPIMSA-N 1 1 348.531 3.878 20 10 EHCDMO Cc1cnc(C(C)(C)[NH2+]Cc2cccc(Br)c2O)s1 ZINC000175982339 1020433179 /nfs/dbraw/zinc/43/31/79/1020433179.db2.gz VCGDCJRGCZDDLU-UHFFFAOYSA-N 1 1 341.274 3.945 20 10 EHCDMO COCCOC[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000093754632 1032902721 /nfs/dbraw/zinc/90/27/21/1032902721.db2.gz LJWTYEKXPLDQCE-QGZVFWFLSA-N 1 1 341.451 3.544 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)Cc2ccc(C)o2)c1O ZINC000160846607 1020654977 /nfs/dbraw/zinc/65/49/77/1020654977.db2.gz VZNNOVVDFDUWJI-UHFFFAOYSA-N 1 1 340.217 3.697 20 10 EHCDMO 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CCN(CC)c1ccc(C[N@@H+](CCO)Cc2ccccc2OC)cc1 ZINC000768762763 1133174270 /nfs/dbraw/zinc/17/42/70/1133174270.db2.gz WQIKLYZOHANICQ-UHFFFAOYSA-N 1 1 342.483 3.536 20 10 EHCDMO CCOc1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)c(O)c1 ZINC000768918495 1133202631 /nfs/dbraw/zinc/20/26/31/1133202631.db2.gz JMWHNGGSYFGRIF-UHFFFAOYSA-N 1 1 337.423 3.609 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)c(O)c1 ZINC000768918495 1133202633 /nfs/dbraw/zinc/20/26/33/1133202633.db2.gz JMWHNGGSYFGRIF-UHFFFAOYSA-N 1 1 337.423 3.609 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000769299538 1133255989 /nfs/dbraw/zinc/25/59/89/1133255989.db2.gz QYABWEJGHKQDPG-INIZCTEOSA-N 1 1 334.460 3.614 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769307970 1133257696 /nfs/dbraw/zinc/25/76/96/1133257696.db2.gz MIFHEISZUXBYSH-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769307970 1133257702 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CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)C(C)(C)CO1 ZINC000769447815 1133292445 /nfs/dbraw/zinc/29/24/45/1133292445.db2.gz ZXDMEFMGQKUFIM-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC001180573696 1133388208 /nfs/dbraw/zinc/38/82/08/1133388208.db2.gz BCQUFRXHPLXYDW-AWEZNQCLSA-N 1 1 339.407 3.913 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC001180573696 1133388212 /nfs/dbraw/zinc/38/82/12/1133388212.db2.gz BCQUFRXHPLXYDW-AWEZNQCLSA-N 1 1 339.407 3.913 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cccc(OC(F)(F)F)c1 ZINC000770333017 1133406261 /nfs/dbraw/zinc/40/62/61/1133406261.db2.gz VDXKLCMMWZDTPP-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cc(Br)ccc1O ZINC000770303483 1133409391 /nfs/dbraw/zinc/40/93/91/1133409391.db2.gz HLAAONZNGOPPQM-UHFFFAOYSA-N 1 1 343.652 3.779 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCO)Cc2cccc(Cl)c2)cc1 ZINC000770352421 1133420597 /nfs/dbraw/zinc/42/05/97/1133420597.db2.gz YDCCEOSAOJVXPT-UHFFFAOYSA-N 1 1 332.875 3.791 20 10 EHCDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000770509769 1133435938 /nfs/dbraw/zinc/43/59/38/1133435938.db2.gz TUPBYFQXJQYBCS-ZBFHGGJFSA-N 1 1 334.460 3.660 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1Cl ZINC001182160010 1133580853 /nfs/dbraw/zinc/58/08/53/1133580853.db2.gz DIXJDRIAYUCERI-QGZVFWFLSA-N 1 1 342.870 3.991 20 10 EHCDMO C[N@H+](CCOc1ccccc1)Cc1cccc(Br)c1O ZINC000771930619 1133611919 /nfs/dbraw/zinc/61/19/19/1133611919.db2.gz NFKBFESLXAAILX-UHFFFAOYSA-N 1 1 336.229 3.666 20 10 EHCDMO C[N@@H+](CCOc1ccccc1)Cc1cccc(Br)c1O ZINC000771930619 1133611920 /nfs/dbraw/zinc/61/19/20/1133611920.db2.gz NFKBFESLXAAILX-UHFFFAOYSA-N 1 1 336.229 3.666 20 10 EHCDMO C[C@@H]([NH2+]CCOc1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000774193623 1133629862 /nfs/dbraw/zinc/62/98/62/1133629862.db2.gz UQMQKYVBINJJRQ-SNVBAGLBSA-N 1 1 327.211 3.824 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1cc(Cl)c(Cl)cc1O ZINC000774205693 1133633078 /nfs/dbraw/zinc/63/30/78/1133633078.db2.gz WFRUXLGTBALQMG-AAEUAGOBSA-N 1 1 340.250 3.953 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000774909421 1134117100 /nfs/dbraw/zinc/11/71/00/1134117100.db2.gz MSGKAZAFKGUFQB-WFASDCNBSA-N 1 1 346.383 3.875 20 10 EHCDMO CCn1cccc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)c1=O ZINC000788609560 1134145534 /nfs/dbraw/zinc/14/55/34/1134145534.db2.gz WAHVQSYCZKEALB-JTQLQIEISA-N 1 1 341.238 3.731 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2csc3ccccc23)ccc1[N+](=O)[O-] ZINC000774973367 1134171071 /nfs/dbraw/zinc/17/10/71/1134171071.db2.gz ADKMTAGDAHYTOJ-UHFFFAOYSA-N 1 1 344.392 3.814 20 10 EHCDMO Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788821705 1134177637 /nfs/dbraw/zinc/17/76/37/1134177637.db2.gz YPZSAODNMCGWOG-LLVKDONJSA-N 1 1 327.350 3.657 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](C)Cc2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000775026223 1134227760 /nfs/dbraw/zinc/22/77/60/1134227760.db2.gz ZRKQKIXDQORXSL-AWEZNQCLSA-N 1 1 344.411 3.647 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCN(Cc2ccc(F)cc2)CC1 ZINC001203663621 1134346724 /nfs/dbraw/zinc/34/67/24/1134346724.db2.gz BUXKSFNUMROTBE-UHFFFAOYSA-N 1 1 348.849 3.893 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1 ZINC000775138280 1134369220 /nfs/dbraw/zinc/36/92/20/1134369220.db2.gz NVMOMVWLGSRYNP-NVXWUHKLSA-N 1 1 344.421 3.668 20 10 EHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3cc(C)cc(OC)c3O)CCO2)cc1 ZINC000790462763 1134417570 /nfs/dbraw/zinc/41/75/70/1134417570.db2.gz YEMYNVCLMLYFMB-HXUWFJFHSA-N 1 1 341.451 3.845 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(F)c1 ZINC000790944295 1134483203 /nfs/dbraw/zinc/48/32/03/1134483203.db2.gz HRNQBUCCDWNVQX-HNNXBMFYSA-N 1 1 340.801 3.716 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@H](c1ccccc1)N(C)C ZINC000790992453 1134489470 /nfs/dbraw/zinc/48/94/70/1134489470.db2.gz ZUQXLEQGZWRKEP-XIKOKIGWSA-N 1 1 336.838 3.966 20 10 EHCDMO COc1ccccc1O[C@H](C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790971953 1134493296 /nfs/dbraw/zinc/49/32/96/1134493296.db2.gz BLSYWMXBSIZBHS-LLVKDONJSA-N 1 1 339.794 3.750 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc([S@@](C)=O)cc1 ZINC000790982877 1134496261 /nfs/dbraw/zinc/49/62/61/1134496261.db2.gz LFVFKKIFBIEJDT-MLMJSJRWSA-N 1 1 341.835 3.773 20 10 EHCDMO CCC[N@@H+]1CC[C@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930699 1134828453 /nfs/dbraw/zinc/82/84/53/1134828453.db2.gz QNSAOQHBYGWINP-CQSZACIVSA-N 1 1 343.437 3.593 20 10 EHCDMO CCC[N@H+]1CC[C@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930699 1134828460 /nfs/dbraw/zinc/82/84/60/1134828460.db2.gz QNSAOQHBYGWINP-CQSZACIVSA-N 1 1 343.437 3.593 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CN(C2CCCCC2)C(=O)O1 ZINC001191277528 1134839066 /nfs/dbraw/zinc/83/90/66/1134839066.db2.gz LHCBYRJHBYMUQN-GOSISDBHSA-N 1 1 346.471 3.758 20 10 EHCDMO COc1ccc(CNC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c(O)c1 ZINC000793390884 1134922000 /nfs/dbraw/zinc/92/20/00/1134922000.db2.gz TYJJNMXOBMCDDR-QAPCUYQASA-N 1 1 332.488 3.534 20 10 EHCDMO Cc1ccc(NC(=O)C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)cc1 ZINC000775638341 1135369912 /nfs/dbraw/zinc/36/99/12/1135369912.db2.gz AOTUCBORAKBQOL-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Cc1ccc(NC(=O)C[N@H+](C)Cc2cc(Cl)cc(C)c2O)cc1 ZINC000775638341 1135369918 /nfs/dbraw/zinc/36/99/18/1135369918.db2.gz AOTUCBORAKBQOL-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)c1O ZINC000775676087 1135499021 /nfs/dbraw/zinc/49/90/21/1135499021.db2.gz KUDCEFZTIJSINC-QGZVFWFLSA-N 1 1 349.377 3.876 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC001130895281 1135533180 /nfs/dbraw/zinc/53/31/80/1135533180.db2.gz LODSBIAGDBYULN-IBGZPJMESA-N 1 1 339.483 3.697 20 10 EHCDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Br)cc(C)c1O ZINC000775723934 1135575976 /nfs/dbraw/zinc/57/59/76/1135575976.db2.gz KPORYZVMUKUJQX-CYBMUJFWSA-N 1 1 330.291 3.791 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cc1OC ZINC000775738277 1135599775 /nfs/dbraw/zinc/59/97/75/1135599775.db2.gz YGJGSJLOWSBLEG-NSHDSACASA-N 1 1 349.377 3.807 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cc1OC ZINC000775738277 1135599778 /nfs/dbraw/zinc/59/97/78/1135599778.db2.gz YGJGSJLOWSBLEG-NSHDSACASA-N 1 1 349.377 3.807 20 10 EHCDMO C[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1c1cccc(F)c1 ZINC000747467494 1135633698 /nfs/dbraw/zinc/63/36/98/1135633698.db2.gz PHPIRNKHWVOMCS-BUXKBTBVSA-N 1 1 329.371 3.843 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CCCSC2)c1 ZINC000808429635 1135674354 /nfs/dbraw/zinc/67/43/54/1135674354.db2.gz FVPAYDBEYAWUDX-LLVKDONJSA-N 1 1 330.291 3.696 20 10 EHCDMO C[N@H+](Cc1cc[nH]n1)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000809575075 1135852646 /nfs/dbraw/zinc/85/26/46/1135852646.db2.gz YRZQJBLVYKXSDL-UHFFFAOYSA-N 1 1 332.451 3.604 20 10 EHCDMO C[N@@H+](Cc1cc[nH]n1)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000809575075 1135852653 /nfs/dbraw/zinc/85/26/53/1135852653.db2.gz YRZQJBLVYKXSDL-UHFFFAOYSA-N 1 1 332.451 3.604 20 10 EHCDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(O)ccc(Cl)c1F ZINC000809688199 1135872056 /nfs/dbraw/zinc/87/20/56/1135872056.db2.gz DUZBFSNNJXWUEK-UHFFFAOYSA-N 1 1 338.766 3.767 20 10 EHCDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(O)ccc(Cl)c1F ZINC000809688199 1135872060 /nfs/dbraw/zinc/87/20/60/1135872060.db2.gz DUZBFSNNJXWUEK-UHFFFAOYSA-N 1 1 338.766 3.767 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)C[C@H]2CCCOC2)cc1 ZINC000809731907 1135873692 /nfs/dbraw/zinc/87/36/92/1135873692.db2.gz WPYQWKGXMOWSNJ-GOSISDBHSA-N 1 1 328.456 3.774 20 10 EHCDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809757511 1135887059 /nfs/dbraw/zinc/88/70/59/1135887059.db2.gz PCTCYOWBNFYJSJ-GOSISDBHSA-N 1 1 333.435 3.782 20 10 EHCDMO CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810215469 1135938428 /nfs/dbraw/zinc/93/84/28/1135938428.db2.gz FWGBRLVVVIRBQT-HNNXBMFYSA-N 1 1 330.394 3.794 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)CN1C(=O)C(C)(C)[C@H]1C1CC1 ZINC000811736791 1136132820 /nfs/dbraw/zinc/13/28/20/1136132820.db2.gz VZFWJNOHFXCPOV-LJQANCHMSA-N 1 1 343.515 3.568 20 10 EHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825537311 1136165060 /nfs/dbraw/zinc/16/50/60/1136165060.db2.gz VBQMMJJCOWUKBZ-ZDUSSCGKSA-N 1 1 342.277 3.793 20 10 EHCDMO COc1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)c(O)c(C(C)(C)C)c1 ZINC000850193491 1136218663 /nfs/dbraw/zinc/21/86/63/1136218663.db2.gz UMRZKKKQEQBFFR-INIZCTEOSA-N 1 1 329.444 3.589 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H](C)c2ccccn2)c1 ZINC000850342649 1136237826 /nfs/dbraw/zinc/23/78/26/1136237826.db2.gz MFLIWVQPINLCHN-LBPRGKRZSA-N 1 1 335.245 3.751 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cn(CC)nn2)cc1 ZINC000850366313 1136241970 /nfs/dbraw/zinc/24/19/70/1136241970.db2.gz RTPOKKKIGRYDHW-UHFFFAOYSA-N 1 1 349.482 3.614 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000850483440 1136267658 /nfs/dbraw/zinc/26/76/58/1136267658.db2.gz YQUCHHKZCBCHRV-VXGBXAGGSA-N 1 1 330.394 3.934 20 10 EHCDMO C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000850581082 1136292276 /nfs/dbraw/zinc/29/22/76/1136292276.db2.gz CXRUYMRDEOKKDH-DYVFJYSZSA-N 1 1 332.463 3.791 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000814178179 1136411822 /nfs/dbraw/zinc/41/18/22/1136411822.db2.gz FVQDIZZMAACKPR-FQEVSTJZSA-N 1 1 328.500 3.925 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)ccc1N(C)C ZINC000852743910 1136482522 /nfs/dbraw/zinc/48/25/22/1136482522.db2.gz OAQFHZGTCNNCNF-DZGCQCFKSA-N 1 1 330.394 3.603 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)ccc1N(C)C ZINC000852743910 1136482524 /nfs/dbraw/zinc/48/25/24/1136482524.db2.gz OAQFHZGTCNNCNF-DZGCQCFKSA-N 1 1 330.394 3.603 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CCC[NH3+])c1[O-] ZINC000852759244 1136483825 /nfs/dbraw/zinc/48/38/25/1136483825.db2.gz MCCQOEPPMZSZMN-SJKOYZFVSA-N 1 1 338.879 3.588 20 10 EHCDMO Cc1nn(C)c(C)c1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000111232844 1136524447 /nfs/dbraw/zinc/52/44/47/1136524447.db2.gz GOUJCUUNIJFRHX-UHFFFAOYSA-N 1 1 325.412 3.538 20 10 EHCDMO Cc1nn(C)c(C)c1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000111232844 1136524449 /nfs/dbraw/zinc/52/44/49/1136524449.db2.gz GOUJCUUNIJFRHX-UHFFFAOYSA-N 1 1 325.412 3.538 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)cc(OC)c1 ZINC000815024025 1136541928 /nfs/dbraw/zinc/54/19/28/1136541928.db2.gz PGJQYYHHWSMQPY-UHFFFAOYSA-N 1 1 328.456 3.710 20 10 EHCDMO Cc1ccc(O)c([C@@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c1 ZINC000854222296 1136599008 /nfs/dbraw/zinc/59/90/08/1136599008.db2.gz DZWVLHPLNRVEJZ-LSBZLQRGSA-N 1 1 328.431 3.636 20 10 EHCDMO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H](C)c2cc(C)ccc2O)cc1 ZINC000854223358 1136599110 /nfs/dbraw/zinc/59/91/10/1136599110.db2.gz DILZGXMICWJFBK-QSFXBCCZSA-N 1 1 340.467 3.506 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000815578628 1136613658 /nfs/dbraw/zinc/61/36/58/1136613658.db2.gz SHYYBDUALRUDIC-WCQYABFASA-N 1 1 328.378 3.546 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C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc2ccccc2n1 ZINC000817942507 1136849146 /nfs/dbraw/zinc/84/91/46/1136849146.db2.gz PCXJQVIZENCHMC-HNAYVOBHSA-N 1 1 334.467 3.651 20 10 EHCDMO C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964397 1136851940 /nfs/dbraw/zinc/85/19/40/1136851940.db2.gz BEWQNWDTYHUBHN-OXQOHEQNSA-N 1 1 333.495 3.856 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000858100585 1136939927 /nfs/dbraw/zinc/93/99/27/1136939927.db2.gz KQFRRVWIZXRZED-NSHDSACASA-N 1 1 335.354 3.790 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858567362 1136979304 /nfs/dbraw/zinc/97/93/04/1136979304.db2.gz BTTBNEQTOQJMCR-LLVKDONJSA-N 1 1 345.361 3.952 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1O ZINC000821333077 1137022782 /nfs/dbraw/zinc/02/27/82/1137022782.db2.gz XXLLNFFUTJVJPQ-CQSZACIVSA-N 1 1 328.387 3.509 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822530247 1137062540 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CCC[N@@H+](Cc1c(C(F)(F)F)cnn1C)Cc1ccccc1O ZINC000824650042 1137146255 /nfs/dbraw/zinc/14/62/55/1137146255.db2.gz LQAPDKFCPDTHLX-UHFFFAOYSA-N 1 1 327.350 3.557 20 10 EHCDMO FC(F)(F)Oc1ccc2c(c1)CCCN2Cc1c[nH+]c2n1CCC2 ZINC000825461951 1137178577 /nfs/dbraw/zinc/17/85/77/1137178577.db2.gz UQHLRQDJWTYUIV-UHFFFAOYSA-N 1 1 337.345 3.681 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000825484433 1137181206 /nfs/dbraw/zinc/18/12/06/1137181206.db2.gz LQKMDGJHCCOQEE-AWEZNQCLSA-N 1 1 347.256 3.614 20 10 EHCDMO CCCc1nc(C)c(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)o1 ZINC000844401469 1137217279 /nfs/dbraw/zinc/21/72/79/1137217279.db2.gz MDBXNBRSUSLTJF-UHFFFAOYSA-N 1 1 331.460 3.512 20 10 EHCDMO COc1cc(C[N@@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000794653253 1137223832 /nfs/dbraw/zinc/22/38/32/1137223832.db2.gz LKEOOJVHTFQAQS-UGSOOPFHSA-N 1 1 333.472 3.698 20 10 EHCDMO CC(C)[N@@H+]1CC[C@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000794698635 1137235616 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Oc1cc(O)c(C[N@@H+](Cc2ccccn2)C2CCCCC2)c(O)c1 ZINC001144514510 1137304206 /nfs/dbraw/zinc/30/42/06/1137304206.db2.gz INJNBCCXSKWKMN-UHFFFAOYSA-N 1 1 328.412 3.533 20 10 EHCDMO COc1cccc([C@H](C)N[C@H](C[NH+]2CCCC2)c2ccccc2)c1O ZINC000846136672 1137338164 /nfs/dbraw/zinc/33/81/64/1137338164.db2.gz MVVUJCBOIOWWLW-QFBILLFUSA-N 1 1 340.467 3.889 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2C[C@@H](c3cnn(C)c3)C(C)(C)C2)cc1 ZINC000846932355 1137376117 /nfs/dbraw/zinc/37/61/17/1137376117.db2.gz RRHCUODLXAPUGG-IBGZPJMESA-N 1 1 326.488 3.502 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2nccn2CC(F)(F)F)cc1C ZINC000873038364 1137588587 /nfs/dbraw/zinc/58/85/87/1137588587.db2.gz PHLCBILZEZTDQC-UHFFFAOYSA-N 1 1 341.377 3.832 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(OC)c(Cn2cccn2)c1)c1nccs1 ZINC000873057610 1137589071 /nfs/dbraw/zinc/58/90/71/1137589071.db2.gz VXCZYCWBDRNMRX-INIZCTEOSA-N 1 1 342.468 3.637 20 10 EHCDMO CC(C)OC1(C[NH2+]Cc2cccc(Br)c2O)CCC1 ZINC000873166831 1137591908 /nfs/dbraw/zinc/59/19/08/1137591908.db2.gz KEEUTSDCVVHRIG-UHFFFAOYSA-N 1 1 328.250 3.592 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc(Cl)nn1 ZINC000876511356 1137654388 /nfs/dbraw/zinc/65/43/88/1137654388.db2.gz GFPVQTYSCORRTK-UHFFFAOYSA-N 1 1 330.863 3.752 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc(Cl)nn1 ZINC000876511356 1137654389 /nfs/dbraw/zinc/65/43/89/1137654389.db2.gz GFPVQTYSCORRTK-UHFFFAOYSA-N 1 1 330.863 3.752 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876535891 1137654906 /nfs/dbraw/zinc/65/49/06/1137654906.db2.gz SHGADMLJPSLTGZ-UHFFFAOYSA-N 1 1 344.886 3.933 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@@H]3C3CCCC3)cc2)CC1 ZINC000876632313 1137657727 /nfs/dbraw/zinc/65/77/27/1137657727.db2.gz IUVDIMYCYTUMFS-OAQYLSRUSA-N 1 1 328.500 3.802 20 10 EHCDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876721018 1137659741 /nfs/dbraw/zinc/65/97/41/1137659741.db2.gz OUTBBVWWZWNWQS-INIZCTEOSA-N 1 1 340.467 3.546 20 10 EHCDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 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CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)cc1F ZINC000271224777 1141328645 /nfs/dbraw/zinc/32/86/45/1141328645.db2.gz ACKRIICHIPLTGF-QAPCUYQASA-N 1 1 332.419 3.573 20 10 EHCDMO C[N@@H+](CCCc1ccsc1)Cc1ccc(N2CCOCC2)cc1 ZINC000782900101 1016590692 /nfs/dbraw/zinc/59/06/92/1016590692.db2.gz FJEMIKVAOSBFDC-UHFFFAOYSA-N 1 1 330.497 3.649 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(F)cc1O ZINC000185134231 1032352493 /nfs/dbraw/zinc/35/24/93/1032352493.db2.gz BPPIMOSGKPCNSJ-LBPRGKRZSA-N 1 1 329.350 3.707 20 10 EHCDMO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cc2c(cc1O)CCC2 ZINC000177176900 1017594194 /nfs/dbraw/zinc/59/41/94/1017594194.db2.gz SZXPPDXDSVSSQF-UHFFFAOYSA-N 1 1 328.481 3.848 20 10 EHCDMO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cc2c(cc1O)CCC2 ZINC000177176900 1017594204 /nfs/dbraw/zinc/59/42/04/1017594204.db2.gz SZXPPDXDSVSSQF-UHFFFAOYSA-N 1 1 328.481 3.848 20 10 EHCDMO CCOC[C@H]1CC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000177632882 1017913592 /nfs/dbraw/zinc/91/35/92/1017913592.db2.gz 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Cc1cc(C)c([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)c(O)c1 ZINC000296590322 1021392114 /nfs/dbraw/zinc/39/21/14/1021392114.db2.gz UXLZRVIMRQVXIX-LLVKDONJSA-N 1 1 325.334 3.669 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c(O)c1OC ZINC000891553465 1021914884 /nfs/dbraw/zinc/91/48/84/1021914884.db2.gz NJWUNZDYZLSGRX-LLVKDONJSA-N 1 1 337.366 3.881 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c(O)c1OC ZINC000894525591 1022477126 /nfs/dbraw/zinc/47/71/26/1022477126.db2.gz FMRZKEAURQSPIZ-BETUJISGSA-N 1 1 347.377 3.962 20 10 EHCDMO CC1(C)C[NH+](Cc2cc(Br)ccc2O)CC(C)(C)O1 ZINC000226455503 1033123267 /nfs/dbraw/zinc/12/32/67/1033123267.db2.gz PIYOSMDXRZILMJ-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(OC)c(C)cc3O)C2)cc1 ZINC000160065280 1024102170 /nfs/dbraw/zinc/10/21/70/1024102170.db2.gz JHNZVUQIXAGDRB-MRXNPFEDSA-N 1 1 327.424 3.707 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000896228490 1025263113 /nfs/dbraw/zinc/26/31/13/1025263113.db2.gz RSGROCANPDETFU-CQSZACIVSA-N 1 1 333.325 3.657 20 10 EHCDMO Cc1cc([C@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)nn1C ZINC000281951166 1025773953 /nfs/dbraw/zinc/77/39/53/1025773953.db2.gz AOTVWFGMLQYXST-KRWDZBQOSA-N 1 1 326.488 3.816 20 10 EHCDMO O=C1C[C@@H](c2ccccc2)[N@@H+](Cc2c(O)ccc3ccccc32)CCN1 ZINC000122030818 1026158608 /nfs/dbraw/zinc/15/86/08/1026158608.db2.gz XMBZLGDZDNCQPM-FQEVSTJZSA-N 1 1 346.430 3.609 20 10 EHCDMO COc1cc(O)c(C[N@H+](C)Cc2nc3ccccc3s2)cc1OC ZINC000158838094 1026353714 /nfs/dbraw/zinc/35/37/14/1026353714.db2.gz CVBJZVCKPPRPQZ-UHFFFAOYSA-N 1 1 344.436 3.651 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2nc3ccccc3s2)cc1OC ZINC000158838094 1026353727 /nfs/dbraw/zinc/35/37/27/1026353727.db2.gz CVBJZVCKPPRPQZ-UHFFFAOYSA-N 1 1 344.436 3.651 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273437289 1027424399 /nfs/dbraw/zinc/42/43/99/1027424399.db2.gz MFXWBSKPSJTHEW-KKUMJFAQSA-N 1 1 347.459 3.604 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OC)c(Cl)c2)c1 ZINC000273490680 1027454231 /nfs/dbraw/zinc/45/42/31/1027454231.db2.gz OGMQIAOSCBCADW-LLVKDONJSA-N 1 1 349.814 3.692 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000273615742 1027520889 /nfs/dbraw/zinc/52/08/89/1027520889.db2.gz XGZKUQHHFZFFOC-LLVKDONJSA-N 1 1 348.468 3.784 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)cc1OC ZINC000160228637 1030610370 /nfs/dbraw/zinc/61/03/70/1030610370.db2.gz GIGPFWNFXOPKOQ-MRXNPFEDSA-N 1 1 345.464 3.700 20 10 EHCDMO COc1ccc(O)c(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1 ZINC000181363584 1031979864 /nfs/dbraw/zinc/97/98/64/1031979864.db2.gz KYBUGRRQJSKZRM-HXUWFJFHSA-N 1 1 339.391 3.882 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000195133524 1032046611 /nfs/dbraw/zinc/04/66/11/1032046611.db2.gz ZFRAFUZPLGEOIB-WMZOPIPTSA-N 1 1 340.467 3.574 20 10 EHCDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000171936786 1034724270 /nfs/dbraw/zinc/72/42/70/1034724270.db2.gz PZTYOBQTNSTCTN-ZDUSSCGKSA-N 1 1 332.831 3.813 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCc3nc(C(C)(C)C)ncc3C2)c1 ZINC000530101560 1034964534 /nfs/dbraw/zinc/96/45/34/1034964534.db2.gz ITAZPJQEMLJCCJ-UHFFFAOYSA-N 1 1 325.456 3.655 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c1O ZINC000186443100 1035636441 /nfs/dbraw/zinc/63/64/41/1035636441.db2.gz MXRLDQYYMCGNKX-LJQANCHMSA-N 1 1 345.826 3.686 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@]3(C)COC(=O)N3)C2)cc1C(C)C ZINC000905707659 1039045929 /nfs/dbraw/zinc/04/59/29/1039045929.db2.gz LBAFMEJAWIKPDI-JXFKEZNVSA-N 1 1 346.471 3.535 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+](Cc1cccc(F)c1)C1CCC1)[C@H](O)CO2 ZINC000905748130 1039054420 /nfs/dbraw/zinc/05/44/20/1039054420.db2.gz DYKOLHIZMDJRMX-LJQANCHMSA-N 1 1 343.398 3.512 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c(O)cc1C ZINC000905732988 1039069196 /nfs/dbraw/zinc/06/91/96/1039069196.db2.gz DYZDHEXKZWJKGA-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO C[C@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000905741904 1039078117 /nfs/dbraw/zinc/07/81/17/1039078117.db2.gz OYNPZBCVKXCAMJ-DJKXOVBDSA-N 1 1 339.435 3.586 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(c2c[nH]c3ncccc23)CC1 ZINC000893961021 1039862179 /nfs/dbraw/zinc/86/21/79/1039862179.db2.gz BELPBNSSSMCFMZ-UHFFFAOYSA-N 1 1 343.377 3.926 20 10 EHCDMO C[N@@H+](CCO[C@@H]1CCCCO1)Cc1ccc(N2CCCCC2)cc1 ZINC000193040975 1040967032 /nfs/dbraw/zinc/96/70/32/1040967032.db2.gz HDRUAJSEOSYKNK-HXUWFJFHSA-N 1 1 332.488 3.652 20 10 EHCDMO COc1cc(C[N@@H+]2CCc3cccc(O)c3C2)cc(C(F)(F)F)c1 ZINC001143519123 1042393248 /nfs/dbraw/zinc/39/32/48/1042393248.db2.gz GFLGKYCFICQUAI-UHFFFAOYSA-N 1 1 337.341 3.978 20 10 EHCDMO COc1cc(C[N@H+]2CCc3cccc(O)c3C2)cc(C(F)(F)F)c1 ZINC001143519123 1042393257 /nfs/dbraw/zinc/39/32/57/1042393257.db2.gz GFLGKYCFICQUAI-UHFFFAOYSA-N 1 1 337.341 3.978 20 10 EHCDMO Cc1cc2c[nH+]c(NCc3cc(Cl)c4cccnc4c3O)nc2[nH]1 ZINC001168528280 1126908480 /nfs/dbraw/zinc/90/84/80/1126908480.db2.gz SCWYBQUQZRZFLI-UHFFFAOYSA-N 1 1 339.786 3.737 20 10 EHCDMO CN1CCCc2cc(CNC3CC[NH+](C4CCCCC4)CC3)ccc21 ZINC000765484235 1127617726 /nfs/dbraw/zinc/61/77/26/1127617726.db2.gz ACMSGMRPGYRXSH-UHFFFAOYSA-N 1 1 341.543 3.956 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1nncn1C ZINC000765747085 1127764337 /nfs/dbraw/zinc/76/43/37/1127764337.db2.gz BLAQFEWFKIGAEW-JKSUJKDBSA-N 1 1 327.476 3.607 20 10 EHCDMO C[C@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872685 1128629132 /nfs/dbraw/zinc/62/91/32/1128629132.db2.gz KOBWENHZFIJXKY-QFBILLFUSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872685 1128629137 /nfs/dbraw/zinc/62/91/37/1128629137.db2.gz KOBWENHZFIJXKY-QFBILLFUSA-N 1 1 345.506 3.951 20 10 EHCDMO COc1ccc([C@H]2C[C@H]([N@@H+](C)Cc3ccccc3O)CCO2)cc1 ZINC001168665128 1128744876 /nfs/dbraw/zinc/74/48/76/1128744876.db2.gz MJIBROKVSDWKHQ-YLJYHZDGSA-N 1 1 327.424 3.753 20 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EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc(F)c1F ZINC000775152200 1134397681 /nfs/dbraw/zinc/39/76/81/1134397681.db2.gz MNPCOGMAADZUNP-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCCOCCc1ccccc1 ZINC000790949736 1134483997 /nfs/dbraw/zinc/48/39/97/1134483997.db2.gz ZHINRYCAXGVBSR-UHFFFAOYSA-N 1 1 337.822 3.924 20 10 EHCDMO CC(C)(C)OC(=O)NC(C)(C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790974921 1134493783 /nfs/dbraw/zinc/49/37/83/1134493783.db2.gz WGDNKQIVBYNCFK-UHFFFAOYSA-N 1 1 346.830 3.578 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C[C@@H](O)COc2ccccc2)C(C)C)cc1C ZINC000775201958 1134510410 /nfs/dbraw/zinc/51/04/10/1134510410.db2.gz WPXDIOPSRPSFAJ-LJQANCHMSA-N 1 1 343.467 3.659 20 10 EHCDMO COc1c(Br)cccc1CNc1ccc2c(c1)[nH+]cn2C ZINC000775313849 1134626699 /nfs/dbraw/zinc/62/66/99/1134626699.db2.gz KFPBAYRUVWJIEW-UHFFFAOYSA-N 1 1 346.228 3.957 20 10 EHCDMO CC[N@@H+](C)[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775406667 1134741463 /nfs/dbraw/zinc/74/14/63/1134741463.db2.gz ZIDNCGUNWLJYTQ-JXFKEZNVSA-N 1 1 339.483 3.623 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2ncccc2F)c(C(F)(F)F)c1 ZINC000793021871 1134843689 /nfs/dbraw/zinc/84/36/89/1134843689.db2.gz QIOSCNZPBNOHSG-UHFFFAOYSA-N 1 1 327.325 3.595 20 10 EHCDMO Cc1ccc([C@H]2CC[N@@H+](Cc3cc4c(cc3O)OCO4)C2)c(C)c1 ZINC000793231197 1134879600 /nfs/dbraw/zinc/87/96/00/1134879600.db2.gz AOVIGMPPYHKQBG-HNNXBMFYSA-N 1 1 325.408 3.727 20 10 EHCDMO C[N@@H+](CCCN(C(=O)OC(C)(C)C)C1CC1)Cc1ccccc1O ZINC001191681802 1134898337 /nfs/dbraw/zinc/89/83/37/1134898337.db2.gz IKXKYBBXMRIZSH-UHFFFAOYSA-N 1 1 334.460 3.614 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000793607193 1134968661 /nfs/dbraw/zinc/96/86/61/1134968661.db2.gz PKFHRAHNCHCNHB-UHFFFAOYSA-N 1 1 336.357 3.522 20 10 EHCDMO C[C@@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc(F)cc1O ZINC000775562956 1135098741 /nfs/dbraw/zinc/09/87/41/1135098741.db2.gz OOOAGBRFDRZJJA-SNVBAGLBSA-N 1 1 333.794 3.922 20 10 EHCDMO C[C@H](C[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CO)c1ccccc1 ZINC000805820877 1135336540 /nfs/dbraw/zinc/33/65/40/1135336540.db2.gz ZSVXKMCDCAZIDM-MSOLQXFVSA-N 1 1 326.484 3.739 20 10 EHCDMO C[NH+]1CCN(c2ccc(C[N@@H+](Cc3cccs3)C3CC3)cc2)CC1 ZINC000775648723 1135406365 /nfs/dbraw/zinc/40/63/65/1135406365.db2.gz IVCGRAIFBXCYID-UHFFFAOYSA-N 1 1 341.524 3.665 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](Cc3cccs3)C3CC3)cc2)CC1 ZINC000775648723 1135406368 /nfs/dbraw/zinc/40/63/68/1135406368.db2.gz IVCGRAIFBXCYID-UHFFFAOYSA-N 1 1 341.524 3.665 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](Cc3cccs3)C3CC3)cc2)CC1 ZINC000775648723 1135406370 /nfs/dbraw/zinc/40/63/70/1135406370.db2.gz IVCGRAIFBXCYID-UHFFFAOYSA-N 1 1 341.524 3.665 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000775660478 1135434173 /nfs/dbraw/zinc/43/41/73/1135434173.db2.gz WFPMCIRQLJQQML-HNNXBMFYSA-N 1 1 326.843 3.635 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)c1O ZINC000775674659 1135488399 /nfs/dbraw/zinc/48/83/99/1135488399.db2.gz HWWNERMWCSLIMH-QGZVFWFLSA-N 1 1 325.408 3.809 20 10 EHCDMO CC[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccc(N(C)C)cc1 ZINC000807271582 1135532093 /nfs/dbraw/zinc/53/20/93/1135532093.db2.gz ZFOJDLAUVKDIIA-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](N4CCCC4)[C@@H]3C)c2c1 ZINC000808190143 1135628171 /nfs/dbraw/zinc/62/81/71/1135628171.db2.gz CUJGADQSIPKJGD-MGPUTAFESA-N 1 1 340.467 3.613 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CC[C@@H]([NH+]4CCCC4)[C@@H]3C)c2c1 ZINC000808190143 1135628175 /nfs/dbraw/zinc/62/81/75/1135628175.db2.gz CUJGADQSIPKJGD-MGPUTAFESA-N 1 1 340.467 3.613 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](N4CCCC4)[C@H]3C)c2c1 ZINC000808190144 1135628254 /nfs/dbraw/zinc/62/82/54/1135628254.db2.gz CUJGADQSIPKJGD-QRWLVFNGSA-N 1 1 340.467 3.613 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CC[C@H]([NH+]4CCCC4)[C@H]3C)c2c1 ZINC000808190144 1135628258 /nfs/dbraw/zinc/62/82/58/1135628258.db2.gz CUJGADQSIPKJGD-QRWLVFNGSA-N 1 1 340.467 3.613 20 10 EHCDMO CCCCN(C)C[C@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000808454004 1135670666 /nfs/dbraw/zinc/67/06/66/1135670666.db2.gz FCLQIAVHLWTGRG-ZDUSSCGKSA-N 1 1 343.309 3.673 20 10 EHCDMO NC(=O)c1cccc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)c1 ZINC000104078822 1135748310 /nfs/dbraw/zinc/74/83/10/1135748310.db2.gz IULSORLUKJANNG-UHFFFAOYSA-N 1 1 338.451 3.826 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)c1O ZINC000775871348 1135833314 /nfs/dbraw/zinc/83/33/14/1135833314.db2.gz REKCHCZBTPHQIE-IRXDYDNUSA-N 1 1 339.863 3.932 20 10 EHCDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc(Br)ccc1O ZINC000809701549 1135869590 /nfs/dbraw/zinc/86/95/90/1135869590.db2.gz GQXBJRNIRRIQAW-SWLSCSKDSA-N 1 1 342.277 3.670 20 10 EHCDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)Cc1cc(C)ccc1O ZINC000809735464 1135873640 /nfs/dbraw/zinc/87/36/40/1135873640.db2.gz HKYNJPQEZKVISM-HXUWFJFHSA-N 1 1 339.483 3.582 20 10 EHCDMO C[C@@H](COc1cccc(F)c1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199659325 1135917917 /nfs/dbraw/zinc/91/79/17/1135917917.db2.gz YEWPBEYDCVEQBA-JTQLQIEISA-N 1 1 327.758 3.881 20 10 EHCDMO CC(C)[N@@H+](C)C[C@@H](C)NCc1ccc(N(C)C)cc1C(F)(F)F ZINC000811516111 1136097554 /nfs/dbraw/zinc/09/75/54/1136097554.db2.gz POXWHFZPFYMQKM-CYBMUJFWSA-N 1 1 331.426 3.590 20 10 EHCDMO CC(C)[N@H+](C)C[C@@H](C)NCc1ccc(N(C)C)cc1C(F)(F)F ZINC000811516111 1136097555 /nfs/dbraw/zinc/09/75/55/1136097555.db2.gz POXWHFZPFYMQKM-CYBMUJFWSA-N 1 1 331.426 3.590 20 10 EHCDMO COc1cc(C[NH2+]C2CCN(CC3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850036389 1136200919 /nfs/dbraw/zinc/20/09/19/1136200919.db2.gz KKYUSQHNUSRYNU-UHFFFAOYSA-N 1 1 346.515 3.662 20 10 EHCDMO COc1cc(CNC2CC[NH+](CC3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850036389 1136200922 /nfs/dbraw/zinc/20/09/22/1136200922.db2.gz KKYUSQHNUSRYNU-UHFFFAOYSA-N 1 1 346.515 3.662 20 10 EHCDMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109772882 1136340195 /nfs/dbraw/zinc/34/01/95/1136340195.db2.gz YCSAPTWTXFVVRC-CYBMUJFWSA-N 1 1 332.831 3.813 20 10 EHCDMO CCCc1nc(C)c(C[NH2+]Cc2cccc(Br)c2O)o1 ZINC000813792925 1136363574 /nfs/dbraw/zinc/36/35/74/1136363574.db2.gz ZYQYIFPEMXKPQO-UHFFFAOYSA-N 1 1 339.233 3.693 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCN(c3cccc(F)c3)C[C@H]2C)c1O ZINC000814178336 1136411845 /nfs/dbraw/zinc/41/18/45/1136411845.db2.gz MMIANDIHZHSAKU-OAHLLOKOSA-N 1 1 344.430 3.641 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1O ZINC000814177313 1136411875 /nfs/dbraw/zinc/41/18/75/1136411875.db2.gz ZLPFVCDELKVSNT-WBVHZDCISA-N 1 1 346.471 3.532 20 10 EHCDMO CC[N@@H+](CCC1CCOCC1)Cc1cc(Br)ccc1O ZINC000814624513 1136481636 /nfs/dbraw/zinc/48/16/36/1136481636.db2.gz BHCHWZNUACYMRR-UHFFFAOYSA-N 1 1 342.277 3.793 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@H]1c1ccco1)[C@H](O)CO2 ZINC000853538699 1136542182 /nfs/dbraw/zinc/54/21/82/1136542182.db2.gz JFGGTWAPCGCYHQ-VQIMIIECSA-N 1 1 341.407 3.528 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c1 ZINC000853552115 1136544183 /nfs/dbraw/zinc/54/41/83/1136544183.db2.gz VSVLNSUISIYGQV-IBGZPJMESA-N 1 1 327.424 3.956 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C(=O)NC(C)C)C2)cc1C(C)C ZINC000853601946 1136548122 /nfs/dbraw/zinc/54/81/22/1136548122.db2.gz FAGZJZRKMBWUHQ-INIZCTEOSA-N 1 1 332.488 3.561 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)cc1 ZINC000815120089 1136552234 /nfs/dbraw/zinc/55/22/34/1136552234.db2.gz AFZRWYIAJUYVKA-IAGOWNOFSA-N 1 1 345.531 3.610 20 10 EHCDMO C[C@H]([NH2+]Cc1cn2ccsc2n1)c1cccc(C(F)(F)F)c1O ZINC000815567269 1136611851 /nfs/dbraw/zinc/61/18/51/1136611851.db2.gz SKPYTURLPSFHNE-VIFPVBQESA-N 1 1 341.358 3.971 20 10 EHCDMO C[C@@H]([NH2+]CCCOC[C@@H]1CCOC1)c1cccc(C(F)(F)F)c1O ZINC000815582599 1136614703 /nfs/dbraw/zinc/61/47/03/1136614703.db2.gz KRQMPDRMBIENEV-OLZOCXBDSA-N 1 1 347.377 3.505 20 10 EHCDMO CC(C)COC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccco1 ZINC000113332108 1136697429 /nfs/dbraw/zinc/69/74/29/1136697429.db2.gz DYEKIQXHCJZVKJ-KRWDZBQOSA-N 1 1 334.435 3.988 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnn(CC(F)F)c1)C1CCCC1 ZINC000816508849 1136728740 /nfs/dbraw/zinc/72/87/40/1136728740.db2.gz WPQLEGPWPYFDLS-UHFFFAOYSA-N 1 1 335.398 3.799 20 10 EHCDMO CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816557961 1136736640 /nfs/dbraw/zinc/73/66/40/1136736640.db2.gz HTFGYMFVPCYCTI-CYBMUJFWSA-N 1 1 328.859 3.642 20 10 EHCDMO Cc1ccc(CN(CC[NH+](C)C)Cc2cc(Cl)c(F)cc2O)o1 ZINC000816610379 1136741285 /nfs/dbraw/zinc/74/12/85/1136741285.db2.gz IPTIMKAPCMPYFG-UHFFFAOYSA-N 1 1 340.826 3.650 20 10 EHCDMO C[N@H+]1CCN(Cc2cccc(Br)c2O)c2ccccc2C1 ZINC000816618338 1136742587 /nfs/dbraw/zinc/74/25/87/1136742587.db2.gz VDFCQEDDCUJDJC-UHFFFAOYSA-N 1 1 347.256 3.607 20 10 EHCDMO CN1CCC[C@@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642836 1136743652 /nfs/dbraw/zinc/74/36/52/1136743652.db2.gz MWCWOTIYBPDJAC-JOCHJYFZSA-N 1 1 336.479 3.977 20 10 EHCDMO CN1CCC[C@@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642836 1136743655 /nfs/dbraw/zinc/74/36/55/1136743655.db2.gz MWCWOTIYBPDJAC-JOCHJYFZSA-N 1 1 336.479 3.977 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947141 1136850459 /nfs/dbraw/zinc/85/04/59/1136850459.db2.gz LFQCSCJGHXGQFZ-JMSVASOKSA-N 1 1 330.394 3.840 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947142 1136850498 /nfs/dbraw/zinc/85/04/98/1136850498.db2.gz LFQCSCJGHXGQFZ-XUJVJEKNSA-N 1 1 330.394 3.840 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1[O-] ZINC000817969506 1136853728 /nfs/dbraw/zinc/85/37/28/1136853728.db2.gz VKYPJDLNBVOJMM-LLVKDONJSA-N 1 1 347.256 3.609 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1c2ccccc2CN(C)C1=O)c1ccc(N(C)C)cc1 ZINC000857875031 1136916894 /nfs/dbraw/zinc/91/68/94/1136916894.db2.gz UPAFLACANVRBMA-UXHICEINSA-N 1 1 337.467 3.507 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858011174 1136930210 /nfs/dbraw/zinc/93/02/10/1136930210.db2.gz RFLYBFXUUPFWQP-SFHVURJKSA-N 1 1 342.414 3.847 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cc(O)ccc1Cl ZINC000859060173 1137001730 /nfs/dbraw/zinc/00/17/30/1137001730.db2.gz NVGYAMRPYPKICU-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cc(O)ccc1Cl ZINC000859060173 1137001732 /nfs/dbraw/zinc/00/17/32/1137001732.db2.gz NVGYAMRPYPKICU-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO O=[N+]([O-])c1cc(C[NH+]2CC(CC(F)F)C2)ccc1N1CCCCC1 ZINC000822520555 1137062170 /nfs/dbraw/zinc/06/21/70/1137062170.db2.gz GIYBRWCGEQEHEL-UHFFFAOYSA-N 1 1 339.386 3.672 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnc2n1CCC2)C1CCCCC1 ZINC000824484805 1137139758 /nfs/dbraw/zinc/13/97/58/1137139758.db2.gz VDZUDRMNHBNPMW-UHFFFAOYSA-N 1 1 325.456 3.870 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000824521517 1137141132 /nfs/dbraw/zinc/14/11/32/1137141132.db2.gz HBZMJSAWUYFBSM-UHFFFAOYSA-N 1 1 346.858 3.987 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000824521517 1137141133 /nfs/dbraw/zinc/14/11/33/1137141133.db2.gz HBZMJSAWUYFBSM-UHFFFAOYSA-N 1 1 346.858 3.987 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1F ZINC000862384315 1137141514 /nfs/dbraw/zinc/14/15/14/1137141514.db2.gz VAUFDWHJMDCHQV-BJZITVGISA-N 1 1 338.442 3.546 20 10 EHCDMO Cc1ccc2cc(C[N@H+](C)Cc3ccc(N4CCOCC4)cc3)[nH]c2c1 ZINC000824535722 1137141620 /nfs/dbraw/zinc/14/16/20/1137141620.db2.gz VLFOLYRFPVIOOQ-UHFFFAOYSA-N 1 1 349.478 3.945 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)cc1 ZINC000824608663 1137144863 /nfs/dbraw/zinc/14/48/63/1137144863.db2.gz LRJPEDCHGQLKDW-GOSISDBHSA-N 1 1 345.531 3.646 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000862484936 1137146762 /nfs/dbraw/zinc/14/67/62/1137146762.db2.gz CVWQXBKEOPAKDX-YOEHRIQHSA-N 1 1 349.471 3.591 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccc(OC)c(F)c3)C2)c1 ZINC000862541480 1137149283 /nfs/dbraw/zinc/14/92/83/1137149283.db2.gz REBABUIFKIYMBG-CQSZACIVSA-N 1 1 331.387 3.538 20 10 EHCDMO O[C@@H]1CCC[C@H]1[C@@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000824714391 1137149771 /nfs/dbraw/zinc/14/97/71/1137149771.db2.gz CURUWGAZOYDMAK-PCCBWWKXSA-N 1 1 328.500 3.802 20 10 EHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)c2nccn21 ZINC000825017503 1137162271 /nfs/dbraw/zinc/16/22/71/1137162271.db2.gz STPLUARTCFZWRJ-XHDPSFHLSA-N 1 1 338.377 3.764 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000825090550 1137165296 /nfs/dbraw/zinc/16/52/96/1137165296.db2.gz BPFFDPCXZWNPGG-SJKOYZFVSA-N 1 1 336.794 3.590 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)c(C(=O)OC)o2)cc1F ZINC000825260510 1137171120 /nfs/dbraw/zinc/17/11/20/1137171120.db2.gz QMPNJYUZDPDAOD-UHFFFAOYSA-N 1 1 348.418 3.650 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)cc1Cl ZINC000825500726 1137179946 /nfs/dbraw/zinc/17/99/46/1137179946.db2.gz HHJMLWGZIKRYNJ-CYBMUJFWSA-N 1 1 325.742 3.856 20 10 EHCDMO COC[C@@]1(C)C[N@@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000863339919 1137181486 /nfs/dbraw/zinc/18/14/86/1137181486.db2.gz GHICRSHNCCMNFH-HXUWFJFHSA-N 1 1 341.407 3.529 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@H](OC(C)C)C3)cc2)CC1 ZINC000844381591 1137218479 /nfs/dbraw/zinc/21/84/79/1137218479.db2.gz LRJOMMOALWJGKT-NRFANRHFSA-N 1 1 346.515 3.691 20 10 EHCDMO COc1ccc(OC(F)(F)F)cc1C[N@@H+](C)Cc1ccccc1O ZINC001144004957 1137225014 /nfs/dbraw/zinc/22/50/14/1137225014.db2.gz KSZVPCSGHCGVAW-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO COCC[C@@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299941 1137268852 /nfs/dbraw/zinc/26/88/52/1137268852.db2.gz MWKCHXGAZOGCTD-LBPRGKRZSA-N 1 1 346.240 3.685 20 10 EHCDMO COCC[C@@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299941 1137268853 /nfs/dbraw/zinc/26/88/53/1137268853.db2.gz MWKCHXGAZOGCTD-LBPRGKRZSA-N 1 1 346.240 3.685 20 10 EHCDMO C[N@@H+](Cc1ccsc1)Cc1cc(Br)c(F)cc1[O-] ZINC001144306984 1137270709 /nfs/dbraw/zinc/27/07/09/1137270709.db2.gz YUNOMGWUBBFFGL-UHFFFAOYSA-N 1 1 330.222 3.987 20 10 EHCDMO C[N@@H+](Cc1ccsc1)Cc1cc(Br)c(F)cc1O ZINC001144306984 1137270712 /nfs/dbraw/zinc/27/07/12/1137270712.db2.gz YUNOMGWUBBFFGL-UHFFFAOYSA-N 1 1 330.222 3.987 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@](C)(c3ccc(F)cc3)C2)cc1OC ZINC000794891549 1137327632 /nfs/dbraw/zinc/32/76/32/1137327632.db2.gz GEVJKCMHUZAMSS-FQEVSTJZSA-N 1 1 345.414 3.712 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c1O ZINC000846156136 1137336722 /nfs/dbraw/zinc/33/67/22/1137336722.db2.gz YFWOYEUBAMJIKD-MRVPVSSYSA-N 1 1 329.293 3.808 20 10 EHCDMO C[C@H](O)[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1ccccc1F ZINC000846182899 1137340325 /nfs/dbraw/zinc/34/03/25/1137340325.db2.gz LGEBBSCVXAKHAU-PUTJDCORSA-N 1 1 325.330 3.582 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000866404829 1137352179 /nfs/dbraw/zinc/35/21/79/1137352179.db2.gz WCSRMWZJVHPHOR-ZSSDLHNXSA-N 1 1 337.341 3.990 20 10 EHCDMO COCCCOCC[N@@H+](C)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000773270064 1137483702 /nfs/dbraw/zinc/48/37/02/1137483702.db2.gz ARDJLHOUQVUJPU-UHFFFAOYSA-N 1 1 347.455 3.502 20 10 EHCDMO Nc1cc[nH+]c(-c2cc(Nc3ccc(C(F)(F)F)cc3O)ccn2)c1 ZINC001212630736 1137518767 /nfs/dbraw/zinc/51/87/67/1137518767.db2.gz JVJSCABNLMVLBS-UHFFFAOYSA-N 1 1 346.312 3.616 20 10 EHCDMO O[C@@H]([C@@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1)C(F)(F)F ZINC000123664933 1137545472 /nfs/dbraw/zinc/54/54/72/1137545472.db2.gz GDXSZBUDUNIGQK-IRXDYDNUSA-N 1 1 342.405 3.565 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872258781 1137576721 /nfs/dbraw/zinc/57/67/21/1137576721.db2.gz AKDFMDREJNYVPA-MRXNPFEDSA-N 1 1 339.863 3.978 20 10 EHCDMO Cc1ccc2cc[nH+]c(NCc3ccc(N4CCOCC4)cc3)c2c1 ZINC000825627005 1137585177 /nfs/dbraw/zinc/58/51/77/1137585177.db2.gz DGODLNWFBPHJCJ-UHFFFAOYSA-N 1 1 333.435 3.992 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3nc4cc(F)ccc4o3)ccc21 ZINC000873029497 1137588528 /nfs/dbraw/zinc/58/85/28/1137588528.db2.gz IQZHARLVABQDKB-UHFFFAOYSA-N 1 1 325.387 3.639 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1[O-] ZINC000873241849 1137595130 /nfs/dbraw/zinc/59/51/30/1137595130.db2.gz GPGAXSZBZYNENR-DGCLKSJQSA-N 1 1 341.293 3.584 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(Br)cc2O)CC1 ZINC000825748507 1137621636 /nfs/dbraw/zinc/62/16/36/1137621636.db2.gz CZRSSJJXYCEOIA-OAHLLOKOSA-N 1 1 328.250 3.546 20 10 EHCDMO Nc1ccc(NC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2)cc1 ZINC000876504665 1137654237 /nfs/dbraw/zinc/65/42/37/1137654237.db2.gz SJPDWBNJLMNXEL-KRWDZBQOSA-N 1 1 329.831 3.525 20 10 EHCDMO Nc1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2)cc1 ZINC000876504665 1137654238 /nfs/dbraw/zinc/65/42/38/1137654238.db2.gz SJPDWBNJLMNXEL-KRWDZBQOSA-N 1 1 329.831 3.525 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000876585842 1137656326 /nfs/dbraw/zinc/65/63/26/1137656326.db2.gz XREJHVRNXILPPM-FQEVSTJZSA-N 1 1 336.479 3.637 20 10 EHCDMO Cc1cccc(O)c1C[N@H+](C)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000876613930 1137656999 /nfs/dbraw/zinc/65/69/99/1137656999.db2.gz GFMUWJXDOFARKU-UHFFFAOYSA-N 1 1 334.460 3.532 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(OC)cnc2F)cc1F ZINC000877027472 1137668004 /nfs/dbraw/zinc/66/80/04/1137668004.db2.gz OHQJRMDCSKRJMI-UHFFFAOYSA-N 1 1 335.398 3.504 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000877583473 1137682028 /nfs/dbraw/zinc/68/20/28/1137682028.db2.gz IEEFZZKYNQEGSW-MRXNPFEDSA-N 1 1 343.389 3.882 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1F ZINC000877674936 1137685377 /nfs/dbraw/zinc/68/53/77/1137685377.db2.gz XMUMMNHGGVXCEF-YLJYHZDGSA-N 1 1 328.431 3.590 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)c1O ZINC000877673208 1137685423 /nfs/dbraw/zinc/68/54/23/1137685423.db2.gz PKXKTPVVPMJSBF-SJORKVTESA-N 1 1 347.842 3.752 20 10 EHCDMO Cc1cc(O)c(C[NH2+]Cc2ncc(Br)s2)cc1Cl ZINC000877766828 1137689002 /nfs/dbraw/zinc/68/90/02/1137689002.db2.gz MZIVSITYQKVNDH-UHFFFAOYSA-N 1 1 347.665 3.863 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3cc(C(C)C)n[nH]3)C2)c1 ZINC000877783590 1137689694 /nfs/dbraw/zinc/68/96/94/1137689694.db2.gz AQOZMVDISIVWPJ-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c1 ZINC000877783590 1137689695 /nfs/dbraw/zinc/68/96/95/1137689695.db2.gz AQOZMVDISIVWPJ-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)c1 ZINC000877783590 1137689696 /nfs/dbraw/zinc/68/96/96/1137689696.db2.gz AQOZMVDISIVWPJ-CQSZACIVSA-N 1 1 329.444 3.627 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CC2(CO1)CCOCC2)C1CCCC1 ZINC000878104412 1137702552 /nfs/dbraw/zinc/70/25/52/1137702552.db2.gz VKIHSVCQGNFLMJ-LJQANCHMSA-N 1 1 345.483 3.723 20 10 EHCDMO CCCC[N@@H+](CCCS(=O)(=O)C(C)(C)C)Cc1ccccc1O ZINC000878565714 1137720412 /nfs/dbraw/zinc/72/04/12/1137720412.db2.gz RTJFWEJNSZVNME-UHFFFAOYSA-N 1 1 341.517 3.598 20 10 EHCDMO C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cc(F)cc(F)c2[O-])CC1 ZINC000883004912 1137841407 /nfs/dbraw/zinc/84/14/07/1137841407.db2.gz YZJUAWFGDFNECR-AWEZNQCLSA-N 1 1 346.421 3.986 20 10 EHCDMO COc1ccc([C@@H](OC)[C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000883081691 1137843838 /nfs/dbraw/zinc/84/38/38/1137843838.db2.gz LXTSSKNJQRELGJ-ZMZPIMSZSA-N 1 1 337.366 3.545 20 10 EHCDMO Cc1ccc(O)c(CNc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000883346066 1137856226 /nfs/dbraw/zinc/85/62/26/1137856226.db2.gz RBWOCTCOLJFKEE-HXUWFJFHSA-N 1 1 337.467 3.597 20 10 EHCDMO C[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(Cl)cc1Cl ZINC000136360129 1138023666 /nfs/dbraw/zinc/02/36/66/1138023666.db2.gz PLNNMFSVDIXDME-MRXNPFEDSA-N 1 1 326.223 3.864 20 10 EHCDMO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886505359 1138085808 /nfs/dbraw/zinc/08/58/08/1138085808.db2.gz XRCNKYHXNTXLMB-ZIAGYGMSSA-N 1 1 344.430 3.910 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1c(O)cccc1F ZINC000886510129 1138086760 /nfs/dbraw/zinc/08/67/60/1138086760.db2.gz VIAIFQHVQDCBLH-CQSZACIVSA-N 1 1 342.414 3.899 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccc(F)cc1F)Cc1ccccc1O ZINC000069009941 1138087261 /nfs/dbraw/zinc/08/72/61/1138087261.db2.gz ASISHUVPPRXCDK-UHFFFAOYSA-N 1 1 334.366 3.521 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccccc1C(F)(F)F)c1c(O)cccc1F ZINC000886512721 1138087269 /nfs/dbraw/zinc/08/72/69/1138087269.db2.gz LQQQPBCGFVQZCC-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc(N2CCOC2=O)c1 ZINC000886513246 1138087574 /nfs/dbraw/zinc/08/75/74/1138087574.db2.gz XCJLNHWXARGBTC-STQMWFEESA-N 1 1 344.386 3.900 20 10 EHCDMO Cc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)cc(N2CCCC2)n1 ZINC000886612703 1138102029 /nfs/dbraw/zinc/10/20/29/1138102029.db2.gz RYKJEIHPLRETLF-CQSZACIVSA-N 1 1 329.419 3.686 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1C ZINC000125903372 1138318951 /nfs/dbraw/zinc/31/89/51/1138318951.db2.gz YASMZHDJGNPAGF-HNNXBMFYSA-N 1 1 347.480 3.606 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1C ZINC000125903372 1138318952 /nfs/dbraw/zinc/31/89/52/1138318952.db2.gz YASMZHDJGNPAGF-HNNXBMFYSA-N 1 1 347.480 3.606 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462494 1139092545 /nfs/dbraw/zinc/09/25/45/1139092545.db2.gz KERLKKFVTIQCGY-MSOLQXFVSA-N 1 1 327.516 3.812 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nncn2-c2ccccc2)cc1 ZINC000152636487 1139101731 /nfs/dbraw/zinc/10/17/31/1139101731.db2.gz MURGRYGEEPELIH-INIZCTEOSA-N 1 1 335.455 3.574 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)cc1OC ZINC000179683238 1139774860 /nfs/dbraw/zinc/77/48/60/1139774860.db2.gz LNGMQFXPGKERSS-LLVKDONJSA-N 1 1 337.366 3.881 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@@H+](C)Cc2cc(F)ccc2O)c(C)c1 ZINC000179936222 1139794356 /nfs/dbraw/zinc/79/43/56/1139794356.db2.gz NFFMHLVIYDSGBU-UHFFFAOYSA-N 1 1 330.403 3.527 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2cc(F)ccc2O)c(C)c1 ZINC000179936222 1139794362 /nfs/dbraw/zinc/79/43/62/1139794362.db2.gz NFFMHLVIYDSGBU-UHFFFAOYSA-N 1 1 330.403 3.527 20 10 EHCDMO COc1ccc(O)c([C@@H](C)N[C@H](C[NH+]2CCCC2)c2ccccc2)c1 ZINC000184919707 1140125909 /nfs/dbraw/zinc/12/59/09/1140125909.db2.gz UQOGDCNJDSDTDB-OXQOHEQNSA-N 1 1 340.467 3.889 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1ccc(F)cc1O ZINC000184984720 1140129679 /nfs/dbraw/zinc/12/96/79/1140129679.db2.gz WUWLKNXILUSYPP-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)c3ccc(F)cc3O)cn2)n1 ZINC000185057908 1140134710 /nfs/dbraw/zinc/13/47/10/1140134710.db2.gz SLRFLGDSVTVSAA-AWEZNQCLSA-N 1 1 340.402 3.580 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1O ZINC000186196414 1140191705 /nfs/dbraw/zinc/19/17/05/1140191705.db2.gz GRTRWGGRPDDBSV-FVMDXXJSSA-N 1 1 327.758 3.708 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000192657907 1140541614 /nfs/dbraw/zinc/54/16/14/1140541614.db2.gz NPXQGWNRBWELKJ-GHMZBOCLSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@H]([NH2+]CCCOC1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193007047 1140560140 /nfs/dbraw/zinc/56/01/40/1140560140.db2.gz RFSZIGTXXIFTOH-NSHDSACASA-N 1 1 348.270 3.935 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Br)cc2O)s1 ZINC000274144223 1141479384 /nfs/dbraw/zinc/47/93/84/1141479384.db2.gz DQUCZEYYTGZCFN-SFYZADRCSA-N 1 1 342.262 3.726 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cn(C)nc2C(F)F)C2CC2)cc1 ZINC000274438261 1141528495 /nfs/dbraw/zinc/52/84/95/1141528495.db2.gz AWPBMYBOYLYHLC-UHFFFAOYSA-N 1 1 334.414 3.588 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cc(F)ccc1F ZINC000104190597 219357957 /nfs/dbraw/zinc/35/79/57/219357957.db2.gz KQFQLSYOFDTRBV-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO CCC[N@@H+](Cc1c(O)cccc1Br)C1CCOCC1 ZINC001140103541 1016743224 /nfs/dbraw/zinc/74/32/24/1016743224.db2.gz OHMNJAHGTFGPNU-UHFFFAOYSA-N 1 1 328.250 3.546 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](CSc3ccccc3)C1)OCO2 ZINC000173400599 1017624415 /nfs/dbraw/zinc/62/44/15/1017624415.db2.gz KIPGQNZUDFSMGF-CQSZACIVSA-N 1 1 343.448 3.735 20 10 EHCDMO CCOC[C@@H]1CC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000177632867 1017914018 /nfs/dbraw/zinc/91/40/18/1017914018.db2.gz ZPTUIGSKYRPHEQ-CQSZACIVSA-N 1 1 329.440 3.876 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H]3CN3CCCC3)c2c1 ZINC000172485470 1032736370 /nfs/dbraw/zinc/73/63/70/1032736370.db2.gz MIDGLJUJBSAMNY-QGZVFWFLSA-N 1 1 340.467 3.614 20 10 EHCDMO COc1ccc2ccc(O)c(CN3CCC[C@@H]3C[NH+]3CCCC3)c2c1 ZINC000172485470 1032736372 /nfs/dbraw/zinc/73/63/72/1032736372.db2.gz MIDGLJUJBSAMNY-QGZVFWFLSA-N 1 1 340.467 3.614 20 10 EHCDMO COc1cccc(C[N@H+](C)Cc2ccccc2Br)c1O ZINC000160383396 1018675055 /nfs/dbraw/zinc/67/50/55/1018675055.db2.gz JGBICBPKJNFTAM-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2ccccc2Br)c1O ZINC000160383396 1018675060 /nfs/dbraw/zinc/67/50/60/1018675060.db2.gz JGBICBPKJNFTAM-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO C[N@@H+](Cc1cnn2ccccc12)Cc1ccc(N2CCCCC2)cc1 ZINC000178867383 1019324002 /nfs/dbraw/zinc/32/40/02/1019324002.db2.gz FOPPITMVQOYRLI-UHFFFAOYSA-N 1 1 334.467 3.957 20 10 EHCDMO Cc1csc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)n1 ZINC000279982281 1019953565 /nfs/dbraw/zinc/95/35/65/1019953565.db2.gz QOZOMYXMWYESMN-UHFFFAOYSA-N 1 1 329.391 3.826 20 10 EHCDMO CCC(CC)[N@@H+](CCOC)Cc1c(O)cccc1Br ZINC000707144258 1021260149 /nfs/dbraw/zinc/26/01/49/1021260149.db2.gz MUTBOJIJCJNBBD-UHFFFAOYSA-N 1 1 330.266 3.792 20 10 EHCDMO COc1cc(C)cc(CNC2CC[NH+](C3CCCCC3)CC2)c1O ZINC000894328202 1021604434 /nfs/dbraw/zinc/60/44/34/1021604434.db2.gz KJGRQHFSKITGEU-UHFFFAOYSA-N 1 1 332.488 3.596 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ccc3cncn3c2)cc1F ZINC000297539807 1021630790 /nfs/dbraw/zinc/63/07/90/1021630790.db2.gz OQIDAJJHPXMQFK-UHFFFAOYSA-N 1 1 326.419 3.609 20 10 EHCDMO CCOc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)o1 ZINC000891466966 1021708763 /nfs/dbraw/zinc/70/87/63/1021708763.db2.gz AARLFZLHTQXWBH-INIZCTEOSA-N 1 1 331.412 3.565 20 10 EHCDMO COc1ccc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c(O)c1OC ZINC000891533189 1021852008 /nfs/dbraw/zinc/85/20/08/1021852008.db2.gz VJSTYEQUOQPMOD-UHFFFAOYSA-N 1 1 343.398 3.838 20 10 EHCDMO CC(C)(CO)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccs1 ZINC000894962425 1022307963 /nfs/dbraw/zinc/30/79/63/1022307963.db2.gz IGCKZBVCUVKILT-HNNXBMFYSA-N 1 1 327.396 3.581 20 10 EHCDMO CC(C)OC(=O)C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000894780202 1022905028 /nfs/dbraw/zinc/90/50/28/1022905028.db2.gz ZLWRQAMDEVMBBR-QGZVFWFLSA-N 1 1 349.377 3.843 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCCN(c2ccccc2Cl)C1=O ZINC000119529085 1024418700 /nfs/dbraw/zinc/41/87/00/1024418700.db2.gz SHQHUNXSXQTHJH-QGZVFWFLSA-N 1 1 344.842 3.673 20 10 EHCDMO Cc1cccc(O)c1CNc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000895648125 1024679151 /nfs/dbraw/zinc/67/91/51/1024679151.db2.gz RYTQGBCIBPRUSL-IBGZPJMESA-N 1 1 337.467 3.597 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000896228488 1025262257 /nfs/dbraw/zinc/26/22/57/1025262257.db2.gz RSGROCANPDETFU-AWEZNQCLSA-N 1 1 333.325 3.657 20 10 EHCDMO CC(C)(C)OC(=O)N1CCC2(CC[N@@H+](Cc3ccccc3O)C2)CC1 ZINC000367041494 1025863866 /nfs/dbraw/zinc/86/38/66/1025863866.db2.gz XIDIRBWPRAMAFR-UHFFFAOYSA-N 1 1 346.471 3.615 20 10 EHCDMO CCN(CC)c1ccc(C[NH+]2CCC(O)(C(F)(F)F)CC2)cc1F ZINC000272746490 1027094284 /nfs/dbraw/zinc/09/42/84/1027094284.db2.gz JAQZEQMJSYPJJV-UHFFFAOYSA-N 1 1 348.384 3.561 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1 ZINC000273355827 1027392457 /nfs/dbraw/zinc/39/24/57/1027392457.db2.gz CRHNFDHJFNSOGS-WDEREUQCSA-N 1 1 335.350 3.869 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](Cc3nc(C)cs3)C2)c1O ZINC000897301572 1027409547 /nfs/dbraw/zinc/40/95/47/1027409547.db2.gz MVHAZBPWWOWYLK-AWEZNQCLSA-N 1 1 332.469 3.539 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2OC)c1 ZINC000273417910 1027419422 /nfs/dbraw/zinc/41/94/22/1027419422.db2.gz REUYHTZNRZWUKJ-VXGBXAGGSA-N 1 1 347.386 3.738 20 10 EHCDMO CC[C@](O)(CCC(F)(F)F)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000897523392 1028292569 /nfs/dbraw/zinc/29/25/69/1028292569.db2.gz KUFCSNMLYRBHBA-ZDUSSCGKSA-N 1 1 343.748 3.758 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)c1 ZINC000271770764 1029162426 /nfs/dbraw/zinc/16/24/26/1029162426.db2.gz GEIDMDHOUNZVNO-LPHOPBHVSA-N 1 1 345.439 3.862 20 10 EHCDMO COc1c(O)c(C[N@@H+]([C@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000278274877 1029899681 /nfs/dbraw/zinc/89/96/81/1029899681.db2.gz SGHGBZLTVRHRBT-LLVKDONJSA-N 1 1 332.356 3.628 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2c3ccccc3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000278494583 1031105144 /nfs/dbraw/zinc/10/51/44/1031105144.db2.gz MAFILSGFHCRGNG-YVEFUNNKSA-N 1 1 342.395 3.722 20 10 EHCDMO CC(C)[N@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc(N(C)C)cc1 ZINC000729876831 1031784419 /nfs/dbraw/zinc/78/44/19/1031784419.db2.gz UZJLLXFRJFQJIN-UHFFFAOYSA-N 1 1 340.427 3.806 20 10 EHCDMO CC(C)[N@@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc(N(C)C)cc1 ZINC000729876831 1031784432 /nfs/dbraw/zinc/78/44/32/1031784432.db2.gz UZJLLXFRJFQJIN-UHFFFAOYSA-N 1 1 340.427 3.806 20 10 EHCDMO CC[N@@H+](Cc1cc(O)cc(Br)c1)Cc1ccccc1O ZINC001232998740 1035821575 /nfs/dbraw/zinc/82/15/75/1035821575.db2.gz FVNYRDYPHACZMY-UHFFFAOYSA-N 1 1 336.229 3.882 20 10 EHCDMO CC(C)[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CCCC1 ZINC000324034812 1037297095 /nfs/dbraw/zinc/29/70/95/1037297095.db2.gz PQOFBISYQZLFIN-NRFANRHFSA-N 1 1 329.532 3.887 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1cn(-c2ccccc2)nn1 ZINC000157288368 1037346978 /nfs/dbraw/zinc/34/69/78/1037346978.db2.gz ISOGPQNBLVEZLO-INIZCTEOSA-N 1 1 336.439 3.946 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000245608304 1040152339 /nfs/dbraw/zinc/15/23/39/1040152339.db2.gz AEZDKOPKIRHMCE-MGPUTAFESA-N 1 1 327.424 3.671 20 10 EHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)CCN1Cc1ccccc1 ZINC000080338639 1041159792 /nfs/dbraw/zinc/15/97/92/1041159792.db2.gz YHSDSXOQNBFBAS-DYESRHJHSA-N 1 1 336.479 3.764 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccccc1Cl)c1cc(F)cc(F)c1O ZINC000756738766 1042207243 /nfs/dbraw/zinc/20/72/43/1042207243.db2.gz KYFPQGJTDWGZKB-BJOHPYRUSA-N 1 1 327.758 3.708 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)ccc1OCOC ZINC000092705031 1042826313 /nfs/dbraw/zinc/82/63/13/1042826313.db2.gz ZBFCLDYZGXDCQY-UHFFFAOYSA-N 1 1 345.439 3.796 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](c1c(F)cccc1F)N(C)C)c1ccc(F)cc1O ZINC000185458745 1126904124 /nfs/dbraw/zinc/90/41/24/1126904124.db2.gz RTMZBWKUJHPCSN-BZNIZROVSA-N 1 1 338.373 3.763 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cccnc1Cl)C[C@H]1CCCO1 ZINC000171923047 1127629724 /nfs/dbraw/zinc/62/97/24/1127629724.db2.gz LJSSCUYDZQCUHI-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cccnc1Cl)C[C@H]1CCCO1 ZINC000171923047 1127629725 /nfs/dbraw/zinc/62/97/25/1127629725.db2.gz LJSSCUYDZQCUHI-MRXNPFEDSA-N 1 1 332.831 3.622 20 10 EHCDMO Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)nnn1-c1ccc(C)cc1 ZINC000765607346 1127703080 /nfs/dbraw/zinc/70/30/80/1127703080.db2.gz BHNLXUGNKAXAML-HNNXBMFYSA-N 1 1 348.450 3.670 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nccn2CC(F)(F)F)cc1 ZINC000765683399 1127724958 /nfs/dbraw/zinc/72/49/58/1127724958.db2.gz FVCWZESUACGUTP-CYBMUJFWSA-N 1 1 340.393 3.752 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(-n2ccnn2)cc1 ZINC000186183545 1127981507 /nfs/dbraw/zinc/98/15/07/1127981507.db2.gz UJMRKIPEOJOOHD-STQMWFEESA-N 1 1 326.375 3.524 20 10 EHCDMO CC(C)([NH2+]Cc1ccc2c(c1)CCCO2)c1cn(-c2ccccc2)nn1 ZINC000921833313 1128796124 /nfs/dbraw/zinc/79/61/24/1128796124.db2.gz VUCJEHGAYINTBO-UHFFFAOYSA-N 1 1 348.450 3.617 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000179589517 1123799750 /nfs/dbraw/zinc/79/97/50/1123799750.db2.gz LIKJYCYQAQDEPF-KRWDZBQOSA-N 1 1 341.407 3.509 20 10 EHCDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000179703866 1123828019 /nfs/dbraw/zinc/82/80/19/1123828019.db2.gz JNVQXSWYFNBOID-OAHLLOKOSA-N 1 1 335.245 3.830 20 10 EHCDMO CCO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cs1 ZINC000182413418 1125276997 /nfs/dbraw/zinc/27/69/97/1125276997.db2.gz DUPHHBISDGHFFP-RYUDHWBXSA-N 1 1 336.457 3.806 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1Cc3cccc(Cl)c3C1)CCC2 ZINC001168739808 1129777359 /nfs/dbraw/zinc/77/73/59/1129777359.db2.gz QLRDBOLKDXMFOA-OAHLLOKOSA-N 1 1 329.827 3.667 20 10 EHCDMO CCC[N@@H+](CCC(=O)Nc1ccc(F)cc1)Cc1ccccc1O ZINC000727830528 1130597222 /nfs/dbraw/zinc/59/72/22/1130597222.db2.gz ANAGUBCISYHHSN-UHFFFAOYSA-N 1 1 330.403 3.772 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000731845378 1130849939 /nfs/dbraw/zinc/84/99/39/1130849939.db2.gz YYZNZPKLVIKRAG-IBGZPJMESA-N 1 1 345.414 3.591 20 10 EHCDMO CC[N@H+]1CCCN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 ZINC000731881338 1130854323 /nfs/dbraw/zinc/85/43/23/1130854323.db2.gz BDCDKLPUXTVYGW-UHFFFAOYSA-N 1 1 339.483 3.570 20 10 EHCDMO CCc1cc(C[N@@H+](C)[C@@H]2CCN(C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190699 1130892160 /nfs/dbraw/zinc/89/21/60/1130892160.db2.gz ZFUHQGXSXFVLOO-GOSISDBHSA-N 1 1 330.516 3.921 20 10 EHCDMO CCc1cc(CN(C)[C@@H]2CC[N@@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190699 1130892165 /nfs/dbraw/zinc/89/21/65/1130892165.db2.gz ZFUHQGXSXFVLOO-GOSISDBHSA-N 1 1 330.516 3.921 20 10 EHCDMO CCc1cc(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190699 1130892170 /nfs/dbraw/zinc/89/21/70/1130892170.db2.gz ZFUHQGXSXFVLOO-GOSISDBHSA-N 1 1 330.516 3.921 20 10 EHCDMO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000733298425 1131018484 /nfs/dbraw/zinc/01/84/84/1131018484.db2.gz GOXFFULXZYLMAR-HXUWFJFHSA-N 1 1 325.408 3.675 20 10 EHCDMO COC(=O)[C@H](C)C[N@@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000740758890 1131540980 /nfs/dbraw/zinc/54/09/80/1131540980.db2.gz MJLKFEWCAXTOMS-QGZVFWFLSA-N 1 1 341.451 3.820 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@H](C(=O)OC)CC1 ZINC001172807376 1131847824 /nfs/dbraw/zinc/84/78/24/1131847824.db2.gz MMKCFKHELPFOQP-PKOBYXMFSA-N 1 1 332.488 3.696 20 10 EHCDMO CCO[C@H](C)c1noc(C[N@H+](C)Cc2c(O)ccc3ccccc32)n1 ZINC000743369791 1131904172 /nfs/dbraw/zinc/90/41/72/1131904172.db2.gz AWNNDHFZTGPPOB-CYBMUJFWSA-N 1 1 341.411 3.658 20 10 EHCDMO CCO[C@H](C)c1noc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)n1 ZINC000743369791 1131904180 /nfs/dbraw/zinc/90/41/80/1131904180.db2.gz AWNNDHFZTGPPOB-CYBMUJFWSA-N 1 1 341.411 3.658 20 10 EHCDMO C[N@H+](Cc1nccn1Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000743378286 1131914849 /nfs/dbraw/zinc/91/48/49/1131914849.db2.gz WOVRYBKVLWRURO-UHFFFAOYSA-N 1 1 347.462 3.758 20 10 EHCDMO C[N@@H+](Cc1nccn1Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000743378286 1131914851 /nfs/dbraw/zinc/91/48/51/1131914851.db2.gz WOVRYBKVLWRURO-UHFFFAOYSA-N 1 1 347.462 3.758 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000743870531 1131994788 /nfs/dbraw/zinc/99/47/88/1131994788.db2.gz WMGCTKVVTKUAFP-BBWFWOEESA-N 1 1 332.488 3.782 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000743870440 1131995969 /nfs/dbraw/zinc/99/59/69/1131995969.db2.gz RJUKBTYIAXUAGT-IMBTUZDBSA-N 1 1 346.515 3.934 20 10 EHCDMO Cc1cc(C[N@H+]2CCCN(CC(F)F)CC2)c(O)c(C(C)(C)C)c1 ZINC000766371874 1132524906 /nfs/dbraw/zinc/52/49/06/1132524906.db2.gz RHCQHULJJVKJSU-UHFFFAOYSA-N 1 1 340.458 3.771 20 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CC(C)(C)c1cc(C[N@H+]2CC[C@](C)(C(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000793390814 1134922073 /nfs/dbraw/zinc/92/20/73/1134922073.db2.gz SIOZKRRIDRFYHK-NRFANRHFSA-N 1 1 346.515 3.685 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000793747513 1134988513 /nfs/dbraw/zinc/98/85/13/1134988513.db2.gz PXHMZEZHYKLYDD-INIZCTEOSA-N 1 1 333.472 3.644 20 10 EHCDMO C[C@H](c1cccs1)[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775648931 1135405121 /nfs/dbraw/zinc/40/51/21/1135405121.db2.gz HYNCEIRIJNHAGB-MRXNPFEDSA-N 1 1 329.513 3.693 20 10 EHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775648931 1135405126 /nfs/dbraw/zinc/40/51/26/1135405126.db2.gz HYNCEIRIJNHAGB-MRXNPFEDSA-N 1 1 329.513 3.693 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](C)CC(=O)N(C)C2CCCCC2)c1O ZINC000775652227 1135421803 /nfs/dbraw/zinc/42/18/03/1135421803.db2.gz JAEFSIHRBMQADU-UHFFFAOYSA-N 1 1 338.879 3.577 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+](C)CC(=O)N(C)C2CCCCC2)c1O ZINC000775652227 1135421806 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CN1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC001199052924 1135876462 /nfs/dbraw/zinc/87/64/62/1135876462.db2.gz OVSALSMDTZIKQJ-PWRODBHTSA-N 1 1 341.543 3.887 20 10 EHCDMO C[NH+](C)CCN(Cc1cccs1)Cc1c(O)ccc(Cl)c1F ZINC000809746606 1135884850 /nfs/dbraw/zinc/88/48/50/1135884850.db2.gz VDODDZNDHJJYOE-UHFFFAOYSA-N 1 1 342.867 3.810 20 10 EHCDMO CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810207856 1135943012 /nfs/dbraw/zinc/94/30/12/1135943012.db2.gz PTLVSGRREHNAQP-OAHLLOKOSA-N 1 1 330.394 3.938 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC000811791795 1136140973 /nfs/dbraw/zinc/14/09/73/1136140973.db2.gz VRBLOVBNKBJDEG-IEBWSBKVSA-N 1 1 345.483 3.929 20 10 EHCDMO C[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C[C@H]1CCCOC1 ZINC000107670997 1136175213 /nfs/dbraw/zinc/17/52/13/1136175213.db2.gz VBRHXDRZPNPYKG-CQSZACIVSA-N 1 1 329.440 3.876 20 10 EHCDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCN(C)CC3)cc1)[C@H](C)C2 ZINC000850386581 1136247288 /nfs/dbraw/zinc/24/72/88/1136247288.db2.gz MGYNFKGZRXYIGT-JPYJTQIMSA-N 1 1 349.522 3.770 20 10 EHCDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2ccc(N(C)C)cc2)C1 ZINC000812840372 1136257677 /nfs/dbraw/zinc/25/76/77/1136257677.db2.gz BGQGFZDOAKRBFD-OTNPHJDUSA-N 1 1 330.516 3.904 20 10 EHCDMO C[C@H](COc1c(F)cccc1F)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000850522793 1136277052 /nfs/dbraw/zinc/27/70/52/1136277052.db2.gz MFCRWMNMYDXISI-GHMZBOCLSA-N 1 1 325.330 3.928 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H](N3CCCC3=O)C2)c(O)c(C(C)(C)C)c1 ZINC000111170985 1136519155 /nfs/dbraw/zinc/51/91/55/1136519155.db2.gz XBUVYTOMIBHYNW-QGZVFWFLSA-N 1 1 344.499 3.585 20 10 EHCDMO Cc1cc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)ccc1N(C)C ZINC000815023176 1136538680 /nfs/dbraw/zinc/53/86/80/1136538680.db2.gz LUTBWOCXFNOZEI-IBGZPJMESA-N 1 1 328.456 3.835 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1C ZINC000853552126 1136543730 /nfs/dbraw/zinc/54/37/30/1136543730.db2.gz VYUJULBCCRLMBO-IBGZPJMESA-N 1 1 327.424 3.956 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000815112160 1136550094 /nfs/dbraw/zinc/55/00/94/1136550094.db2.gz MBNWJEBCFAYQPP-JOCHJYFZSA-N 1 1 338.495 3.669 20 10 EHCDMO C[C@H]([NH2+]CCCOC[C@H]1CCOC1)c1cccc(C(F)(F)F)c1O ZINC000815582600 1136614467 /nfs/dbraw/zinc/61/44/67/1136614467.db2.gz KRQMPDRMBIENEV-QWHCGFSZSA-N 1 1 347.377 3.505 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815576429 1136618491 /nfs/dbraw/zinc/61/84/91/1136618491.db2.gz QEENKFOPLIHYFI-OCCSQVGLSA-N 1 1 339.357 3.665 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H]3C3CCOCC3)c2c1 ZINC000776772182 1136659313 /nfs/dbraw/zinc/65/93/13/1136659313.db2.gz MNRRBDDIXPVEIC-FQEVSTJZSA-N 1 1 341.451 3.945 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccsc1 ZINC000816532038 1136730761 /nfs/dbraw/zinc/73/07/61/1136730761.db2.gz OUYDFSCGYMSJEO-CQSZACIVSA-N 1 1 328.840 3.639 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000816565906 1136737672 /nfs/dbraw/zinc/73/76/72/1136737672.db2.gz FXWDFJCGVQQKTB-CHWSQXEVSA-N 1 1 340.870 3.927 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1O ZINC000816642562 1136743840 /nfs/dbraw/zinc/74/38/40/1136743840.db2.gz CSIHHCMDMGVJDV-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1O ZINC000816642562 1136743843 /nfs/dbraw/zinc/74/38/43/1136743843.db2.gz CSIHHCMDMGVJDV-MRXNPFEDSA-N 1 1 347.377 3.723 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817938730 1136847629 /nfs/dbraw/zinc/84/76/29/1136847629.db2.gz QZILMPSVNLKVNX-RTBURBONSA-N 1 1 329.875 3.683 20 10 EHCDMO CCOc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938488 1136847848 /nfs/dbraw/zinc/84/78/48/1136847848.db2.gz LGOUQTGZGTWRSS-YWZLYKJASA-N 1 1 327.472 3.502 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817944379 1136849521 /nfs/dbraw/zinc/84/95/21/1136849521.db2.gz ZZNYHCXFQOTMQK-RBUKOAKNSA-N 1 1 329.875 3.683 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817987762 1136855356 /nfs/dbraw/zinc/85/53/56/1136855356.db2.gz WTCSEUWAUPKMLY-DMEJVMROSA-N 1 1 342.405 3.840 20 10 EHCDMO COC(=O)c1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000818356701 1136875570 /nfs/dbraw/zinc/87/55/70/1136875570.db2.gz PVBFUAMMNGDZJK-DTWKUNHWSA-N 1 1 340.832 3.701 20 10 EHCDMO c1nc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000858355844 1136960972 /nfs/dbraw/zinc/96/09/72/1136960972.db2.gz WWTMLELAPWVOAQ-INIZCTEOSA-N 1 1 345.537 3.864 20 10 EHCDMO O=[N+]([O-])c1cnc(S[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000819936154 1136968197 /nfs/dbraw/zinc/96/81/97/1136968197.db2.gz WYFZXAOVPWQRLU-CYBMUJFWSA-N 1 1 335.454 3.808 20 10 EHCDMO O=[N+]([O-])c1cnc(S[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000819936154 1136968199 /nfs/dbraw/zinc/96/81/99/1136968199.db2.gz WYFZXAOVPWQRLU-CYBMUJFWSA-N 1 1 335.454 3.808 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(CO)ccc1F ZINC000859082353 1137002400 /nfs/dbraw/zinc/00/24/00/1137002400.db2.gz WPFYHQUDXAZEHD-UHFFFAOYSA-N 1 1 330.447 3.795 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CCn2cccn2)cc1 ZINC000823448508 1137100086 /nfs/dbraw/zinc/10/00/86/1137100086.db2.gz XDZSRFWNOHMEIZ-UHFFFAOYSA-N 1 1 340.496 3.713 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000862247863 1137134829 /nfs/dbraw/zinc/13/48/29/1137134829.db2.gz CVPLNCBRUNZJLA-INIZCTEOSA-N 1 1 340.261 3.547 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000862293574 1137137528 /nfs/dbraw/zinc/13/75/28/1137137528.db2.gz YJIPMSPBDPLQFU-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnn2c1CCC2)C1CCCCC1 ZINC000824484575 1137139715 /nfs/dbraw/zinc/13/97/15/1137139715.db2.gz MLAQHOFDLAKFKB-UHFFFAOYSA-N 1 1 325.456 3.870 20 10 EHCDMO CC(C)(C[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1)C(N)=O ZINC000824608238 1137144877 /nfs/dbraw/zinc/14/48/77/1137144877.db2.gz DOMKLPFECQLAKZ-HNNXBMFYSA-N 1 1 340.467 3.659 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3ccc(N(C)C)cc3)CC2)nn1 ZINC000824738195 1137148941 /nfs/dbraw/zinc/14/89/41/1137148941.db2.gz KFQGIBQCHKMZIE-UHFFFAOYSA-N 1 1 339.487 3.604 20 10 EHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3c(O)cccc3OC)C2)cc1F ZINC000862540518 1137149168 /nfs/dbraw/zinc/14/91/68/1137149168.db2.gz FFGSQQRIGJVRFH-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO Cc1noc(C)c1CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000119333274 1137174923 /nfs/dbraw/zinc/17/49/23/1137174923.db2.gz SKBXGPFAWMQEKC-UHFFFAOYSA-N 1 1 326.396 3.835 20 10 EHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(OC(F)(F)F)cc1F)CC2 ZINC001143791374 1137200071 /nfs/dbraw/zinc/20/00/71/1137200071.db2.gz MEICMSUEILKQBH-UHFFFAOYSA-N 1 1 341.304 3.988 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N3CCC(OC)CC3)cc2)[C@@H](CC)CO1 ZINC000844384166 1137215865 /nfs/dbraw/zinc/21/58/65/1137215865.db2.gz CCYLIQUWUCGFLN-AZUAARDMSA-N 1 1 346.515 3.691 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000865651369 1137301568 /nfs/dbraw/zinc/30/15/68/1137301568.db2.gz ZOSAFNKRDFBHCK-WBVHZDCISA-N 1 1 348.240 3.775 20 10 EHCDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCN(C)CC3)cc1)CC2 ZINC000846055786 1137331025 /nfs/dbraw/zinc/33/10/25/1137331025.db2.gz NTPRZBSURPLNEO-QFIPXVFZSA-N 1 1 335.495 3.524 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@]3(CCCOC3)C2)cc1C(C)C ZINC000794903632 1137332785 /nfs/dbraw/zinc/33/27/85/1137332785.db2.gz VCXPGKDLHAEYIU-OXJNMPFZSA-N 1 1 333.472 3.594 20 10 EHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccc3scnc3c1)CCC2 ZINC001144743719 1137343512 /nfs/dbraw/zinc/34/35/12/1137343512.db2.gz WTZMQUTWBJNQTK-UHFFFAOYSA-N 1 1 326.421 3.656 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001146516935 1137391315 /nfs/dbraw/zinc/39/13/15/1137391315.db2.gz JNFAYVMTCGBMCI-HNNXBMFYSA-N 1 1 345.874 3.524 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001146516935 1137391317 /nfs/dbraw/zinc/39/13/17/1137391317.db2.gz JNFAYVMTCGBMCI-HNNXBMFYSA-N 1 1 345.874 3.524 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1[O-] ZINC000873241851 1137595104 /nfs/dbraw/zinc/59/51/04/1137595104.db2.gz GPGAXSZBZYNENR-YPMHNXCESA-N 1 1 341.293 3.584 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(N)cc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000873288585 1137596433 /nfs/dbraw/zinc/59/64/33/1137596433.db2.gz IWHJJGIBRJBJTP-VIFPVBQESA-N 1 1 328.309 3.983 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2nccnc2c1 ZINC001137088749 1137632716 /nfs/dbraw/zinc/63/27/16/1137632716.db2.gz OJAKLXKYFSVWLC-UHFFFAOYSA-N 1 1 332.451 3.862 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)c1[O-] ZINC000125917663 1137650097 /nfs/dbraw/zinc/65/00/97/1137650097.db2.gz YBZMEVGVXQTNII-GFCCVEGCSA-N 1 1 331.387 3.503 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)c1O ZINC000125917663 1137650098 /nfs/dbraw/zinc/65/00/98/1137650098.db2.gz YBZMEVGVXQTNII-GFCCVEGCSA-N 1 1 331.387 3.503 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)c1O ZINC000125917663 1137650099 /nfs/dbraw/zinc/65/00/99/1137650099.db2.gz YBZMEVGVXQTNII-GFCCVEGCSA-N 1 1 331.387 3.503 20 10 EHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876733015 1137660004 /nfs/dbraw/zinc/66/00/04/1137660004.db2.gz MEHRZHKIUMUBQC-HGHGUNKESA-N 1 1 328.500 3.801 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@@H]1c1ccccc1 ZINC000876793976 1137661450 /nfs/dbraw/zinc/66/14/50/1137661450.db2.gz JZBVRHFILUPKHK-JTSKRJEESA-N 1 1 336.479 3.841 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CC3(CO2)CCOCC3)cc1 ZINC000877921802 1137695773 /nfs/dbraw/zinc/69/57/73/1137695773.db2.gz MAKBENVOMUIOGY-FQEVSTJZSA-N 1 1 346.515 3.550 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](O)C23CCCC3)c(O)c(C(C)(C)C)c1 ZINC000826012589 1137699799 /nfs/dbraw/zinc/69/97/99/1137699799.db2.gz PFBWSCBUSKBBHQ-KRWDZBQOSA-N 1 1 333.472 3.578 20 10 EHCDMO COc1cc(N(C)Cc2c(C)cc(C)[nH+]c2C)cc(OC)c1OC ZINC000878130397 1137703702 /nfs/dbraw/zinc/70/37/02/1137703702.db2.gz WQRUSOVURACVCN-UHFFFAOYSA-N 1 1 330.428 3.669 20 10 EHCDMO Cc1cccc(Cl)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000878242179 1137708404 /nfs/dbraw/zinc/70/84/04/1137708404.db2.gz NXOXLSSLCXOLBL-CYBMUJFWSA-N 1 1 332.831 3.813 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1cc(F)ccc1F)Cc1ccccc1O ZINC000130728187 1137841423 /nfs/dbraw/zinc/84/14/23/1137841423.db2.gz LQWFXBXKQGDAJW-UHFFFAOYSA-N 1 1 334.366 3.521 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000883075907 1137843547 /nfs/dbraw/zinc/84/35/47/1137843547.db2.gz ORBBIOYQHKFKTF-FZKQIMNGSA-N 1 1 333.378 3.928 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1c2ccccc2CC12CCOCC2 ZINC000883122613 1137845426 /nfs/dbraw/zinc/84/54/26/1137845426.db2.gz STOUILROABDGDC-LJQANCHMSA-N 1 1 345.389 3.854 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(C)cc(Br)c1O)[C@H]1CCCOC1 ZINC000883353010 1137856945 /nfs/dbraw/zinc/85/69/45/1137856945.db2.gz MJDCROMAERHQJF-WFASDCNBSA-N 1 1 342.277 3.758 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1c(O)cccc1F ZINC000886505009 1138085112 /nfs/dbraw/zinc/08/51/12/1138085112.db2.gz DVYULMFJNVMSGI-PBHICJAKSA-N 1 1 342.414 3.546 20 10 EHCDMO C[C@@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1c(O)cccc1F ZINC000886505010 1138085178 /nfs/dbraw/zinc/08/51/78/1138085178.db2.gz DVYULMFJNVMSGI-RHSMWYFYSA-N 1 1 342.414 3.546 20 10 EHCDMO Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)c3c(O)cccc3F)cn2)n1 ZINC000886506380 1138086146 /nfs/dbraw/zinc/08/61/46/1138086146.db2.gz OVDJSZZMWYMMHI-CQSZACIVSA-N 1 1 340.402 3.580 20 10 EHCDMO COc1cccc(N2CC[C@@H](C[NH2+][C@H](C)c3c(O)cccc3F)C2)c1 ZINC000886520858 1138088816 /nfs/dbraw/zinc/08/88/16/1138088816.db2.gz OSYSSYRITFVADX-CABCVRRESA-N 1 1 344.430 3.717 20 10 EHCDMO CCOc1c(OC)cc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1OC ZINC000886519257 1138089049 /nfs/dbraw/zinc/08/90/49/1138089049.db2.gz RLZKVHMPFGTOPX-LBPRGKRZSA-N 1 1 349.402 3.798 20 10 EHCDMO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886528813 1138090702 /nfs/dbraw/zinc/09/07/02/1138090702.db2.gz RTSNNIKLADEQCJ-UGSOOPFHSA-N 1 1 333.403 3.703 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@H](c3ccccc3OC)C2)c1O ZINC000093593266 1138238734 /nfs/dbraw/zinc/23/87/34/1138238734.db2.gz OENDFUKCUGXZAZ-HNNXBMFYSA-N 1 1 327.424 3.789 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000180282885 1139824634 /nfs/dbraw/zinc/82/46/34/1139824634.db2.gz KNDBHLHLTNCRRC-SHACYNPGSA-N 1 1 347.480 3.721 20 10 EHCDMO CC(=O)c1cc(F)cc(C[NH2+][C@H](COCC(C)C)c2ccco2)c1O ZINC000184196595 1140086697 /nfs/dbraw/zinc/08/66/97/1140086697.db2.gz VAWDWEWKFIHVMV-QGZVFWFLSA-N 1 1 349.402 3.830 20 10 EHCDMO COc1cc(Cl)cc(CN2CC[C@@H]3CC[C@H](C2)[N@H+]3C(C)C)c1O ZINC000184698116 1140115695 /nfs/dbraw/zinc/11/56/95/1140115695.db2.gz IWGSXPVAZBJHRQ-JKSUJKDBSA-N 1 1 338.879 3.501 20 10 EHCDMO C[C@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1ccc(F)cc1O ZINC000185048961 1140134095 /nfs/dbraw/zinc/13/40/95/1140134095.db2.gz SESSLUPXBKLLLT-KBXCAEBGSA-N 1 1 342.414 3.546 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(Cl)ccc1[O-] ZINC000185231851 1140140812 /nfs/dbraw/zinc/14/08/12/1140140812.db2.gz SDWYCRJPGGFMJF-CQSZACIVSA-N 1 1 348.874 3.837 20 10 EHCDMO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185478778 1140152166 /nfs/dbraw/zinc/15/21/66/1140152166.db2.gz HXFONSZKOUXFDS-ORAYPTAESA-N 1 1 333.403 3.703 20 10 EHCDMO CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000185671111 1140162021 /nfs/dbraw/zinc/16/20/21/1140162021.db2.gz WJNBCQTXNNTETG-WBVHZDCISA-N 1 1 330.472 3.553 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cnc([C@H]3CCCO3)s2)cc1 ZINC000270984826 1141290498 /nfs/dbraw/zinc/29/04/98/1141290498.db2.gz FOUXYESWIGJVRL-QGZVFWFLSA-N 1 1 331.485 3.693 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc([C@H]3CCCO3)s2)cc1 ZINC000270984826 1141290503 /nfs/dbraw/zinc/29/05/03/1141290503.db2.gz FOUXYESWIGJVRL-QGZVFWFLSA-N 1 1 331.485 3.693 20 10 EHCDMO CC[N@@H+](CCc1ccncc1)Cc1cc(Br)ccc1O ZINC000076118574 1125476545 /nfs/dbraw/zinc/47/65/45/1125476545.db2.gz ZMLCUTUPTVLNOI-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)cc1OC ZINC000160223520 1014516251 /nfs/dbraw/zinc/51/62/51/1014516251.db2.gz BCCHLPJNBAPYPP-HIFRSBDPSA-N 1 1 345.414 3.927 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1OC ZINC000160223195 1014526574 /nfs/dbraw/zinc/52/65/74/1014526574.db2.gz SYLUJJBFXMRGDX-OAHLLOKOSA-N 1 1 345.414 3.613 20 10 EHCDMO C[C@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccccc1O ZINC000183403553 1032167748 /nfs/dbraw/zinc/16/77/48/1032167748.db2.gz OEFLISTXGSYYBD-UGSOOPFHSA-N 1 1 325.387 3.705 20 10 EHCDMO C[C@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccccc1O ZINC000183403590 1032168983 /nfs/dbraw/zinc/16/89/83/1032168983.db2.gz OEFLISTXGSYYBD-SCLBCKFNSA-N 1 1 325.387 3.705 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@@H](c3ccccc3C)C2)c(O)cc1C ZINC000160291059 1017199697 /nfs/dbraw/zinc/19/96/97/1017199697.db2.gz IPZLXVOJUBGQNC-HXUWFJFHSA-N 1 1 327.424 3.591 20 10 EHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2O)C1 ZINC000160319756 1017932698 /nfs/dbraw/zinc/93/26/98/1017932698.db2.gz QVZDYTKBRHVXJC-ZIAGYGMSSA-N 1 1 325.474 3.515 20 10 EHCDMO COc1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c(O)cc1C ZINC000160325312 1018003410 /nfs/dbraw/zinc/00/34/10/1018003410.db2.gz LJJHWSKKZOSXKW-MAUKXSAKSA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c(O)cc1C ZINC000160325312 1018003422 /nfs/dbraw/zinc/00/34/22/1018003422.db2.gz LJJHWSKKZOSXKW-MAUKXSAKSA-N 1 1 327.424 3.671 20 10 EHCDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000078679706 1018025911 /nfs/dbraw/zinc/02/59/11/1018025911.db2.gz YKJBJFGBDXNUBL-QMMMGPOBSA-N 1 1 325.206 3.610 20 10 EHCDMO COc1cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c(O)cc1C ZINC000160516215 1019451531 /nfs/dbraw/zinc/45/15/31/1019451531.db2.gz DQDFAFORTDFZLW-HXUWFJFHSA-N 1 1 345.414 3.730 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c(O)cc1C ZINC000160516215 1019451545 /nfs/dbraw/zinc/45/15/45/1019451545.db2.gz DQDFAFORTDFZLW-HXUWFJFHSA-N 1 1 345.414 3.730 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c1O ZINC000780370167 1020317606 /nfs/dbraw/zinc/31/76/06/1020317606.db2.gz MMOJGTSPGJDMAI-HNNXBMFYSA-N 1 1 343.398 3.635 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCOc1ccc(F)cc1)C[C@@H]1CCCO1 ZINC000096971025 1021078910 /nfs/dbraw/zinc/07/89/10/1021078910.db2.gz CAHYSJIJBIZZCB-IBGZPJMESA-N 1 1 345.414 3.591 20 10 EHCDMO Cc1cnc(Cl)c(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000891526254 1021834354 /nfs/dbraw/zinc/83/43/54/1021834354.db2.gz JUROGWGSOFYMQD-UHFFFAOYSA-N 1 1 345.874 3.512 20 10 EHCDMO Cc1cnc(Cl)c(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000891526254 1021834365 /nfs/dbraw/zinc/83/43/65/1021834365.db2.gz JUROGWGSOFYMQD-UHFFFAOYSA-N 1 1 345.874 3.512 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)c(O)c1 ZINC000290388935 1022008519 /nfs/dbraw/zinc/00/85/19/1022008519.db2.gz IORZKGFNKPSQOI-QGZVFWFLSA-N 1 1 329.444 3.858 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)[nH]1 ZINC000894774882 1022872964 /nfs/dbraw/zinc/87/29/64/1022872964.db2.gz YXFYFGHBTWHABD-OAHLLOKOSA-N 1 1 347.466 3.527 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H](C)c2ncnn2C)cc1 ZINC000276795854 1022952772 /nfs/dbraw/zinc/95/27/72/1022952772.db2.gz YMEDWBCPTABDLU-QGZVFWFLSA-N 1 1 349.482 3.692 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](Cc2nc(C)cs2)C1 ZINC000895822870 1024877362 /nfs/dbraw/zinc/87/73/62/1024877362.db2.gz MPSUOQOTEOISIO-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO CCCCN(C)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435607956 1025031652 /nfs/dbraw/zinc/03/16/52/1025031652.db2.gz PVXJLAOVTGSEQL-UHFFFAOYSA-N 1 1 341.499 3.666 20 10 EHCDMO CC(C)CCNC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435661672 1025054780 /nfs/dbraw/zinc/05/47/80/1025054780.db2.gz HCRHGTZSEIAXNB-UHFFFAOYSA-N 1 1 341.499 3.570 20 10 EHCDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000121294769 1026613842 /nfs/dbraw/zinc/61/38/42/1026613842.db2.gz JVNRNQWFWXQAKY-UHFFFAOYSA-N 1 1 345.512 3.735 20 10 EHCDMO COc1ccc(N2CCN(c3cc[nH+]c4ccsc43)CC2)cc1F ZINC000301551663 1026850696 /nfs/dbraw/zinc/85/06/96/1026850696.db2.gz HATQCOSZEVHYLK-UHFFFAOYSA-N 1 1 343.427 3.771 20 10 EHCDMO Cc1cc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)nc2ccccc12 ZINC000176719239 1026876895 /nfs/dbraw/zinc/87/68/95/1026876895.db2.gz YGILILOSDMCAEB-UHFFFAOYSA-N 1 1 334.419 3.748 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000273384870 1027406461 /nfs/dbraw/zinc/40/64/61/1027406461.db2.gz JDQQDIMNMLCEIN-QWRGUYRKSA-N 1 1 335.350 3.869 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000273511672 1027468431 /nfs/dbraw/zinc/46/84/31/1027468431.db2.gz RVJNOYFPYNAVKS-GDBMZVCRSA-N 1 1 347.455 3.711 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000273584231 1027505903 /nfs/dbraw/zinc/50/59/03/1027505903.db2.gz NHRAEBHFSGGVLF-APPDUMDISA-N 1 1 329.371 3.656 20 10 EHCDMO c1cc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000153543678 1028149734 /nfs/dbraw/zinc/14/97/34/1028149734.db2.gz QCPIQBOZVVIDEL-IBGZPJMESA-N 1 1 328.481 3.922 20 10 EHCDMO CCC[N@@H+](Cc1cn(C)nc1-c1cccnc1)Cc1ccccc1O ZINC000092704981 1030500655 /nfs/dbraw/zinc/50/06/55/1030500655.db2.gz HKXZASZPTFOFSB-UHFFFAOYSA-N 1 1 336.439 3.600 20 10 EHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)n1 ZINC000093453351 1030612870 /nfs/dbraw/zinc/61/28/70/1030612870.db2.gz YPERELLDHXDBBB-NRFANRHFSA-N 1 1 337.467 3.564 20 10 EHCDMO Cc1ccc(O)c(C[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174669757 1031244008 /nfs/dbraw/zinc/24/40/08/1031244008.db2.gz ACMJYYWXISMGNF-GFCCVEGCSA-N 1 1 327.359 3.741 20 10 EHCDMO Cc1noc(CCC[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)n1 ZINC000278668023 1031913585 /nfs/dbraw/zinc/91/35/85/1031913585.db2.gz JBIRAEZGNYNMAA-MRVPVSSYSA-N 1 1 330.215 3.674 20 10 EHCDMO CC[N@@H+](CCc1cccnc1)Cc1cc(Br)ccc1O ZINC000173992712 1033647828 /nfs/dbraw/zinc/64/78/28/1033647828.db2.gz WURGLCRCARLEOL-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO CC[C@H]1CCC[N@@H+](Cc2ccc(I)cc2O)C1 ZINC001232979649 1035613477 /nfs/dbraw/zinc/61/34/77/1035613477.db2.gz HYXINNSGWFXJHE-NSHDSACASA-N 1 1 345.224 3.619 20 10 EHCDMO O=C(CC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 ZINC000182650775 1038623377 /nfs/dbraw/zinc/62/33/77/1038623377.db2.gz AVGDPZWOSDQSNX-LJQANCHMSA-N 1 1 339.435 3.646 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(C)ccc3OC)CC2)cc1 ZINC000108090606 1038777123 /nfs/dbraw/zinc/77/71/23/1038777123.db2.gz DJIKAMMMXPCJSQ-UHFFFAOYSA-N 1 1 340.467 3.725 20 10 EHCDMO COC(=O)c1cnc(C[N@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000894017629 1039964969 /nfs/dbraw/zinc/96/49/69/1039964969.db2.gz PXTXLINBYBXYIU-UHFFFAOYSA-N 1 1 346.452 3.580 20 10 EHCDMO COC(=O)c1cnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000894017629 1039964982 /nfs/dbraw/zinc/96/49/82/1039964982.db2.gz PXTXLINBYBXYIU-UHFFFAOYSA-N 1 1 346.452 3.580 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)c(O)c1OC ZINC000894037818 1039998129 /nfs/dbraw/zinc/99/81/29/1039998129.db2.gz FJTGGJNUTZOAJH-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)CC2(c3ccccc3)CC2)cc1OC ZINC000188825099 1040082570 /nfs/dbraw/zinc/08/25/70/1040082570.db2.gz DLFFBQKTAQFALQ-UHFFFAOYSA-N 1 1 327.424 3.573 20 10 EHCDMO CCCN(Cc1ccccc1O)C(=O)C[C@H](C)n1cc[nH+]c1CC ZINC000843819350 1041141097 /nfs/dbraw/zinc/14/10/97/1041141097.db2.gz AJVGVGHBDXIMJL-HNNXBMFYSA-N 1 1 329.444 3.541 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(Br)o2)c1O ZINC000164209296 1041220257 /nfs/dbraw/zinc/22/02/57/1041220257.db2.gz VJWSRUXLDJDCHU-UHFFFAOYSA-N 1 1 340.217 3.697 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000159228725 1042758977 /nfs/dbraw/zinc/75/89/77/1042758977.db2.gz ODQKVHRILAIWIC-UHFFFAOYSA-N 1 1 338.860 3.769 20 10 EHCDMO CCOC1(C)CC[NH+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000814169523 1136414632 /nfs/dbraw/zinc/41/46/32/1136414632.db2.gz JBVXKCYTPPMVTO-UHFFFAOYSA-N 1 1 342.277 3.854 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cccc2nccn21 ZINC000183372155 1125540805 /nfs/dbraw/zinc/54/08/05/1125540805.db2.gz DQWNHAIHMZHJRO-UHFFFAOYSA-N 1 1 333.391 3.835 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccc2nccn21 ZINC000183372155 1125540810 /nfs/dbraw/zinc/54/08/10/1125540810.db2.gz DQWNHAIHMZHJRO-UHFFFAOYSA-N 1 1 333.391 3.835 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H](OC(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000781149611 1125604584 /nfs/dbraw/zinc/60/45/84/1125604584.db2.gz OAKYPFIYGVLWCF-ZDUSSCGKSA-N 1 1 343.414 3.902 20 10 EHCDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)C2=CC(=O)CS2)CC1 ZINC000764338623 1127482645 /nfs/dbraw/zinc/48/26/45/1127482645.db2.gz VILSAPHTTXWJIZ-AWEZNQCLSA-N 1 1 336.501 3.570 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@H]2CCCN(c3ccccc3)C2=O)cc1C ZINC000734481550 1131239725 /nfs/dbraw/zinc/23/97/25/1131239725.db2.gz VPDWIJQIQUYMST-IBGZPJMESA-N 1 1 338.451 3.636 20 10 EHCDMO Cc1cc(CC[NH2+][C@@H]2CCN(C)[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716043 1127525593 /nfs/dbraw/zinc/52/55/93/1127525593.db2.gz GOMITFPOVOSDHR-OXJNMPFZSA-N 1 1 325.500 3.709 20 10 EHCDMO C[C@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872682 1128629068 /nfs/dbraw/zinc/62/90/68/1128629068.db2.gz KOBWENHZFIJXKY-LPHOPBHVSA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872682 1128629072 /nfs/dbraw/zinc/62/90/72/1128629072.db2.gz KOBWENHZFIJXKY-LPHOPBHVSA-N 1 1 345.506 3.951 20 10 EHCDMO COc1ccc([C@@H]2C[C@@H]([N@H+]3CCc4cccc(O)c4C3)CCO2)cc1 ZINC001168665238 1128745472 /nfs/dbraw/zinc/74/54/72/1128745472.db2.gz NRZPMFUCNCPERH-UWJYYQICSA-N 1 1 339.435 3.679 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1c1ccccc1)[C@@H](O)CO2 ZINC000762468906 1121313307 /nfs/dbraw/zinc/31/33/07/1121313307.db2.gz XUCCYGLFTPTCEY-HKUYNNGSSA-N 1 1 325.408 3.545 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCN1CC(F)(F)F ZINC000762508528 1121334093 /nfs/dbraw/zinc/33/40/93/1121334093.db2.gz OSDDMIQKSMOUAA-CYBMUJFWSA-N 1 1 338.373 3.614 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2cccc(F)c2)cc1 ZINC000917020516 1122441061 /nfs/dbraw/zinc/44/10/61/1122441061.db2.gz REXPPBHIQGRWDO-FQEVSTJZSA-N 1 1 330.447 3.837 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC(=O)N(C)C2CCCCC2)C2CC2)cc1 ZINC000917074147 1122470829 /nfs/dbraw/zinc/47/08/29/1122470829.db2.gz QXXQKVJOIITGPP-UHFFFAOYSA-N 1 1 343.515 3.508 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N[C@H]1CCCC[C@H]1C)Cc1ccc(N(C)C)cc1 ZINC000917074933 1122472490 /nfs/dbraw/zinc/47/24/90/1122472490.db2.gz MATLWZBMGSTIBP-XLIONFOSSA-N 1 1 345.531 3.658 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)Cc2ccccc2)c1O ZINC000154460598 1122654436 /nfs/dbraw/zinc/65/44/36/1122654436.db2.gz VLTLIGDZLNMZMH-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000182318313 1125253239 /nfs/dbraw/zinc/25/32/39/1125253239.db2.gz XXKGNIWJVNZEQW-CHWSQXEVSA-N 1 1 339.395 3.863 20 10 EHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCS[C@@H](C)[C@@H]2C)c1O ZINC000735668113 1131371259 /nfs/dbraw/zinc/37/12/59/1131371259.db2.gz PACHGXOVVGUEOJ-STQMWFEESA-N 1 1 345.464 3.658 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)Nc2cccc(C)c2)cc1 ZINC000741675233 1131634012 /nfs/dbraw/zinc/63/40/12/1131634012.db2.gz CRJCJKUHMFZSLV-UHFFFAOYSA-N 1 1 339.483 3.912 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)Nc2cccc(C)c2)cc1 ZINC000741675233 1131634016 /nfs/dbraw/zinc/63/40/16/1131634016.db2.gz CRJCJKUHMFZSLV-UHFFFAOYSA-N 1 1 339.483 3.912 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)N(C(C)C)C(C)C)cc1 ZINC000741678028 1131634720 /nfs/dbraw/zinc/63/47/20/1131634720.db2.gz HVTOJZNUXCFBIN-UHFFFAOYSA-N 1 1 333.520 3.610 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)CC)cc2)C1 ZINC000741754628 1131643668 /nfs/dbraw/zinc/64/36/68/1131643668.db2.gz UFPXJYFQHDVOHF-IEBWSBKVSA-N 1 1 345.531 3.660 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)C[C@@H](c2ccc(F)cc2)O1 ZINC000742160488 1131694928 /nfs/dbraw/zinc/69/49/28/1131694928.db2.gz CYPDTHZVSLYZJW-QKKBWIMNSA-N 1 1 341.426 3.982 20 10 EHCDMO CN(Cc1ccccc1)[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000743375622 1131912905 /nfs/dbraw/zinc/91/29/05/1131912905.db2.gz IZYZZJCMIZSGNV-LJQANCHMSA-N 1 1 347.462 3.647 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@H]1C[C@@H](C)N(C(=O)OC(C)(C)C)C1 ZINC001168872190 1132593643 /nfs/dbraw/zinc/59/36/43/1132593643.db2.gz LJNSFYSMQSQRED-ZBFHGGJFSA-N 1 1 334.460 3.612 20 10 EHCDMO C[C@@H](C(=O)NC1CCCC1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000741711656 1133008064 /nfs/dbraw/zinc/00/80/64/1133008064.db2.gz MMXJYNURDPNXFZ-KRWDZBQOSA-N 1 1 343.515 3.556 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@@H](N3CC=CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000742161444 1133047893 /nfs/dbraw/zinc/04/78/93/1133047893.db2.gz PBCLDZLUIXYLAT-GOSISDBHSA-N 1 1 328.500 3.698 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCc2ccccc21 ZINC000768232614 1133115020 /nfs/dbraw/zinc/11/50/20/1133115020.db2.gz GGFIMBPZDHWBLM-HXUWFJFHSA-N 1 1 340.442 3.782 20 10 EHCDMO COc1cccc(C[N@@H+](C)Cc2cccc(Br)c2)c1O ZINC000768252725 1133116955 /nfs/dbraw/zinc/11/69/55/1133116955.db2.gz NLIDKRFJHZQSNU-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO CCOC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)o1 ZINC000768257180 1133118017 /nfs/dbraw/zinc/11/80/17/1133118017.db2.gz JATUPPVXBGZUEF-UHFFFAOYSA-N 1 1 342.439 3.687 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2nn(C)c3ccccc23)C2CC2)cc1 ZINC000768258187 1133118562 /nfs/dbraw/zinc/11/85/62/1133118562.db2.gz SOOGDRMNNIYNMQ-UHFFFAOYSA-N 1 1 334.467 3.804 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(Br)o2)c(O)c1 ZINC000768263542 1133119230 /nfs/dbraw/zinc/11/92/30/1133119230.db2.gz ULAHINVIHGRVNE-UHFFFAOYSA-N 1 1 340.217 3.778 20 10 EHCDMO Cn1c[nH+]c2cc(NCc3ccc(OC[C@@H]4CCCO4)cc3)ccc21 ZINC001178037695 1133130872 /nfs/dbraw/zinc/13/08/72/1133130872.db2.gz XEYYIFNGDMLQAE-SFHVURJKSA-N 1 1 337.423 3.743 20 10 EHCDMO CCc1ccc(C[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C2CC2)cc1 ZINC000768439158 1133138001 /nfs/dbraw/zinc/13/80/01/1133138001.db2.gz IMOBSFKHMCKQMB-FQEVSTJZSA-N 1 1 339.435 3.545 20 10 EHCDMO CCC1CCC([N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C2CC2)CC1 ZINC000768439129 1133138022 /nfs/dbraw/zinc/13/80/22/1133138022.db2.gz HXCRNPKGKBDURC-XBMPDCEQSA-N 1 1 331.456 3.751 20 10 EHCDMO Cc1cccc(C[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)CC(C)C)c1 ZINC000768438996 1133138363 /nfs/dbraw/zinc/13/83/63/1133138363.db2.gz CTFNFPJQSTVUDS-FQEVSTJZSA-N 1 1 341.451 3.785 20 10 EHCDMO CCC[N@@H+](Cc1cc(OC)c(C)cc1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000768446794 1133140262 /nfs/dbraw/zinc/14/02/62/1133140262.db2.gz OSIKVTCVFKDTQG-IPELMVKDSA-N 1 1 333.472 3.735 20 10 EHCDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768447941 1133140495 /nfs/dbraw/zinc/14/04/95/1133140495.db2.gz RSHOCHWQVMVTPO-UYAOXDASSA-N 1 1 327.424 3.647 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC3(C1)CCCCCC3)[C@@H](O)CO2 ZINC000768466732 1133145002 /nfs/dbraw/zinc/14/50/02/1133145002.db2.gz VRSHOCIGYRBUQE-SFHVURJKSA-N 1 1 331.456 3.754 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)cc1 ZINC000773734381 1133147609 /nfs/dbraw/zinc/14/76/09/1133147609.db2.gz SDLGBJPFHOROEL-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000768524766 1133149724 /nfs/dbraw/zinc/14/97/24/1133149724.db2.gz QEEILHADRSSNSK-UHFFFAOYSA-N 1 1 341.451 3.842 20 10 EHCDMO CCOc1ccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c(O)c1 ZINC000769036473 1133217348 /nfs/dbraw/zinc/21/73/48/1133217348.db2.gz WUDDSUQTVKSVET-HXUWFJFHSA-N 1 1 341.451 3.972 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cc(C)ccc2O)C[C@@H]2CCCO2)c1 ZINC000769124353 1133230192 /nfs/dbraw/zinc/23/01/92/1133230192.db2.gz JEWJKBQVLFGYSW-FQEVSTJZSA-N 1 1 341.451 3.890 20 10 EHCDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769234534 1133247850 /nfs/dbraw/zinc/24/78/50/1133247850.db2.gz UGLPBDZFUNGYIU-HXUWFJFHSA-N 1 1 336.479 3.821 20 10 EHCDMO Fc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769378322 1133273029 /nfs/dbraw/zinc/27/30/29/1133273029.db2.gz BDUZDCZYEPXTCP-SFHVURJKSA-N 1 1 340.442 3.652 20 10 EHCDMO Cc1cc([C@H]2C[N@H+](Cc3ccc(N(C)C)cc3)CCO2)ccc1F ZINC000769481833 1133287726 /nfs/dbraw/zinc/28/77/26/1133287726.db2.gz WKCVGSWQQNOQDX-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc([C@H]2C[N@@H+](Cc3ccc(N(C)C)cc3)CCO2)ccc1F ZINC000769481833 1133287732 /nfs/dbraw/zinc/28/77/32/1133287732.db2.gz WKCVGSWQQNOQDX-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000769541421 1133300894 /nfs/dbraw/zinc/30/08/94/1133300894.db2.gz AJHUQVOSAKYQNU-FQEVSTJZSA-N 1 1 325.452 3.924 20 10 EHCDMO COc1cccc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)c1O ZINC000769498256 1133301662 /nfs/dbraw/zinc/30/16/62/1133301662.db2.gz SPWOISSWFLWMLA-OXJNMPFZSA-N 1 1 341.451 3.980 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000769505535 1133304658 /nfs/dbraw/zinc/30/46/58/1133304658.db2.gz DHFXRVGHVPJWSG-OAHLLOKOSA-N 1 1 332.241 3.972 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000769505535 1133304661 /nfs/dbraw/zinc/30/46/61/1133304661.db2.gz DHFXRVGHVPJWSG-OAHLLOKOSA-N 1 1 332.241 3.972 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)cc1F ZINC000769519251 1133308862 /nfs/dbraw/zinc/30/88/62/1133308862.db2.gz NEXANHBQGJBQCU-GOSISDBHSA-N 1 1 334.479 3.920 20 10 EHCDMO Cc1ccc(N2CC[N@@H+](Cc3cc(F)ccc3O)[C@H](C)C2)cc1C ZINC001180167017 1133341747 /nfs/dbraw/zinc/34/17/47/1133341747.db2.gz YXQBVKMWJLBZHR-MRXNPFEDSA-N 1 1 328.431 3.859 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](CC(=O)OC(C)(C)C)C2)c1 ZINC000770333378 1133407565 /nfs/dbraw/zinc/40/75/65/1133407565.db2.gz WUHLQGPTNNFYQM-HNNXBMFYSA-N 1 1 349.471 3.735 20 10 EHCDMO CC(C)(C[NH2+]Cc1cc(F)c(F)cc1O)Oc1cc(F)cc(F)c1 ZINC001181673555 1133512452 /nfs/dbraw/zinc/51/24/52/1133512452.db2.gz MBBRRWXJLFGXJY-UHFFFAOYSA-N 1 1 343.320 3.896 20 10 EHCDMO CC[N@H+]1CCCC[C@H]1C(=O)N(Cc1ccccc1)c1ccc(N)cc1 ZINC001181999340 1133560377 /nfs/dbraw/zinc/56/03/77/1133560377.db2.gz WRQYMVKETSKBRP-FQEVSTJZSA-N 1 1 337.467 3.676 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2nc3ccccc3n2C)C2CC2)cc1 ZINC000771790829 1133595405 /nfs/dbraw/zinc/59/54/05/1133595405.db2.gz HKZHVCVLGDHJEU-UHFFFAOYSA-N 1 1 334.467 3.804 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2nc3ccccc3n2C)C2CC2)cc1 ZINC000771790829 1133595418 /nfs/dbraw/zinc/59/54/18/1133595418.db2.gz HKZHVCVLGDHJEU-UHFFFAOYSA-N 1 1 334.467 3.804 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774172383 1133628024 /nfs/dbraw/zinc/62/80/24/1133628024.db2.gz BSZWGRWZUXEXAC-ZYHUDNBSSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@H]([NH2+][C@H]1CC(=O)N(C(C)(C)C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774258311 1133647796 /nfs/dbraw/zinc/64/77/96/1133647796.db2.gz MXKRGRHOAPPQIU-UWVGGRQHSA-N 1 1 345.270 3.749 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCSC[C@H]1C1CCC1 ZINC001182463204 1133681340 /nfs/dbraw/zinc/68/13/40/1133681340.db2.gz UOWNVAUAVKLGOG-AWEZNQCLSA-N 1 1 342.302 3.872 20 10 EHCDMO COc1ccc2c(c1)C[C@H](C(C)C)CN2Cc1c(C)cc[nH+]c1N ZINC001182471017 1133687156 /nfs/dbraw/zinc/68/71/56/1133687156.db2.gz SYLATXOJANLVFX-INIZCTEOSA-N 1 1 325.456 3.816 20 10 EHCDMO COc1ccc2c(c1)C[C@@H](C(C)C)CN2Cc1c(C)cc[nH+]c1N ZINC001182471031 1133687203 /nfs/dbraw/zinc/68/72/03/1133687203.db2.gz SYLATXOJANLVFX-MRXNPFEDSA-N 1 1 325.456 3.816 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1scnc1C1CC1)C[C@H]1CCCO1 ZINC000787050613 1133944373 /nfs/dbraw/zinc/94/43/73/1133944373.db2.gz RDZHEHZACUIBRI-MRXNPFEDSA-N 1 1 344.480 3.907 20 10 EHCDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)[C@H]1C ZINC000787239733 1133983321 /nfs/dbraw/zinc/98/33/21/1133983321.db2.gz CBDSZXKJQUAFKT-GXTWGEPZSA-N 1 1 339.391 3.675 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)Cc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000774821313 1134031737 /nfs/dbraw/zinc/03/17/37/1134031737.db2.gz BORYFFDSFHBVCP-UHFFFAOYSA-N 1 1 336.775 3.594 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774831943 1134038972 /nfs/dbraw/zinc/03/89/72/1134038972.db2.gz GALWTWCJPWDOGM-HNNXBMFYSA-N 1 1 334.416 3.854 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774831943 1134038978 /nfs/dbraw/zinc/03/89/78/1134038978.db2.gz GALWTWCJPWDOGM-HNNXBMFYSA-N 1 1 334.416 3.854 20 10 EHCDMO C[C@@H]([NH2+]CC1(N(C)C)CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788505019 1134133779 /nfs/dbraw/zinc/13/37/79/1134133779.db2.gz IWLVCAFCFDZHHH-GFCCVEGCSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@H]([NH2+]CCCNc1ccccn1)c1cccc(C(F)(F)F)c1O ZINC000788629382 1134153939 /nfs/dbraw/zinc/15/39/39/1134153939.db2.gz UHQWLCJJRAYHPT-LBPRGKRZSA-N 1 1 339.361 3.959 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000774958308 1134156160 /nfs/dbraw/zinc/15/61/60/1134156160.db2.gz WYZOMQXQAFUDIV-GZBFAFLISA-N 1 1 334.416 3.758 20 10 EHCDMO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc(C(F)(F)F)c1O ZINC000788749127 1134169902 /nfs/dbraw/zinc/16/99/02/1134169902.db2.gz CLTWEBACUXCZNB-GWCFXTLKSA-N 1 1 329.318 3.778 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775029450 1134229678 /nfs/dbraw/zinc/22/96/78/1134229678.db2.gz MLPJUQQDLQQPRS-CHWSQXEVSA-N 1 1 330.384 3.591 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2c(Cl)cccc2OC)c1 ZINC000790697307 1134454748 /nfs/dbraw/zinc/45/47/48/1134454748.db2.gz IOVSPFRSOAZIIR-LLVKDONJSA-N 1 1 349.814 3.692 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000790961936 1134486309 /nfs/dbraw/zinc/48/63/09/1134486309.db2.gz TYVZUSWYGGSMDI-QMMMGPOBSA-N 1 1 335.766 3.617 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@H](O)c1cccc(F)c1 ZINC000790973527 1134494310 /nfs/dbraw/zinc/49/43/10/1134494310.db2.gz NIWRMKCGTRIDPG-FVMDXXJSSA-N 1 1 327.758 3.536 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2c([O-])ccc(Cl)c2F)cc(OC)c1 ZINC000792163410 1134660291 /nfs/dbraw/zinc/66/02/91/1134660291.db2.gz YZVNKRBSFSHFFW-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO OC[C@@H](C1CC1)[N@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792174836 1134663673 /nfs/dbraw/zinc/66/36/73/1134663673.db2.gz IHKCPESUMWAQAU-KRWDZBQOSA-N 1 1 349.833 3.958 20 10 EHCDMO OC[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792174836 1134663677 /nfs/dbraw/zinc/66/36/77/1134663677.db2.gz IHKCPESUMWAQAU-KRWDZBQOSA-N 1 1 349.833 3.958 20 10 EHCDMO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000775368990 1134668932 /nfs/dbraw/zinc/66/89/32/1134668932.db2.gz IJTIHPXGACFUIT-LSDHHAIUSA-N 1 1 342.277 3.838 20 10 EHCDMO Cc1ccc(CCC[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cn1 ZINC000792767798 1134791799 /nfs/dbraw/zinc/79/17/99/1134791799.db2.gz WMTSOACVOATBSG-FQEVSTJZSA-N 1 1 340.467 3.709 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2CCCOC2)c(C(F)(F)F)c1 ZINC000792808163 1134794270 /nfs/dbraw/zinc/79/42/70/1134794270.db2.gz CDERPLAPQVELTD-CYBMUJFWSA-N 1 1 330.394 3.630 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCCCO)C2CC2)c(C(F)(F)F)c1 ZINC000792821895 1134795943 /nfs/dbraw/zinc/79/59/43/1134795943.db2.gz GLJPQYSSMAKXML-UHFFFAOYSA-N 1 1 330.394 3.508 20 10 EHCDMO Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000793206986 1134882405 /nfs/dbraw/zinc/88/24/05/1134882405.db2.gz MLYZKVZPRDXUOI-QGZVFWFLSA-N 1 1 344.886 3.966 20 10 EHCDMO Cc1cc(C[N@H+]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)ccc1N(C)C ZINC001192990844 1135081844 /nfs/dbraw/zinc/08/18/44/1135081844.db2.gz SWSZLTMQZDMMGY-INIZCTEOSA-N 1 1 347.503 3.502 20 10 EHCDMO Cc1cc(C[N@@H+]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)ccc1N(C)C ZINC001192990844 1135081848 /nfs/dbraw/zinc/08/18/48/1135081848.db2.gz SWSZLTMQZDMMGY-INIZCTEOSA-N 1 1 347.503 3.502 20 10 EHCDMO Cc1cccc(C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)c1O ZINC000775645421 1135392530 /nfs/dbraw/zinc/39/25/30/1135392530.db2.gz KZGZHKFDYFKZNF-UHFFFAOYSA-N 1 1 328.431 3.548 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C(=O)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000806326590 1135428508 /nfs/dbraw/zinc/42/85/08/1135428508.db2.gz RWADEEFUXQDVIQ-IBGZPJMESA-N 1 1 345.531 3.756 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1O ZINC000775737072 1135593759 /nfs/dbraw/zinc/59/37/59/1135593759.db2.gz AHRQLYJCHBJEIQ-OAHLLOKOSA-N 1 1 342.277 3.710 20 10 EHCDMO CC[C@]1(C)CC(=O)N(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)C1 ZINC000808142440 1135623700 /nfs/dbraw/zinc/62/37/00/1135623700.db2.gz SJXBPIFVEHELEN-HXUWFJFHSA-N 1 1 331.504 3.569 20 10 EHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](CC(N)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000808229479 1135633862 /nfs/dbraw/zinc/63/38/62/1135633862.db2.gz RDCIFXWVCQPTAY-AWEZNQCLSA-N 1 1 346.515 3.685 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c(O)c1 ZINC000809712550 1135875932 /nfs/dbraw/zinc/87/59/32/1135875932.db2.gz QIKQBTJFRYRPNS-UHFFFAOYSA-N 1 1 344.430 3.642 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4CCCC[C@H]4C3)cc2)CC1 ZINC001199052926 1135876219 /nfs/dbraw/zinc/87/62/19/1135876219.db2.gz OVSALSMDTZIKQJ-QHAWAJNXSA-N 1 1 341.543 3.887 20 10 EHCDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000809720624 1135878413 /nfs/dbraw/zinc/87/84/13/1135878413.db2.gz JZPSBEBSVAZUAC-HNNXBMFYSA-N 1 1 340.851 3.535 20 10 EHCDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC/C=C\c1ccc(N(C)C)cc1 ZINC001199677955 1135919261 /nfs/dbraw/zinc/91/92/61/1135919261.db2.gz IEAPQEMXVBCCPS-QRTFGMIHSA-N 1 1 329.532 3.722 20 10 EHCDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001199677955 1135919262 /nfs/dbraw/zinc/91/92/62/1135919262.db2.gz IEAPQEMXVBCCPS-QRTFGMIHSA-N 1 1 329.532 3.722 20 10 EHCDMO CCc1nnc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000810175874 1135934180 /nfs/dbraw/zinc/93/41/80/1135934180.db2.gz FEFJUWSGKWHAAV-UHFFFAOYSA-N 1 1 325.437 3.763 20 10 EHCDMO CCOC(=O)c1ccc(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)o1 ZINC000776173901 1136021178 /nfs/dbraw/zinc/02/11/78/1136021178.db2.gz CWZAEDRBTSJYRB-UHFFFAOYSA-N 1 1 348.418 3.731 20 10 EHCDMO CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)[C@H]1[C@H]1CCCO1 ZINC000811511093 1136102481 /nfs/dbraw/zinc/10/24/81/1136102481.db2.gz UWKWDVPXJOTGJY-CABCVRRESA-N 1 1 340.261 3.544 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)c1 ZINC000811801255 1136138368 /nfs/dbraw/zinc/13/83/68/1136138368.db2.gz HGHJSQSFIYSFHO-HNNXBMFYSA-N 1 1 349.862 3.692 20 10 EHCDMO CO[C@@](C)(C[NH2+][C@H](C)c1cc(Br)c(F)cc1O)C1CC1 ZINC000812734890 1136239233 /nfs/dbraw/zinc/23/92/33/1136239233.db2.gz ULQHAXLGRHQHKO-PSLIRLAXSA-N 1 1 346.240 3.760 20 10 EHCDMO CO[C@@](C)(C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O)C1CC1 ZINC000812734892 1136239528 /nfs/dbraw/zinc/23/95/28/1136239528.db2.gz ULQHAXLGRHQHKO-VFZGTOFNSA-N 1 1 346.240 3.760 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccc(N2CCCCC2)c(F)c1 ZINC000850498819 1136271992 /nfs/dbraw/zinc/27/19/92/1136271992.db2.gz DLMKWXPFJNOMJH-GRDNDAEWSA-N 1 1 343.450 3.764 20 10 EHCDMO C[C@H]([NH2+]CCO[C@@H]1CC1(F)F)c1cc(Cl)c(Cl)cc1O ZINC000850521164 1136276351 /nfs/dbraw/zinc/27/63/51/1136276351.db2.gz OJSNRSICMNVIPC-JVXZTZIISA-N 1 1 326.170 3.774 20 10 EHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)c(C)s1 ZINC000850566197 1136287422 /nfs/dbraw/zinc/28/74/22/1136287422.db2.gz LQRSSKOZLINOOS-ZDUSSCGKSA-N 1 1 345.512 3.572 20 10 EHCDMO CCOCc1cc(CNC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)ccc1OC ZINC000747854023 1136326170 /nfs/dbraw/zinc/32/61/70/1136326170.db2.gz LLDBLHCMBAAWDO-DYESRHJHSA-N 1 1 348.531 3.832 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)ccc1F)C[C@H]1CCCO1 ZINC000111232910 1136524684 /nfs/dbraw/zinc/52/46/84/1136524684.db2.gz FOMBAZYDYTUGCQ-QGZVFWFLSA-N 1 1 333.378 3.852 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)Cc1ccc(F)cc1 ZINC000815019047 1136538216 /nfs/dbraw/zinc/53/82/16/1136538216.db2.gz HAODLFPBKLZVKY-OAQYLSRUSA-N 1 1 344.474 3.706 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@H]1c1ccco1)OCO2 ZINC000853538649 1136542534 /nfs/dbraw/zinc/54/25/34/1136542534.db2.gz IJVLOSNINCWJBI-GOSISDBHSA-N 1 1 327.380 3.831 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCOCC3)[C@@H]1c1ccco1)CCC2 ZINC000853552001 1136544012 /nfs/dbraw/zinc/54/40/12/1136544012.db2.gz RHMBZTHEAPJXGJ-FQEVSTJZSA-N 1 1 339.435 3.828 20 10 EHCDMO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815073108 1136547371 /nfs/dbraw/zinc/54/73/71/1136547371.db2.gz FYGZDGKQOYBKDF-UHFFFAOYSA-N 1 1 328.485 3.711 20 10 EHCDMO COc1cc(C[N@@H+](Cc2ccc(N(C)C)c(C)c2)C2CC2)ccc1O ZINC000815077450 1136547706 /nfs/dbraw/zinc/54/77/06/1136547706.db2.gz OUPOXEVPFSONLO-UHFFFAOYSA-N 1 1 340.467 3.940 20 10 EHCDMO CC[C@@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000854222747 1136598936 /nfs/dbraw/zinc/59/89/36/1136598936.db2.gz LJBGAJXFRFJQNI-BHIYHBOVSA-N 1 1 328.431 3.718 20 10 EHCDMO C[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815555074 1136609806 /nfs/dbraw/zinc/60/98/06/1136609806.db2.gz PBJUEZKJVSVCRY-OLZOCXBDSA-N 1 1 347.377 3.647 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815586587 1136615026 /nfs/dbraw/zinc/61/50/26/1136615026.db2.gz MOOYHIPQBCSUGL-OCCSQVGLSA-N 1 1 339.357 3.838 20 10 EHCDMO C[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815586585 1136615044 /nfs/dbraw/zinc/61/50/44/1136615044.db2.gz MOOYHIPQBCSUGL-GXTWGEPZSA-N 1 1 339.357 3.838 20 10 EHCDMO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1cccc(C(F)(F)F)c1O ZINC000815625679 1136620905 /nfs/dbraw/zinc/62/09/05/1136620905.db2.gz JYVSXQRCSIBSAO-LLVKDONJSA-N 1 1 335.329 3.910 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)CCCOc2ccccc2)c1O ZINC000748051445 1136686875 /nfs/dbraw/zinc/68/68/75/1136686875.db2.gz XLOUHHKUYUDNQG-UHFFFAOYSA-N 1 1 331.387 3.635 20 10 EHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000816491466 1136724323 /nfs/dbraw/zinc/72/43/23/1136724323.db2.gz MUIFZNAIKMHKLI-JTQLQIEISA-N 1 1 341.732 3.728 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000816495364 1136724839 /nfs/dbraw/zinc/72/48/39/1136724839.db2.gz UWNSRLTVWOCSKJ-UHFFFAOYSA-N 1 1 334.822 3.897 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000816495364 1136724840 /nfs/dbraw/zinc/72/48/40/1136724840.db2.gz UWNSRLTVWOCSKJ-UHFFFAOYSA-N 1 1 334.822 3.897 20 10 EHCDMO CN(C)C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(F)cc1 ZINC000816612666 1136741532 /nfs/dbraw/zinc/74/15/32/1136741532.db2.gz VRWPNFBQUXUWHE-MRXNPFEDSA-N 1 1 340.801 3.716 20 10 EHCDMO COc1cccc(C[N@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)c1O ZINC000816659250 1136745961 /nfs/dbraw/zinc/74/59/61/1136745961.db2.gz HGCDAPXSHQWUBF-INIZCTEOSA-N 1 1 333.815 3.708 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCC[N@H+]2CC(C)C)cc1 ZINC001135946064 1136821083 /nfs/dbraw/zinc/82/10/83/1136821083.db2.gz CQZOPTCYAGUXCL-FQEVSTJZSA-N 1 1 345.531 3.612 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000817938747 1136847240 /nfs/dbraw/zinc/84/72/40/1136847240.db2.gz RFHIWOCSRTUEIC-ZWKOTPCHSA-N 1 1 345.487 3.718 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cc2c(s1)CCC2 ZINC000817939559 1136847960 /nfs/dbraw/zinc/84/79/60/1136847960.db2.gz CMNKAGCHOCYMMN-GUYCJALGSA-N 1 1 329.513 3.653 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000817938992 1136848377 /nfs/dbraw/zinc/84/83/77/1136848377.db2.gz XFNHMXJURIIHCN-CXAGYDPISA-N 1 1 349.425 3.705 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000817943525 1136848987 /nfs/dbraw/zinc/84/89/87/1136848987.db2.gz UXCYUKXFKOEYMA-CXAGYDPISA-N 1 1 340.496 3.713 20 10 EHCDMO CCN(C)c1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817942256 1136849513 /nfs/dbraw/zinc/84/95/13/1136849513.db2.gz NPJXQQZFTKFAJF-HRAATJIYSA-N 1 1 340.515 3.559 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817946916 1136850002 /nfs/dbraw/zinc/85/00/02/1136850002.db2.gz HSZKVOKKXLHLPU-ZOWXZIJZSA-N 1 1 341.293 3.584 20 10 EHCDMO Nc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H]3CCC[C@H]32)cc1 ZINC000817957349 1136851594 /nfs/dbraw/zinc/85/15/94/1136851594.db2.gz LCKRVBOPWMMDMS-ZRBLBEILSA-N 1 1 349.522 3.844 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)cn1 ZINC000858131577 1136942392 /nfs/dbraw/zinc/94/23/92/1136942392.db2.gz ZQLPIAWOKBYIOZ-UHFFFAOYSA-N 1 1 335.398 3.504 20 10 EHCDMO COc1ccc(N2CC[C@@H](CNc3[nH+]c4ccccc4n3C)C2)cc1 ZINC000819936679 1136968163 /nfs/dbraw/zinc/96/81/63/1136968163.db2.gz UNYVHLMWRMIIFY-HNNXBMFYSA-N 1 1 336.439 3.520 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Br)cc1[O-] ZINC000858490627 1136972993 /nfs/dbraw/zinc/97/29/93/1136972993.db2.gz KYTLAIRDMZHSPK-CHWSQXEVSA-N 1 1 341.293 3.537 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)c1ncc(Br)cn1)c1ccccc1O ZINC000805749038 1136994857 /nfs/dbraw/zinc/99/48/57/1136994857.db2.gz UMNQMQJYAHNWBK-MFKMUULPSA-N 1 1 336.233 3.747 20 10 EHCDMO CN(Cc1cccs1)c1ccc(CN2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000823447050 1137099924 /nfs/dbraw/zinc/09/99/24/1137099924.db2.gz BRDIHJJRQLMOJZ-SFHVURJKSA-N 1 1 343.540 3.768 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC000823452923 1137100339 /nfs/dbraw/zinc/10/03/39/1137100339.db2.gz GTJIHTWOVCXAHU-HDICACEKSA-N 1 1 328.481 3.748 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2cc[nH]c2c1 ZINC000862214142 1137132354 /nfs/dbraw/zinc/13/23/54/1137132354.db2.gz HJSGLNFKZHYGMZ-UHFFFAOYSA-N 1 1 335.451 3.637 20 10 EHCDMO COC1CCC([N@@H+](C)Cc2c(O)cccc2Br)CC1 ZINC000862245277 1137134460 /nfs/dbraw/zinc/13/44/60/1137134460.db2.gz LVRNZVFIXKQVGN-UHFFFAOYSA-N 1 1 328.250 3.544 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000862313599 1137138076 /nfs/dbraw/zinc/13/80/76/1137138076.db2.gz KIAGABIIKPQJML-CQSZACIVSA-N 1 1 347.256 3.614 20 10 EHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(O)(c3ccccc3)CC2)cc1F ZINC000862329862 1137138467 /nfs/dbraw/zinc/13/84/67/1137138467.db2.gz NPXUUMCVPWTUDA-UHFFFAOYSA-N 1 1 346.421 3.514 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1c(O)cccc1Br)c1nccs1 ZINC000862323557 1137138482 /nfs/dbraw/zinc/13/84/82/1137138482.db2.gz WPIBIQUZJZUWRY-JTQLQIEISA-N 1 1 341.274 3.847 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2c(O)cccc2Br)CC1 ZINC000862351580 1137139539 /nfs/dbraw/zinc/13/95/39/1137139539.db2.gz QQQMWWJOINDJFV-OAHLLOKOSA-N 1 1 328.250 3.546 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000862367137 1137140791 /nfs/dbraw/zinc/14/07/91/1137140791.db2.gz XCTOIWCGBMCQSA-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000862367136 1137140805 /nfs/dbraw/zinc/14/08/05/1137140805.db2.gz XCTOIWCGBMCQSA-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000862387181 1137141979 /nfs/dbraw/zinc/14/19/79/1137141979.db2.gz IIPDMWOKNPVLME-OAHLLOKOSA-N 1 1 342.302 3.874 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473537 1137146092 /nfs/dbraw/zinc/14/60/92/1137146092.db2.gz UXUVEJFCDRHOBG-OLZOCXBDSA-N 1 1 328.275 3.625 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000862484933 1137146646 /nfs/dbraw/zinc/14/66/46/1137146646.db2.gz CVWQXBKEOPAKDX-PBHICJAKSA-N 1 1 349.471 3.591 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824696827 1137147209 /nfs/dbraw/zinc/14/72/09/1137147209.db2.gz UULXIVHCPJGUPR-GLQYFDAESA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824696827 1137147210 /nfs/dbraw/zinc/14/72/10/1137147210.db2.gz UULXIVHCPJGUPR-GLQYFDAESA-N 1 1 327.827 3.700 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2nc3ccccc3n2C)cc1Cl ZINC000824802808 1137153052 /nfs/dbraw/zinc/15/30/52/1137153052.db2.gz PSJHEILWIXPNLV-UHFFFAOYSA-N 1 1 329.831 3.873 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)Cc2nc3ccccc3n2C)cc1Cl ZINC000824802808 1137153054 /nfs/dbraw/zinc/15/30/54/1137153054.db2.gz PSJHEILWIXPNLV-UHFFFAOYSA-N 1 1 329.831 3.873 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1ccc(Br)cc1O ZINC000824895344 1137155924 /nfs/dbraw/zinc/15/59/24/1137155924.db2.gz UVHYZHAWMAMDBN-UHFFFAOYSA-N 1 1 341.274 3.676 20 10 EHCDMO CCn1cc([C@H](C)[NH2+]Cc2cc(C)cc(Br)c2O)cn1 ZINC000825130230 1137167042 /nfs/dbraw/zinc/16/70/42/1137167042.db2.gz QBNDJJWPQCFAIF-NSHDSACASA-N 1 1 338.249 3.530 20 10 EHCDMO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1cc(C)cc(Br)c1O ZINC000825284635 1137171534 /nfs/dbraw/zinc/17/15/34/1137171534.db2.gz UUIQBPHQSKSTCB-ZIAGYGMSSA-N 1 1 328.250 3.510 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)cc1C ZINC000863303667 1137180402 /nfs/dbraw/zinc/18/04/02/1137180402.db2.gz YEZXBWMTKAKQLT-HOCLYGCPSA-N 1 1 349.471 3.509 20 10 EHCDMO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000863941735 1137208643 /nfs/dbraw/zinc/20/86/43/1137208643.db2.gz JPPJQLMASYDIKZ-HXUWFJFHSA-N 1 1 345.531 3.754 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000865725961 1137306904 /nfs/dbraw/zinc/30/69/04/1137306904.db2.gz RHSLNGBEHINJLN-UHFFFAOYSA-N 1 1 348.240 3.517 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[N@H+](C)[C@H](C)C2)c1 ZINC001146516940 1137391103 /nfs/dbraw/zinc/39/11/03/1137391103.db2.gz JNFAYVMTCGBMCI-OAHLLOKOSA-N 1 1 345.874 3.524 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[N@@H+](C)[C@H](C)C2)c1 ZINC001146516940 1137391104 /nfs/dbraw/zinc/39/11/04/1137391104.db2.gz JNFAYVMTCGBMCI-OAHLLOKOSA-N 1 1 345.874 3.524 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000773257105 1137482145 /nfs/dbraw/zinc/48/21/45/1137482145.db2.gz COWFZTGSRSADTH-JKSUJKDBSA-N 1 1 326.440 3.579 20 10 EHCDMO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC001172101678 1137532420 /nfs/dbraw/zinc/53/24/20/1137532420.db2.gz HPIREXKGGDLEAO-ZKTXZKFHSA-N 1 1 327.516 3.782 20 10 EHCDMO CC[C@H](C)OCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172340722 1137552312 /nfs/dbraw/zinc/55/23/12/1137552312.db2.gz KVSJAVSMKQAPBX-MSOLQXFVSA-N 1 1 334.504 3.549 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nnc3n2CCCCC3)cc1C ZINC000873011548 1137588050 /nfs/dbraw/zinc/58/80/50/1137588050.db2.gz YYIFOKZARRIUME-MRXNPFEDSA-N 1 1 342.487 3.953 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(C(F)F)nc1)C[C@H]1CCCO1 ZINC000876531786 1137654780 /nfs/dbraw/zinc/65/47/80/1137654780.db2.gz OXXINXITBCXDIY-MRXNPFEDSA-N 1 1 348.393 3.906 20 10 EHCDMO CC[N@@H+](CCc1cccs1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876610746 1137656944 /nfs/dbraw/zinc/65/69/44/1137656944.db2.gz ZPFFKLJHVPFBAS-UHFFFAOYSA-N 1 1 344.524 3.774 20 10 EHCDMO C[C@H](c1ccco1)[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876640021 1137657869 /nfs/dbraw/zinc/65/78/69/1137657869.db2.gz YQDDAFDTGJIGSP-MRXNPFEDSA-N 1 1 340.467 3.966 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@@H]3c3cccc(F)c3)cc2)CC1 ZINC000876774890 1137660938 /nfs/dbraw/zinc/66/09/38/1137660938.db2.gz JOGUMZPJWNSBTK-OAQYLSRUSA-N 1 1 340.442 3.734 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)N(C)c2ccc(N)cc2)cc1)C(C)C ZINC000877077488 1137669761 /nfs/dbraw/zinc/66/97/61/1137669761.db2.gz KKXPNIJKGLQJKB-UHFFFAOYSA-N 1 1 325.456 3.776 20 10 EHCDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825991754 1137684413 /nfs/dbraw/zinc/68/44/13/1137684413.db2.gz MIDAQLSVYFBTJP-LLVKDONJSA-N 1 1 330.291 3.730 20 10 EHCDMO CC(=O)Nc1ccc2c(c1)C[N@H+](Cc1c(O)cccc1Cl)CC2 ZINC000877817388 1137691316 /nfs/dbraw/zinc/69/13/16/1137691316.db2.gz UTDPGFSCIJWRTF-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)[C@H]1CCCOC1 ZINC000880465639 1137779475 /nfs/dbraw/zinc/77/94/75/1137779475.db2.gz GVQFDZCMESKHNV-LRDDRELGSA-N 1 1 325.836 3.543 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2cc(C)ccc2O)cc1OC(F)F ZINC000130409346 1137836972 /nfs/dbraw/zinc/83/69/72/1137836972.db2.gz ILAPPZCJWISHDU-UHFFFAOYSA-N 1 1 337.366 3.943 20 10 EHCDMO COc1cc(C)c([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC000882889858 1137837074 /nfs/dbraw/zinc/83/70/74/1137837074.db2.gz KNBDTMIHNHMPGC-LLVKDONJSA-N 1 1 337.366 3.847 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H](O)c1c(F)cccc1F ZINC000883025397 1137841923 /nfs/dbraw/zinc/84/19/23/1137841923.db2.gz JAZSMGCJBQGZOX-RHSMWYFYSA-N 1 1 343.320 3.550 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(Cc2ccccc2)CCOCC1 ZINC000883139589 1137846190 /nfs/dbraw/zinc/84/61/90/1137846190.db2.gz RWMREZIVTUMXKR-UHFFFAOYSA-N 1 1 333.378 3.552 20 10 EHCDMO OC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(C(F)(F)F)c1 ZINC000883193336 1137848052 /nfs/dbraw/zinc/84/80/52/1137848052.db2.gz UGPCOOOBSQJQNE-AWEZNQCLSA-N 1 1 347.283 3.512 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1ccc(N(C)C)cc1 ZINC000120870185 1137953176 /nfs/dbraw/zinc/95/31/76/1137953176.db2.gz CEZYULYITXMSLM-OAHLLOKOSA-N 1 1 329.463 3.804 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCC2)cc1)c1c(O)cccc1F ZINC000886514022 1138087691 /nfs/dbraw/zinc/08/76/91/1138087691.db2.gz CHQSFXFJDXPXPO-CQSZACIVSA-N 1 1 342.414 3.618 20 10 EHCDMO COC(=O)CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886545126 1138094126 /nfs/dbraw/zinc/09/41/26/1138094126.db2.gz HJJAOCMTZHZQLO-BBRMVZONSA-N 1 1 331.387 3.876 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886545553 1138094360 /nfs/dbraw/zinc/09/43/60/1138094360.db2.gz NQRPUOMBHHSPAB-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1c(O)cccc1F ZINC000886553628 1138095450 /nfs/dbraw/zinc/09/54/50/1138095450.db2.gz RYDFCNIJAIGWSQ-STQMWFEESA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)CCCNC(=O)OC(C)(C)C)c1c(O)cccc1F ZINC000886615987 1138102467 /nfs/dbraw/zinc/10/24/67/1138102467.db2.gz SBBYHGMCKYBLMK-QWHCGFSZSA-N 1 1 340.439 3.875 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](OC(C)(C)C)[C@@H]1n1cccn1)c1c(O)cccc1F ZINC000886621730 1138103215 /nfs/dbraw/zinc/10/32/15/1138103215.db2.gz ACAGJLWBUYUQHF-IYPIGGPWSA-N 1 1 347.434 3.576 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1c([O-])cccc1F ZINC000886629867 1138103769 /nfs/dbraw/zinc/10/37/69/1138103769.db2.gz PXOUIIKOFFVBEK-UAGQMJEPSA-N 1 1 328.431 3.527 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(-c2cccnc2)no1 ZINC000076074241 1138129700 /nfs/dbraw/zinc/12/97/00/1138129700.db2.gz ITVXQURNHJVJFS-CQSZACIVSA-N 1 1 338.411 3.810 20 10 EHCDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)s1 ZINC000093612608 1138239106 /nfs/dbraw/zinc/23/91/06/1138239106.db2.gz CJLDEKDYKIGJEM-LLVKDONJSA-N 1 1 334.441 3.641 20 10 EHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)c(O)c1 ZINC000093712913 1138240470 /nfs/dbraw/zinc/24/04/70/1138240470.db2.gz OOQCIXCNMCVYNW-DEOSSOPVSA-N 1 1 347.480 3.550 20 10 EHCDMO CCOc1cccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1O ZINC000093768902 1138240793 /nfs/dbraw/zinc/24/07/93/1138240793.db2.gz XOMOSLRVTQXHCE-DYVFJYSZSA-N 1 1 333.453 3.814 20 10 EHCDMO COc1cccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000173866826 1139383271 /nfs/dbraw/zinc/38/32/71/1139383271.db2.gz LJDACZXOCAQARO-GFCCVEGCSA-N 1 1 331.416 3.682 20 10 EHCDMO CC(C)OC[C@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179643759 1139771597 /nfs/dbraw/zinc/77/15/97/1139771597.db2.gz OWWVENUKCORARE-FXAWDEMLSA-N 1 1 343.467 3.741 20 10 EHCDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@@H](C)c1cccc(O)c1 ZINC000179770795 1139781705 /nfs/dbraw/zinc/78/17/05/1139781705.db2.gz YSGLMGAWUYAWFK-ZDUSSCGKSA-N 1 1 331.412 3.698 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)cc1OC ZINC000180154031 1139813025 /nfs/dbraw/zinc/81/30/25/1139813025.db2.gz WDWLJZRUHOXPEP-NSHDSACASA-N 1 1 336.457 3.676 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1 ZINC000180396319 1139830904 /nfs/dbraw/zinc/83/09/04/1139830904.db2.gz CUKYRBXTGXYMOB-BFUOFWGJSA-N 1 1 331.387 3.502 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(Cl)ccc1[O-] ZINC000185054876 1140133728 /nfs/dbraw/zinc/13/37/28/1140133728.db2.gz FNGOHJNFXRYITF-CQSZACIVSA-N 1 1 348.874 3.837 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1O ZINC000185090550 1140135722 /nfs/dbraw/zinc/13/57/22/1140135722.db2.gz JGRJCJOURQMLSA-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185478797 1140152169 /nfs/dbraw/zinc/15/21/69/1140152169.db2.gz HXFONSZKOUXFDS-DJJJIMSYSA-N 1 1 333.403 3.703 20 10 EHCDMO COc1cccc(-c2noc([C@H](C)[NH2+]Cc3cccc(C)c3O)n2)c1 ZINC000191562562 1140471923 /nfs/dbraw/zinc/47/19/23/1140471923.db2.gz GOHFUHRHBNJPJW-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)n1 ZINC000191826621 1140488293 /nfs/dbraw/zinc/48/82/93/1140488293.db2.gz KZUIHNNYFHWNMN-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@H]2CCC[N@H+]2Cc2cc(C)ccc2O)n1 ZINC000191826621 1140488297 /nfs/dbraw/zinc/48/82/97/1140488297.db2.gz KZUIHNNYFHWNMN-OAHLLOKOSA-N 1 1 346.452 3.671 20 10 EHCDMO COc1ccsc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000271027224 1141296622 /nfs/dbraw/zinc/29/66/22/1141296622.db2.gz WRYUSAMFHYXBLA-HNNXBMFYSA-N 1 1 333.453 3.644 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1)c1cscn1 ZINC000271069970 1141303644 /nfs/dbraw/zinc/30/36/44/1141303644.db2.gz DWGRMFNVAVRDMJ-HZSPNIEDSA-N 1 1 349.475 3.747 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)c1c[nH]c2ncccc12 ZINC000271200884 1141323694 /nfs/dbraw/zinc/32/36/94/1141323694.db2.gz FNRJPHUNAFALEZ-CQSZACIVSA-N 1 1 337.423 3.752 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1)c1nccs1 ZINC000271396470 1141357193 /nfs/dbraw/zinc/35/71/93/1141357193.db2.gz KWQFUMLNCVBASB-MJBXVCDLSA-N 1 1 349.475 3.747 20 10 EHCDMO CC[N@H+](Cc1csc(C)n1)Cc1cc(Br)ccc1O ZINC000076118596 1125476472 /nfs/dbraw/zinc/47/64/72/1125476472.db2.gz NZOYIIGNKSJEIJ-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO CC[N@@H+](Cc1csc(C)n1)Cc1cc(Br)ccc1O ZINC000076118596 1125476473 /nfs/dbraw/zinc/47/64/73/1125476473.db2.gz NZOYIIGNKSJEIJ-UHFFFAOYSA-N 1 1 341.274 3.942 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cc1OC ZINC000160205058 1014356832 /nfs/dbraw/zinc/35/68/32/1014356832.db2.gz LMPXHXLTHAKSHM-ZBFHGGJFSA-N 1 1 327.424 3.787 20 10 EHCDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000078679704 1018025519 /nfs/dbraw/zinc/02/55/19/1018025519.db2.gz YKJBJFGBDXNUBL-MRVPVSSYSA-N 1 1 325.206 3.610 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3cccs3)C1)CCCC2 ZINC000160413394 1018751094 /nfs/dbraw/zinc/75/10/94/1018751094.db2.gz WJKNUEWPWPORCO-GOSISDBHSA-N 1 1 329.465 3.906 20 10 EHCDMO CCOCc1cc(CNC2CC(C)(C)[NH2+]C(C)(C)C2)ccc1OC ZINC000171415955 1018790557 /nfs/dbraw/zinc/79/05/57/1018790557.db2.gz KISNKLATCDVOCX-UHFFFAOYSA-N 1 1 334.504 3.631 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@H](CC)c2ccc(C)cc2O)[C@H](C)C1 ZINC000280054364 1020040508 /nfs/dbraw/zinc/04/05/08/1020040508.db2.gz JUZXNMPHUFRTPF-RLLQIKCJSA-N 1 1 348.531 3.878 20 10 EHCDMO CN1CCN(c2ccc(CNc3cccc(C4=[NH+]CCC4)c3)cc2)CC1 ZINC001167436819 1020133112 /nfs/dbraw/zinc/13/31/12/1020133112.db2.gz AUTMEAJQWOFKAB-UHFFFAOYSA-N 1 1 348.494 3.633 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC[C@@H]1O ZINC000275996584 1020143933 /nfs/dbraw/zinc/14/39/33/1020143933.db2.gz OIBOQCLZOHIVBK-FQEVSTJZSA-N 1 1 341.451 3.564 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1c(O)cccc1Cl ZINC000121312846 1020802599 /nfs/dbraw/zinc/80/25/99/1020802599.db2.gz DDJHECGMEFPIAH-UHFFFAOYSA-N 1 1 346.858 3.514 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H](O)C(F)F ZINC000834875872 1020988554 /nfs/dbraw/zinc/98/85/54/1020988554.db2.gz UXWZKSTUNMKYET-LTEOIEINSA-N 1 1 328.186 3.754 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000290809752 1022104340 /nfs/dbraw/zinc/10/43/40/1022104340.db2.gz GAGSHEPTWXEZSR-OAHLLOKOSA-N 1 1 327.815 3.842 20 10 EHCDMO COC[C@@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894952315 1022291812 /nfs/dbraw/zinc/29/18/12/1022291812.db2.gz IYLHUMUSGSFNHW-LLVKDONJSA-N 1 1 346.240 3.542 20 10 EHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894952315 1022291818 /nfs/dbraw/zinc/29/18/18/1022291818.db2.gz IYLHUMUSGSFNHW-LLVKDONJSA-N 1 1 346.240 3.542 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2c1NCCC2 ZINC000894571390 1022571718 /nfs/dbraw/zinc/57/17/18/1022571718.db2.gz PXZVOYNPADFMAZ-UHFFFAOYSA-N 1 1 347.256 3.803 20 10 EHCDMO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3cc(F)ccc3O)n2)cc1 ZINC000276772596 1022772384 /nfs/dbraw/zinc/77/23/84/1022772384.db2.gz PCHIOBCAQDYHNK-LBPRGKRZSA-N 1 1 341.386 3.995 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+](C)Cc2cc(Br)cn2C)c1 ZINC000164491101 1022888682 /nfs/dbraw/zinc/88/86/82/1022888682.db2.gz FRBJWOCCELJXGL-UHFFFAOYSA-N 1 1 337.261 3.742 20 10 EHCDMO Cc1noc(C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)c2ccccc2)n1 ZINC000277213623 1024226151 /nfs/dbraw/zinc/22/61/51/1024226151.db2.gz WXZXAXFJDYAIBO-SJKOYZFVSA-N 1 1 341.386 3.857 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1cnc2cnccn12)C1CCCCC1 ZINC000156777063 1024590428 /nfs/dbraw/zinc/59/04/28/1024590428.db2.gz LXBVFNQYEXLRGU-UHFFFAOYSA-N 1 1 336.439 3.770 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895580348 1024637965 /nfs/dbraw/zinc/63/79/65/1024637965.db2.gz ANJYSQZGUGZLSW-LLVKDONJSA-N 1 1 339.258 3.601 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCCSC[C@@H]3C)cc2)CC1 ZINC000934297587 1025315920 /nfs/dbraw/zinc/31/59/20/1025315920.db2.gz IMQXGESDVHBITF-INIZCTEOSA-N 1 1 334.529 3.629 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3nc4c(s3)CCC4)C2)c1O ZINC000896516950 1025524821 /nfs/dbraw/zinc/52/48/21/1025524821.db2.gz TXMMDGSPWAFAGB-CQSZACIVSA-N 1 1 344.480 3.726 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3nc4c(s3)CCC4)C2)c1O ZINC000896516948 1025525603 /nfs/dbraw/zinc/52/56/03/1025525603.db2.gz TXMMDGSPWAFAGB-AWEZNQCLSA-N 1 1 344.480 3.726 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1 ZINC000273355824 1027392425 /nfs/dbraw/zinc/39/24/25/1027392425.db2.gz CRHNFDHJFNSOGS-GHMZBOCLSA-N 1 1 335.350 3.869 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCCOc3ccccc32)c1 ZINC000273368942 1027397864 /nfs/dbraw/zinc/39/78/64/1027397864.db2.gz CBZAMABDJBXYLK-GUYCJALGSA-N 1 1 341.407 3.743 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000273384865 1027406759 /nfs/dbraw/zinc/40/67/59/1027406759.db2.gz JDQQDIMNMLCEIN-GHMZBOCLSA-N 1 1 335.350 3.869 20 10 EHCDMO C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1[O-] ZINC000273410844 1027416792 /nfs/dbraw/zinc/41/67/92/1027416792.db2.gz HUMSFNWBAFFJRR-GFCCVEGCSA-N 1 1 341.293 3.537 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2(c3cccc(OC)c3)CC2)c1 ZINC000273547842 1027485668 /nfs/dbraw/zinc/48/56/68/1027485668.db2.gz ZSBBPJCVIMTEJN-ZDUSSCGKSA-N 1 1 341.407 3.527 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC(C)(C)c2cccnc2)c1 ZINC000840974916 1028384216 /nfs/dbraw/zinc/38/42/16/1028384216.db2.gz JLCSTKWYKSNTJE-UHFFFAOYSA-N 1 1 349.272 3.926 20 10 EHCDMO Cc1cc(O)c(C[NH2+]Cc2cccc(Br)c2O)cc1C ZINC000278340022 1030255031 /nfs/dbraw/zinc/25/50/31/1030255031.db2.gz HNLDNAKNPQRKQV-UHFFFAOYSA-N 1 1 336.229 3.767 20 10 EHCDMO CCc1nc(CN(Cc2ccccc2O)[C@@H](C)c2ccccc2)n[nH]1 ZINC000160174344 1030572293 /nfs/dbraw/zinc/57/22/93/1030572293.db2.gz QCNSSGUXDMQONS-HNNXBMFYSA-N 1 1 336.439 3.836 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCSC[C@H]2c2ccccc2)cc1OC ZINC000160228776 1030610352 /nfs/dbraw/zinc/61/03/52/1030610352.db2.gz GIGPFWNFXOPKOQ-INIZCTEOSA-N 1 1 345.464 3.700 20 10 EHCDMO Cc1ccc(O)c(C[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174669745 1031242843 /nfs/dbraw/zinc/24/28/43/1031242843.db2.gz ACMJYYWXISMGNF-LBPRGKRZSA-N 1 1 327.359 3.741 20 10 EHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898069619 1033318971 /nfs/dbraw/zinc/31/89/71/1033318971.db2.gz YFNLNRSJZSEPNU-JTQLQIEISA-N 1 1 326.824 3.706 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898069619 1033318985 /nfs/dbraw/zinc/31/89/85/1033318985.db2.gz YFNLNRSJZSEPNU-JTQLQIEISA-N 1 1 326.824 3.706 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898069619 1033319002 /nfs/dbraw/zinc/31/90/02/1033319002.db2.gz YFNLNRSJZSEPNU-JTQLQIEISA-N 1 1 326.824 3.706 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccccc3C)C2)c1O ZINC000761202786 1034407760 /nfs/dbraw/zinc/40/77/60/1034407760.db2.gz LUGCYESHSMGABB-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccccc3C)C2)c1O ZINC000761202786 1034407770 /nfs/dbraw/zinc/40/77/70/1034407770.db2.gz LUGCYESHSMGABB-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000029891468 1037415571 /nfs/dbraw/zinc/41/55/71/1037415571.db2.gz JOTMEIDZQZPWBG-LJQANCHMSA-N 1 1 341.451 3.969 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000029891468 1037415582 /nfs/dbraw/zinc/41/55/82/1037415582.db2.gz JOTMEIDZQZPWBG-LJQANCHMSA-N 1 1 341.451 3.969 20 10 EHCDMO Cc1cc(C[N@@H+]2CCCN(C(=O)C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000151931901 1037946840 /nfs/dbraw/zinc/94/68/40/1037946840.db2.gz OHGADOJPZUWBCR-UHFFFAOYSA-N 1 1 346.515 3.688 20 10 EHCDMO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2nnc3n2CCCCC3)c1O ZINC000378446459 1038629821 /nfs/dbraw/zinc/62/98/21/1038629821.db2.gz ZTXFTPCAMOSENW-GFCCVEGCSA-N 1 1 334.851 3.523 20 10 EHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000363854543 1038689664 /nfs/dbraw/zinc/68/96/64/1038689664.db2.gz MDVNIRIVFTZXAP-SDDRHHMPSA-N 1 1 329.271 3.976 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2cn3ccccc3n2)c(C(F)(F)F)c1 ZINC000279926018 1039478431 /nfs/dbraw/zinc/47/84/31/1039478431.db2.gz MWYMQUULCQJWSN-UHFFFAOYSA-N 1 1 348.372 3.709 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1C ZINC000186953228 1039499597 /nfs/dbraw/zinc/49/95/97/1039499597.db2.gz SBXRCXFKNRGQCF-IBGZPJMESA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1C ZINC000186953228 1039499605 /nfs/dbraw/zinc/49/96/05/1039499605.db2.gz SBXRCXFKNRGQCF-IBGZPJMESA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)o1 ZINC000278832987 1040882421 /nfs/dbraw/zinc/88/24/21/1040882421.db2.gz UEJHSQXNMVTDGB-LKFCYVNXSA-N 1 1 330.211 3.985 20 10 EHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(C)cc(OC)c3O)C2)cc1 ZINC000164245188 1041226606 /nfs/dbraw/zinc/22/66/06/1041226606.db2.gz XOWMIFFUEJAGKQ-INIZCTEOSA-N 1 1 327.424 3.707 20 10 EHCDMO COc1cccc(O)c1C[N@H+](C)Cc1csc(Br)c1 ZINC000768935591 1133205711 /nfs/dbraw/zinc/20/57/11/1133205711.db2.gz CWJXTLQUWPGMIP-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1csc(Br)c1 ZINC000768935591 1133205717 /nfs/dbraw/zinc/20/57/17/1133205717.db2.gz CWJXTLQUWPGMIP-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO C[N@@H+](Cc1ccncc1)Cc1cc(Cl)cc(Br)c1[O-] ZINC001141367521 1042657840 /nfs/dbraw/zinc/65/78/40/1042657840.db2.gz DKTPDJUUINWLRR-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)ccc1[N+](=O)[O-] ZINC000278884653 1042830820 /nfs/dbraw/zinc/83/08/20/1042830820.db2.gz OPVYYCBIYHIWPZ-CQSZACIVSA-N 1 1 348.786 3.740 20 10 EHCDMO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(Br)c1O ZINC000105486552 1042878488 /nfs/dbraw/zinc/87/84/88/1042878488.db2.gz SJSCMGVSRLOUNV-AWEZNQCLSA-N 1 1 334.213 3.637 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000278928088 1042974672 /nfs/dbraw/zinc/97/46/72/1042974672.db2.gz VTAGFLOCYXSKFT-KRWDZBQOSA-N 1 1 342.395 3.858 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](C)N1CCc2sccc2C1)c1ccc(F)cc1O ZINC000185174164 1126803320 /nfs/dbraw/zinc/80/33/20/1126803320.db2.gz SNYXDVJVPDYDNS-QWHCGFSZSA-N 1 1 334.460 3.690 20 10 EHCDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCN(CCc3ccccc3)C2)c1 ZINC000185337368 1126868893 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CCOc1cccc(C[N@H+]2CCN(c3ccccc3F)C[C@H]2C)c1O ZINC000789590057 1134299447 /nfs/dbraw/zinc/29/94/47/1134299447.db2.gz PSUHNKKKDUTZFW-OAHLLOKOSA-N 1 1 344.430 3.641 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cncc2ccccc21 ZINC000775152148 1134397979 /nfs/dbraw/zinc/39/79/79/1134397979.db2.gz LDKUUKNIBUVNQJ-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)OC3(CCOCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000790406473 1134411999 /nfs/dbraw/zinc/41/19/99/1134411999.db2.gz XLTNUGNTZVULGZ-MRXNPFEDSA-N 1 1 347.499 3.768 20 10 EHCDMO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1O ZINC000790935529 1134479653 /nfs/dbraw/zinc/47/96/53/1134479653.db2.gz YJMCBUOVVDDDNH-IUODEOHRSA-N 1 1 342.277 3.589 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccsc1 ZINC000790949607 1134483914 /nfs/dbraw/zinc/48/39/14/1134483914.db2.gz NTDSGEOCGSYFIO-ZDUSSCGKSA-N 1 1 328.840 3.639 20 10 EHCDMO COc1ccc(O[C@@H](C)C[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790974349 1134493817 /nfs/dbraw/zinc/49/38/17/1134493817.db2.gz SYVSQZLEWPNBRY-NSHDSACASA-N 1 1 339.794 3.750 20 10 EHCDMO CC(C)(CNCc1ccc(N2CCCCC2)cc1)C[NH+]1CCCC1 ZINC000791011690 1134496345 /nfs/dbraw/zinc/49/63/45/1134496345.db2.gz XPWTXUOUSBYSCK-UHFFFAOYSA-N 1 1 329.532 3.889 20 10 EHCDMO C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1c(O)ccc(Cl)c1F ZINC000792166982 1134662618 /nfs/dbraw/zinc/66/26/18/1134662618.db2.gz XQILWQWEMVYUFG-UHFFFAOYSA-N 1 1 346.830 3.531 20 10 EHCDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1c(O)ccc(Cl)c1F ZINC000792166982 1134662622 /nfs/dbraw/zinc/66/26/22/1134662622.db2.gz XQILWQWEMVYUFG-UHFFFAOYSA-N 1 1 346.830 3.531 20 10 EHCDMO COC(=O)[C@H]1CCCC[C@@H]1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190446872 1134702228 /nfs/dbraw/zinc/70/22/28/1134702228.db2.gz QAWOTIXNWFZCDB-XLIONFOSSA-N 1 1 344.499 3.696 20 10 EHCDMO CC[N@@H+](C)[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775406676 1134741943 /nfs/dbraw/zinc/74/19/43/1134741943.db2.gz ZIDNCGUNWLJYTQ-UZLBHIALSA-N 1 1 339.483 3.623 20 10 EHCDMO C[C@@H](NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000775410122 1134748424 /nfs/dbraw/zinc/74/84/24/1134748424.db2.gz JUIBZEYOJRCYMO-SJLPKXTDSA-N 1 1 343.515 3.584 20 10 EHCDMO CCN1CCC([N@@H+](C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792776462 1134791753 /nfs/dbraw/zinc/79/17/53/1134791753.db2.gz FNVPXKRTDXSDJQ-UHFFFAOYSA-N 1 1 343.437 3.688 20 10 EHCDMO CC[NH+]1CCC(N(C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792776462 1134791756 /nfs/dbraw/zinc/79/17/56/1134791756.db2.gz FNVPXKRTDXSDJQ-UHFFFAOYSA-N 1 1 343.437 3.688 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC001191510320 1134876961 /nfs/dbraw/zinc/87/69/61/1134876961.db2.gz PPTLZACTJHNICT-JOCHJYFZSA-N 1 1 337.511 3.849 20 10 EHCDMO CN(C)c1ccc(CN(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC001191510320 1134876964 /nfs/dbraw/zinc/87/69/64/1134876964.db2.gz PPTLZACTJHNICT-JOCHJYFZSA-N 1 1 337.511 3.849 20 10 EHCDMO CN(C)c1ccc(CN(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001191510320 1134876968 /nfs/dbraw/zinc/87/69/68/1134876968.db2.gz PPTLZACTJHNICT-JOCHJYFZSA-N 1 1 337.511 3.849 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCOc3c(Br)cccc3C2)c1O ZINC000793225769 1134877556 /nfs/dbraw/zinc/87/75/56/1134877556.db2.gz HRJIZDMPXZAAMM-UHFFFAOYSA-N 1 1 348.240 3.858 20 10 EHCDMO Cc1cccc(C[N@H+]2CCOc3c(Br)cccc3C2)c1O ZINC000793225769 1134877569 /nfs/dbraw/zinc/87/75/69/1134877569.db2.gz HRJIZDMPXZAAMM-UHFFFAOYSA-N 1 1 348.240 3.858 20 10 EHCDMO Fc1cc(C[N@@H+](CC2CC2)CC2CCC2)ccc1N1CCOCC1 ZINC000793389700 1134921705 /nfs/dbraw/zinc/92/17/05/1134921705.db2.gz MKSXZFCLXGDFOE-UHFFFAOYSA-N 1 1 332.463 3.674 20 10 EHCDMO C[N@H+](Cc1cnn(Cc2ccccc2)c1Cl)Cc1ccccc1O ZINC000793583527 1134962181 /nfs/dbraw/zinc/96/21/81/1134962181.db2.gz FFVJPELQMPSIKU-UHFFFAOYSA-N 1 1 341.842 3.922 20 10 EHCDMO C[N@@H+](Cc1cnn(Cc2ccccc2)c1Cl)Cc1ccccc1O ZINC000793583527 1134962187 /nfs/dbraw/zinc/96/21/87/1134962187.db2.gz FFVJPELQMPSIKU-UHFFFAOYSA-N 1 1 341.842 3.922 20 10 EHCDMO CC[C@H](Cc1ccc2c(c1)OCO2)[N@@H+](CC)Cc1ccccc1O ZINC001170451545 1135073694 /nfs/dbraw/zinc/07/36/94/1135073694.db2.gz YUAIYTKHWYFZNC-QGZVFWFLSA-N 1 1 327.424 3.964 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000807486952 1135548225 /nfs/dbraw/zinc/54/82/25/1135548225.db2.gz YWSYJIACIBZCIB-SFHVURJKSA-N 1 1 332.488 3.785 20 10 EHCDMO C[N@@H+]1CCCC[C@H]1CCC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000807841215 1135576425 /nfs/dbraw/zinc/57/64/25/1135576425.db2.gz VFXAXCUAPWRLHW-ZDUSSCGKSA-N 1 1 345.270 3.580 20 10 EHCDMO C[N@H+]1CCCC[C@H]1CCC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000807841215 1135576429 /nfs/dbraw/zinc/57/64/29/1135576429.db2.gz VFXAXCUAPWRLHW-ZDUSSCGKSA-N 1 1 345.270 3.580 20 10 EHCDMO CC[C@@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1cccc(C)c1O ZINC000775731717 1135591009 /nfs/dbraw/zinc/59/10/09/1135591009.db2.gz KJMBHUINXHWRIB-SFHVURJKSA-N 1 1 327.424 3.827 20 10 EHCDMO CC[C@@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1cccc(C)c1O ZINC000775731717 1135591011 /nfs/dbraw/zinc/59/10/11/1135591011.db2.gz KJMBHUINXHWRIB-SFHVURJKSA-N 1 1 327.424 3.827 20 10 EHCDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000808218875 1135630896 /nfs/dbraw/zinc/63/08/96/1135630896.db2.gz QVSGGQMGBIMCNG-QGZVFWFLSA-N 1 1 346.515 3.736 20 10 EHCDMO Cc1ccc(-c2noc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)n2)cc1 ZINC000775833769 1135799054 /nfs/dbraw/zinc/79/90/54/1135799054.db2.gz LPGYDGNQJKHWNQ-OAHLLOKOSA-N 1 1 336.439 3.962 20 10 EHCDMO COc1ccc(N(C)Cc2ncc(C[NH+](C)C)s2)cc1Cl ZINC000809637019 1135864242 /nfs/dbraw/zinc/86/42/42/1135864242.db2.gz MNXJEKIFKVXYQE-UHFFFAOYSA-N 1 1 325.865 3.503 20 10 EHCDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc(Br)ccc1O ZINC000809701547 1135869799 /nfs/dbraw/zinc/86/97/99/1135869799.db2.gz GQXBJRNIRRIQAW-DOMZBBRYSA-N 1 1 342.277 3.670 20 10 EHCDMO CCC[N@@H+](CCc1ccccn1)Cc1cc(Cl)cc(OC)c1O ZINC000809735150 1135873729 /nfs/dbraw/zinc/87/37/29/1135873729.db2.gz ZHXQXQDYGYFLLW-UHFFFAOYSA-N 1 1 334.847 3.904 20 10 EHCDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000809711027 1135875668 /nfs/dbraw/zinc/87/56/68/1135875668.db2.gz HNLTWNBIQGSDRI-INIZCTEOSA-N 1 1 331.387 3.583 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2CCNC(=O)OC(C)(C)C)c1 ZINC000809723538 1135878914 /nfs/dbraw/zinc/87/89/14/1135878914.db2.gz JWRBIQACEYAQOV-QGZVFWFLSA-N 1 1 348.487 3.970 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000810209795 1135943668 /nfs/dbraw/zinc/94/36/68/1135943668.db2.gz VVCBOEXVWSOIFM-WBMJQRKESA-N 1 1 342.405 3.936 20 10 EHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810209795 1135943672 /nfs/dbraw/zinc/94/36/72/1135943672.db2.gz VVCBOEXVWSOIFM-WBMJQRKESA-N 1 1 342.405 3.936 20 10 EHCDMO Cc1cc(C[N@@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)ccc1N(C)C ZINC001170615045 1136003174 /nfs/dbraw/zinc/00/31/74/1136003174.db2.gz UWFPQDOEGZVMHZ-QGZVFWFLSA-N 1 1 344.421 3.993 20 10 EHCDMO Cc1cc(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)ccc1N(C)C ZINC001170615045 1136003177 /nfs/dbraw/zinc/00/31/77/1136003177.db2.gz UWFPQDOEGZVMHZ-QGZVFWFLSA-N 1 1 344.421 3.993 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)O[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000810841261 1136012882 /nfs/dbraw/zinc/01/28/82/1136012882.db2.gz NKHNDBLTKDPHLJ-CVEARBPZSA-N 1 1 344.480 3.939 20 10 EHCDMO CC(C)Nc1ccc(Nc2cccc(C[NH+]3CCN(C)CC3)c2)cc1 ZINC001201498105 1136029146 /nfs/dbraw/zinc/02/91/46/1136029146.db2.gz RVMLLKWBORKRNE-UHFFFAOYSA-N 1 1 338.499 3.998 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c(O)cc1C ZINC000811781693 1136134608 /nfs/dbraw/zinc/13/46/08/1136134608.db2.gz FWQYJZQTYZZYRR-NRFANRHFSA-N 1 1 339.435 3.679 20 10 EHCDMO CN(c1ccc(C[NH2+]Cc2cc3n(n2)CCC3)cc1)C1CCCCC1 ZINC000850095055 1136209879 /nfs/dbraw/zinc/20/98/79/1136209879.db2.gz BVRIFKLKYCIQOQ-UHFFFAOYSA-N 1 1 338.499 3.888 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cnc(C(F)(F)F)nc1)c1ccc(F)cc1O ZINC000850485388 1136267997 /nfs/dbraw/zinc/26/79/97/1136267997.db2.gz HEECLPJBLLDABH-GFCCVEGCSA-N 1 1 329.297 3.581 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccc(N2CCCCC2)c(F)c1 ZINC000850498821 1136272196 /nfs/dbraw/zinc/27/21/96/1136272196.db2.gz DLMKWXPFJNOMJH-KEYYUXOJSA-N 1 1 343.450 3.764 20 10 EHCDMO CC[C@H]([NH2+]CC1(CC(=O)NC)CCCCC1)c1ccc(F)cc1O ZINC000850554482 1136284044 /nfs/dbraw/zinc/28/40/44/1136284044.db2.gz DUHAQZQQGZOSAD-INIZCTEOSA-N 1 1 336.451 3.659 20 10 EHCDMO CCOC(=O)c1cc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)[nH]c1C ZINC000813334394 1136319849 /nfs/dbraw/zinc/31/98/49/1136319849.db2.gz IMRNLVNVMWXOKT-UHFFFAOYSA-N 1 1 343.471 3.588 20 10 EHCDMO COc1ccc(N2CCC(Nc3[nH+]ccc4c(N)cccc43)CC2)cc1 ZINC000853252675 1136522113 /nfs/dbraw/zinc/52/21/13/1136522113.db2.gz QZSRKJKTULIPBO-UHFFFAOYSA-N 1 1 348.450 3.907 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1CO)c1cccc(C(F)(F)F)c1O ZINC000815564197 1136611400 /nfs/dbraw/zinc/61/14/00/1136611400.db2.gz AZHBFICEBQHYDL-LLVKDONJSA-N 1 1 325.330 3.754 20 10 EHCDMO C[C@@H]([NH2+]CCCOC[C@H]1CCOC1)c1cccc(C(F)(F)F)c1O ZINC000815582598 1136614460 /nfs/dbraw/zinc/61/44/60/1136614460.db2.gz KRQMPDRMBIENEV-CHWSQXEVSA-N 1 1 347.377 3.505 20 10 EHCDMO C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1cccc(C(F)(F)F)c1O ZINC000815623550 1136620379 /nfs/dbraw/zinc/62/03/79/1136620379.db2.gz ACDNWIFTUMVHAS-NSHDSACASA-N 1 1 339.361 3.795 20 10 EHCDMO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000815627700 1136621461 /nfs/dbraw/zinc/62/14/61/1136621461.db2.gz HDQDLHFRYJAHCW-MJGOQNOKSA-N 1 1 347.462 3.936 20 10 EHCDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)c1 ZINC000815634292 1136622023 /nfs/dbraw/zinc/62/20/23/1136622023.db2.gz HYZIIQRTMPXCLJ-MNOVXSKESA-N 1 1 336.233 3.665 20 10 EHCDMO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(F)cc1O ZINC000815646051 1136625594 /nfs/dbraw/zinc/62/55/94/1136625594.db2.gz YBYQQUUEVSNTLT-SNVBAGLBSA-N 1 1 328.309 3.838 20 10 EHCDMO C[N@H+](Cc1ccc2c(c1)OCCO2)Cc1cc(Cl)c(F)cc1O ZINC000816481663 1136723345 /nfs/dbraw/zinc/72/33/45/1136723345.db2.gz DVHIIGKUYJFSLB-UHFFFAOYSA-N 1 1 337.778 3.588 20 10 EHCDMO C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1cc(Cl)c(F)cc1O ZINC000816481663 1136723346 /nfs/dbraw/zinc/72/33/46/1136723346.db2.gz DVHIIGKUYJFSLB-UHFFFAOYSA-N 1 1 337.778 3.588 20 10 EHCDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816515965 1136730303 /nfs/dbraw/zinc/73/03/03/1136730303.db2.gz QLQRPHQWCUTQHO-INIZCTEOSA-N 1 1 327.424 3.709 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3cc(Cl)c(F)cc3O)ccc21 ZINC000816543308 1136731979 /nfs/dbraw/zinc/73/19/79/1136731979.db2.gz WCIZFSQVVUAKIC-UHFFFAOYSA-N 1 1 334.822 3.857 20 10 EHCDMO C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)Oc1ccccc1F ZINC000816554161 1136736278 /nfs/dbraw/zinc/73/62/78/1136736278.db2.gz QUOLAJBXAMRCNX-JTQLQIEISA-N 1 1 327.758 3.881 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](c3cccc(Cl)c3)C1)OCO2 ZINC000816631881 1136747366 /nfs/dbraw/zinc/74/73/66/1136747366.db2.gz KBJOXPDOAZBWBJ-ZDUSSCGKSA-N 1 1 331.799 3.764 20 10 EHCDMO CN(c1ccc(CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1)C1CCCCC1 ZINC000817897607 1136844125 /nfs/dbraw/zinc/84/41/25/1136844125.db2.gz SWSMHYHTKQFGSR-DFNIBXOVSA-N 1 1 327.516 3.828 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000817938580 1136847639 /nfs/dbraw/zinc/84/76/39/1136847639.db2.gz NOVOBHQTCORKKN-KPZWWZAWSA-N 1 1 335.854 3.896 20 10 EHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000817938545 1136847774 /nfs/dbraw/zinc/84/77/74/1136847774.db2.gz MSMPIOMKHXLAIG-VQTJNVASSA-N 1 1 327.472 3.502 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000817938581 1136847863 /nfs/dbraw/zinc/84/78/63/1136847863.db2.gz NOVOBHQTCORKKN-KZULUSFZSA-N 1 1 335.854 3.896 20 10 EHCDMO CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817979733 1136855025 /nfs/dbraw/zinc/85/50/25/1136855025.db2.gz DRHDKAOXKGSIGG-ZFWWWQNUSA-N 1 1 330.394 3.984 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H](CO)c2ccc(Cl)cc2)cc1F ZINC000858157197 1136944783 /nfs/dbraw/zinc/94/47/83/1136944783.db2.gz WEAZUDWNCJBFMK-INIZCTEOSA-N 1 1 340.801 3.507 20 10 EHCDMO Cc1ccc(O)c(C[NH2+]Cc2cc(C)cc(Br)c2O)c1 ZINC000858239685 1136951648 /nfs/dbraw/zinc/95/16/48/1136951648.db2.gz SBLBEFZFMXPMFD-UHFFFAOYSA-N 1 1 336.229 3.767 20 10 EHCDMO CCC[C@@H](C[NH2+]Cc1cc(C)cc(Br)c1O)OCC ZINC001203249275 1136952464 /nfs/dbraw/zinc/95/24/64/1136952464.db2.gz OEZBLBNBFZBUHN-ZDUSSCGKSA-N 1 1 330.266 3.758 20 10 EHCDMO COc1ccc(N2CC[C@H](CNc3[nH+]c4ccccc4n3C)C2)cc1 ZINC000819936680 1136968213 /nfs/dbraw/zinc/96/82/13/1136968213.db2.gz UNYVHLMWRMIIFY-OAHLLOKOSA-N 1 1 336.439 3.520 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000822526834 1137062555 /nfs/dbraw/zinc/06/25/55/1137062555.db2.gz ZFDLLKWSUQINNK-RTBURBONSA-N 1 1 330.859 3.714 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c(O)c1 ZINC000822526838 1137062588 /nfs/dbraw/zinc/06/25/88/1137062588.db2.gz ZHLKVUGOVXFMJH-IEBWSBKVSA-N 1 1 347.842 3.752 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c(O)c1 ZINC000822530192 1137062606 /nfs/dbraw/zinc/06/26/06/1137062606.db2.gz TTWCVKWPMUWXAW-IBGZPJMESA-N 1 1 331.456 3.572 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@H]1CCc3cccc(F)c3C1)CCC2 ZINC001171004508 1137084838 /nfs/dbraw/zinc/08/48/38/1137084838.db2.gz GJALHTFALHCYDX-INIZCTEOSA-N 1 1 327.399 3.543 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CCCCCO)cc1 ZINC000824307300 1137131668 /nfs/dbraw/zinc/13/16/68/1137131668.db2.gz FZANZNODBOVMPQ-UHFFFAOYSA-N 1 1 332.513 3.979 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000862247926 1137135072 /nfs/dbraw/zinc/13/50/72/1137135072.db2.gz DHGQAESKFFOAPI-UHFFFAOYSA-N 1 1 336.151 3.849 20 10 EHCDMO Oc1cccc(Br)c1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000862247926 1137135073 /nfs/dbraw/zinc/13/50/73/1137135073.db2.gz DHGQAESKFFOAPI-UHFFFAOYSA-N 1 1 336.151 3.849 20 10 EHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(O)cccc1Br ZINC000862351391 1137139501 /nfs/dbraw/zinc/13/95/01/1137139501.db2.gz OKHWLBDFRVOBGL-SCZZXKLOSA-N 1 1 338.167 3.927 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000862402776 1137142636 /nfs/dbraw/zinc/14/26/36/1137142636.db2.gz RKYGQFJUUYGUCE-CYBMUJFWSA-N 1 1 340.261 3.688 20 10 EHCDMO O=C1C[C@]2(CCC[N@H+](Cc3cc(F)ccc3O)C2)Oc2ccccc21 ZINC000862482227 1137146392 /nfs/dbraw/zinc/14/63/92/1137146392.db2.gz QLPYKMWRYXANRS-FQEVSTJZSA-N 1 1 341.382 3.531 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@]3(CC(=O)c4ccccc4O3)C2)c1O ZINC000862481546 1137146441 /nfs/dbraw/zinc/14/64/41/1137146441.db2.gz IOIVPTUAFTUCTJ-NRFANRHFSA-N 1 1 337.419 3.701 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000862484693 1137146690 /nfs/dbraw/zinc/14/66/90/1137146690.db2.gz ZEPJAULCXHOZHK-UHFFFAOYSA-N 1 1 328.481 3.749 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3ccc(OC)c(F)c3)C2)c1 ZINC000862541479 1137149455 /nfs/dbraw/zinc/14/94/55/1137149455.db2.gz REBABUIFKIYMBG-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCc2ncccc2C)c1 ZINC000824783717 1137154211 /nfs/dbraw/zinc/15/42/11/1137154211.db2.gz UGQXIFOITKCWSG-UHFFFAOYSA-N 1 1 349.272 3.889 20 10 EHCDMO COc1cc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)c(O)c(C(C)(C)C)c1 ZINC000824906797 1137156255 /nfs/dbraw/zinc/15/62/55/1137156255.db2.gz SMHFDKFAFXUMMO-GOSISDBHSA-N 1 1 345.439 3.865 20 10 EHCDMO COc1cc(C[N@H+]2CCO[C@@H](c3ccco3)C2)c(O)c(C(C)(C)C)c1 ZINC000824906797 1137156256 /nfs/dbraw/zinc/15/62/56/1137156256.db2.gz SMHFDKFAFXUMMO-GOSISDBHSA-N 1 1 345.439 3.865 20 10 EHCDMO CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(Br)c1O ZINC000825299930 1137172050 /nfs/dbraw/zinc/17/20/50/1137172050.db2.gz SJUICKVBNNGUKL-ZIAGYGMSSA-N 1 1 328.250 3.592 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N3CCC(OC)CC3)cc2)[C@H](CC)CO1 ZINC000844384169 1137215950 /nfs/dbraw/zinc/21/59/50/1137215950.db2.gz CCYLIQUWUCGFLN-UYAOXDASSA-N 1 1 346.515 3.691 20 10 EHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccc(-n3cccc3)cc1)CCC2 ZINC001144252717 1137261946 /nfs/dbraw/zinc/26/19/46/1137261946.db2.gz VTALGAXYYJPURX-UHFFFAOYSA-N 1 1 334.419 3.837 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3ncccc3c2)c1 ZINC000794828183 1137267746 /nfs/dbraw/zinc/26/77/46/1137267746.db2.gz LNGXECWOOYIQST-CYBMUJFWSA-N 1 1 336.391 3.578 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1F)c1ccc(N2CCOCC2)cc1Cl ZINC000794836506 1137276512 /nfs/dbraw/zinc/27/65/12/1137276512.db2.gz QDRRAJDTZLVMGQ-CYBMUJFWSA-N 1 1 349.837 3.562 20 10 EHCDMO Cc1cc2cc[nH+]c(NCc3cc(Br)ccc3O)c2[nH]1 ZINC001171174102 1137283136 /nfs/dbraw/zinc/28/31/36/1137283136.db2.gz IAIAYDBSIODFDI-UHFFFAOYSA-N 1 1 332.201 3.952 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](OCC(C)C)C3)c2c1 ZINC000120828094 1137321680 /nfs/dbraw/zinc/32/16/80/1137321680.db2.gz QZYUDOHZDOYRAZ-QGZVFWFLSA-N 1 1 329.440 3.801 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c1O ZINC000846139370 1137338502 /nfs/dbraw/zinc/33/85/02/1137338502.db2.gz SICJOQSISRLYIP-KDOFPFPSSA-N 1 1 337.423 3.575 20 10 EHCDMO C[C@H](COCC1CC1)[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000846206038 1137339329 /nfs/dbraw/zinc/33/93/29/1137339329.db2.gz UHWRTRLJJHHJHA-NXEZZACHSA-N 1 1 346.240 3.760 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H](O)C(F)(F)F ZINC000866464525 1137357010 /nfs/dbraw/zinc/35/70/10/1137357010.db2.gz WGYXPUWXLRFTBJ-WGDKSQQYSA-N 1 1 332.149 3.661 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H](O)C(F)(F)F ZINC000866464524 1137357029 /nfs/dbraw/zinc/35/70/29/1137357029.db2.gz WGYXPUWXLRFTBJ-CPZGKSPBSA-N 1 1 332.149 3.661 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c1 ZINC000866610562 1137368925 /nfs/dbraw/zinc/36/89/25/1137368925.db2.gz VDWWDSGUHRJLQH-LERXQTSPSA-N 1 1 343.345 3.727 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1[O-] ZINC000873241850 1137595033 /nfs/dbraw/zinc/59/50/33/1137595033.db2.gz GPGAXSZBZYNENR-WCQYABFASA-N 1 1 341.293 3.584 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cc(Br)ccc1O ZINC000125700455 1137641668 /nfs/dbraw/zinc/64/16/68/1137641668.db2.gz CNLVPSGXQVHKOW-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccc(C(F)F)nc1)C[C@@H]1CCCO1 ZINC000876531785 1137654627 /nfs/dbraw/zinc/65/46/27/1137654627.db2.gz OXXINXITBCXDIY-INIZCTEOSA-N 1 1 348.393 3.906 20 10 EHCDMO Cc1ccc(C[N@@H+](Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c(O)c1 ZINC000876593086 1137656493 /nfs/dbraw/zinc/65/64/93/1137656493.db2.gz XBSLYXGQDFZMGT-UHFFFAOYSA-N 1 1 337.423 3.760 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c(O)c1 ZINC000876593086 1137656494 /nfs/dbraw/zinc/65/64/94/1137656494.db2.gz XBSLYXGQDFZMGT-UHFFFAOYSA-N 1 1 337.423 3.760 20 10 EHCDMO Cc1ccc(CNc2cccc([C@@H](C)[NH+]3CCOCC3)c2)c(O)c1 ZINC000876859634 1137663939 /nfs/dbraw/zinc/66/39/39/1137663939.db2.gz WUEPOTASUOYPCR-MRXNPFEDSA-N 1 1 326.440 3.706 20 10 EHCDMO C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc(F)c(F)c2[O-])CC1 ZINC000877037776 1137668466 /nfs/dbraw/zinc/66/84/66/1137668466.db2.gz CAODWHNZRZZILI-CQSZACIVSA-N 1 1 346.421 3.986 20 10 EHCDMO CC(C)c1csc(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)n1 ZINC000877108267 1137670300 /nfs/dbraw/zinc/67/03/00/1137670300.db2.gz PMUYLOPGJVVUDK-UHFFFAOYSA-N 1 1 345.512 3.517 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CCC(F)(F)CC1 ZINC000877532082 1137680071 /nfs/dbraw/zinc/68/00/71/1137680071.db2.gz DUFACIPTBKMQTJ-UHFFFAOYSA-N 1 1 338.442 3.657 20 10 EHCDMO COc1cc(C[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)on1 ZINC000877635630 1137683711 /nfs/dbraw/zinc/68/37/11/1137683711.db2.gz ZTJBGZSJFKVDGG-UHFFFAOYSA-N 1 1 343.452 3.671 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](OCc3ccccn3)C2)c1O ZINC000877645794 1137684273 /nfs/dbraw/zinc/68/42/73/1137684273.db2.gz WSJUOYAOKDTHHA-KRWDZBQOSA-N 1 1 332.831 3.540 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1 ZINC000877672415 1137685147 /nfs/dbraw/zinc/68/51/47/1137685147.db2.gz DUSMBFFXLRJNDC-UCJUAVMMSA-N 1 1 336.479 3.964 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCC3(CCOCC3)O2)cc1 ZINC000877922956 1137695901 /nfs/dbraw/zinc/69/59/01/1137695901.db2.gz YDHXULINBRMUSF-FQEVSTJZSA-N 1 1 346.515 3.693 20 10 EHCDMO C[N@@H+](CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1)Cc1ccccc1O ZINC000878242395 1137708350 /nfs/dbraw/zinc/70/83/50/1137708350.db2.gz QLDYJONMDIIZRW-XBXGTLAGSA-N 1 1 329.362 3.762 20 10 EHCDMO Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883289202 1137852806 /nfs/dbraw/zinc/85/28/06/1137852806.db2.gz HMSCGIVHAARCDJ-MRXNPFEDSA-N 1 1 329.513 3.659 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2cc(O)ccc2Cl)ccc1OC ZINC000883325209 1137854809 /nfs/dbraw/zinc/85/48/09/1137854809.db2.gz SKCHLNUSNRWALF-UHFFFAOYSA-N 1 1 335.831 3.881 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H]([C@@H]4CCCO4)C3)c2c1 ZINC000884483266 1137960980 /nfs/dbraw/zinc/96/09/80/1137960980.db2.gz QMETYIMRDDAYTA-QRWLVFNGSA-N 1 1 327.424 3.555 20 10 EHCDMO CC1CC[NH+](CCCNCc2ccc(N3CCCCC3)cc2)CC1 ZINC000215869018 1137964324 /nfs/dbraw/zinc/96/43/24/1137964324.db2.gz XBUDNCNQNNRDPO-UHFFFAOYSA-N 1 1 329.532 3.889 20 10 EHCDMO CCCCNC(=O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000216480982 1137980827 /nfs/dbraw/zinc/98/08/27/1137980827.db2.gz WQKMWLBFEABGRS-QGZVFWFLSA-N 1 1 340.467 3.872 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1c(O)cccc1F ZINC000886506184 1138085490 /nfs/dbraw/zinc/08/54/90/1138085490.db2.gz FTZNQZBGICDBBC-CQSZACIVSA-N 1 1 346.471 3.935 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(O[C@H]2CCOC2)c1 ZINC000886538152 1138092936 /nfs/dbraw/zinc/09/29/36/1138092936.db2.gz CHCGOHRGBXAWQV-ZBFHGGJFSA-N 1 1 345.414 3.858 20 10 EHCDMO CC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2c(O)cccc2F)c2ccccc21 ZINC000886556743 1138095963 /nfs/dbraw/zinc/09/59/63/1138095963.db2.gz JJRHZYCRJWZMTF-BLLLJJGKSA-N 1 1 328.387 3.680 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1c(O)cccc1F ZINC000886558661 1138096983 /nfs/dbraw/zinc/09/69/83/1138096983.db2.gz PDZOLEWLGGGZFY-BJOHPYRUSA-N 1 1 327.758 3.708 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774200 1138138187 /nfs/dbraw/zinc/13/81/87/1138138187.db2.gz JTAXCANGDMVUBG-AUUYWEPGSA-N 1 1 347.455 3.569 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1O ZINC000093594370 1138238545 /nfs/dbraw/zinc/23/85/45/1138238545.db2.gz WKLFKNKACUHYQW-HNNXBMFYSA-N 1 1 343.398 3.635 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@H]2CC(=O)c2ccccc2)c1O ZINC000093667982 1138239732 /nfs/dbraw/zinc/23/97/32/1138239732.db2.gz UQZFEZXDMJDMJY-KRWDZBQOSA-N 1 1 325.408 3.638 20 10 EHCDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093888735 1138242551 /nfs/dbraw/zinc/24/25/51/1138242551.db2.gz LDCSIGRMXJRHKM-IQMFZBJNSA-N 1 1 330.497 3.683 20 10 EHCDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 ZINC000174506046 1139425400 /nfs/dbraw/zinc/42/54/00/1139425400.db2.gz PSMBVZUMDSFLOJ-GOSISDBHSA-N 1 1 339.483 3.508 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)cc1 ZINC000179766525 1139780908 /nfs/dbraw/zinc/78/09/08/1139780908.db2.gz MIQNYVGGHYBUCO-XMMPIXPASA-N 1 1 344.524 3.902 20 10 EHCDMO C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184913251 1140125945 /nfs/dbraw/zinc/12/59/45/1140125945.db2.gz VNOYMAVKXKHVOP-JTQLQIEISA-N 1 1 329.271 3.976 20 10 EHCDMO COc1ccccc1N1CC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000185269256 1140142457 /nfs/dbraw/zinc/14/24/57/1140142457.db2.gz PWOPPGBRNZQFRZ-GJZGRUSLSA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000185356179 1140146548 /nfs/dbraw/zinc/14/65/48/1140146548.db2.gz SDKOESBPAPHRCF-LBPRGKRZSA-N 1 1 341.293 3.537 20 10 EHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(O[C@@H]2CCOC2)c1 ZINC000185725617 1140166310 /nfs/dbraw/zinc/16/63/10/1140166310.db2.gz OYTKGGVBWLBXOE-RHSMWYFYSA-N 1 1 345.414 3.858 20 10 EHCDMO Cn1cc([C@@H]2CSCC[N@H+]2Cc2c(O)ccc3ccccc32)cn1 ZINC000189875731 1140369372 /nfs/dbraw/zinc/36/93/72/1140369372.db2.gz CDZHJUPUMGAFBR-SFHVURJKSA-N 1 1 339.464 3.569 20 10 EHCDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777467573 1140415512 /nfs/dbraw/zinc/41/55/12/1140415512.db2.gz NOXSJQCZNAXCMC-LJQANCHMSA-N 1 1 338.495 3.895 20 10 EHCDMO COc1ccc(-c2noc([C@@H](C)[N@H+](C)Cc3ccccc3O)n2)cc1 ZINC000153880993 1014280671 /nfs/dbraw/zinc/28/06/71/1014280671.db2.gz BPUWBVRXGCIXPE-CYBMUJFWSA-N 1 1 339.395 3.644 20 10 EHCDMO COc1ccc(-c2noc([C@@H](C)[N@@H+](C)Cc3ccccc3O)n2)cc1 ZINC000153880993 1014280684 /nfs/dbraw/zinc/28/06/84/1014280684.db2.gz BPUWBVRXGCIXPE-CYBMUJFWSA-N 1 1 339.395 3.644 20 10 EHCDMO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000160194648 1014311179 /nfs/dbraw/zinc/31/11/79/1014311179.db2.gz OWGKQFRXLDHISX-KRWDZBQOSA-N 1 1 343.471 3.594 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(CN2CCC[N@H+](C(C)(C)C)CC2)c1 ZINC000748082390 1015312750 /nfs/dbraw/zinc/31/27/50/1015312750.db2.gz KSIOTGPPYVNJLQ-UHFFFAOYSA-N 1 1 334.504 3.702 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@H](C3OCCO3)C2)c(O)c(C(C)(C)C)c1 ZINC000172491496 1032740278 /nfs/dbraw/zinc/74/02/78/1032740278.db2.gz USKBCKJYTCLHLI-HNNXBMFYSA-N 1 1 333.472 3.583 20 10 EHCDMO CC[C@H]([NH2+]C1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C)cc1O ZINC000280265785 1020234068 /nfs/dbraw/zinc/23/40/68/1020234068.db2.gz XNXRHJHSBMZYFS-XUVXKRRUSA-N 1 1 346.515 3.509 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c(C(F)(F)F)c1 ZINC000280268430 1020236245 /nfs/dbraw/zinc/23/62/45/1020236245.db2.gz LTFFTILMESMDGI-OAHLLOKOSA-N 1 1 338.377 3.662 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c(O)c1OC ZINC000891399826 1020916584 /nfs/dbraw/zinc/91/65/84/1020916584.db2.gz MLKJTWKCNCPHJW-UHFFFAOYSA-N 1 1 331.387 3.713 20 10 EHCDMO COc1ccc(C[N@H+]2CCCCC[C@H]2c2ccncc2)c(O)c1OC ZINC000891441016 1021220508 /nfs/dbraw/zinc/22/05/08/1021220508.db2.gz QUHBEFVGSJVEFF-KRWDZBQOSA-N 1 1 342.439 3.922 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2ccc(C)c(C)n2)c1 ZINC000839163648 1021573154 /nfs/dbraw/zinc/57/31/54/1021573154.db2.gz JFNSBNUYMPKENL-UHFFFAOYSA-N 1 1 335.245 3.765 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2[O-])C[C@@H]1C ZINC000894902764 1022058702 /nfs/dbraw/zinc/05/87/02/1022058702.db2.gz LAGDUQLKZCKWPI-ZANVPECISA-N 1 1 348.668 3.665 20 10 EHCDMO 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COc1cc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c(O)cc1C ZINC000768909803 1133201864 /nfs/dbraw/zinc/20/18/64/1133201864.db2.gz KRYGOHDEVRZYTJ-CYBMUJFWSA-N 1 1 333.378 3.977 20 10 EHCDMO CCC[N@@H+](Cc1ccc(C(=O)NC2CC2)cc1)Cc1ccccc1O ZINC000769201626 1133242873 /nfs/dbraw/zinc/24/28/73/1133242873.db2.gz YGZGNXRPMUUAMB-UHFFFAOYSA-N 1 1 338.451 3.697 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)c1 ZINC000769232156 1133248187 /nfs/dbraw/zinc/24/81/87/1133248187.db2.gz HZJZLUXLTXZYQF-INIZCTEOSA-N 1 1 334.460 3.532 20 10 EHCDMO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310155 1133258989 /nfs/dbraw/zinc/25/89/89/1133258989.db2.gz WZYPOFQBMAELLP-YWZLYKJASA-N 1 1 328.431 3.854 20 10 EHCDMO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310155 1133258991 /nfs/dbraw/zinc/25/89/91/1133258991.db2.gz WZYPOFQBMAELLP-YWZLYKJASA-N 1 1 328.431 3.854 20 10 EHCDMO C[C@H]1CSCC[N@@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769427184 1133282239 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EHCDMO CCN(C)c1ccc(CN[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000773840937 1133342119 /nfs/dbraw/zinc/34/21/19/1133342119.db2.gz VDLJKPITZRAPIZ-IEBWSBKVSA-N 1 1 329.532 3.885 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@@H](COC(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000769816585 1133350875 /nfs/dbraw/zinc/35/08/75/1133350875.db2.gz VDRKUUCILPHCRY-QGZVFWFLSA-N 1 1 335.488 3.624 20 10 EHCDMO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1cc(F)c(F)cc1O)N(C)C ZINC001180942626 1133433419 /nfs/dbraw/zinc/43/34/19/1133433419.db2.gz KFTIRQLSJKKIFV-DJJJIMSYSA-N 1 1 334.410 3.760 20 10 EHCDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000771631203 1133583006 /nfs/dbraw/zinc/58/30/06/1133583006.db2.gz NNOZGJQLMHVANX-GOSISDBHSA-N 1 1 345.483 3.682 20 10 EHCDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001182203218 1133592495 /nfs/dbraw/zinc/59/24/95/1133592495.db2.gz IFSYMAUFTJIMHV-KRWDZBQOSA-N 1 1 343.826 3.738 20 10 EHCDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001182203218 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NLIOGHJZPMSUIK-INIZCTEOSA-N 1 1 344.411 3.762 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000774958316 1134155993 /nfs/dbraw/zinc/15/59/93/1134155993.db2.gz WYZOMQXQAFUDIV-VNHYZAJKSA-N 1 1 334.416 3.758 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000774958312 1134156110 /nfs/dbraw/zinc/15/61/10/1134156110.db2.gz WYZOMQXQAFUDIV-KCQAQPDRSA-N 1 1 334.416 3.758 20 10 EHCDMO C[C@@H]([NH2+]CCOc1ncccc1F)c1cccc(C(F)(F)F)c1O ZINC000788668460 1134158978 /nfs/dbraw/zinc/15/89/78/1134158978.db2.gz BAIJIBGFSFAAMI-SNVBAGLBSA-N 1 1 344.308 3.675 20 10 EHCDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)cc1 ZINC000774967204 1134160126 /nfs/dbraw/zinc/16/01/26/1134160126.db2.gz NRIDKCGDPLIRFB-LBPRGKRZSA-N 1 1 346.383 3.559 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)Cc2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000775026225 1134228165 /nfs/dbraw/zinc/22/81/65/1134228165.db2.gz ZRKQKIXDQORXSL-CQSZACIVSA-N 1 1 344.411 3.647 20 10 EHCDMO 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EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000793609640 1134971083 /nfs/dbraw/zinc/97/10/83/1134971083.db2.gz QLHZEYRFZWHZKU-LSDHHAIUSA-N 1 1 340.261 3.607 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000793609640 1134971091 /nfs/dbraw/zinc/97/10/91/1134971091.db2.gz QLHZEYRFZWHZKU-LSDHHAIUSA-N 1 1 340.261 3.607 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCOC[C@@H](C4CCC4)C3)c2c1 ZINC000793747242 1134988860 /nfs/dbraw/zinc/98/88/60/1134988860.db2.gz OFLRELTXKVCMQV-KRWDZBQOSA-N 1 1 341.451 3.803 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000775645415 1135392106 /nfs/dbraw/zinc/39/21/06/1135392106.db2.gz KUUXUKJSQLIJAZ-JOCHJYFZSA-N 1 1 335.495 3.776 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000775645415 1135392113 /nfs/dbraw/zinc/39/21/13/1135392113.db2.gz KUUXUKJSQLIJAZ-JOCHJYFZSA-N 1 1 335.495 3.776 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)c1 ZINC000775720949 1135570961 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Oc1ccccc1C[N@H+]1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000809751661 1135885968 /nfs/dbraw/zinc/88/59/68/1135885968.db2.gz HIUOQCSDQPYYCB-QGZVFWFLSA-N 1 1 340.471 3.938 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@]2(C)CCCO)c1 ZINC000809757727 1135886968 /nfs/dbraw/zinc/88/69/68/1135886968.db2.gz SKWJXCXXQHLKQB-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@]2(C)CCCO)c1 ZINC000809757727 1135886970 /nfs/dbraw/zinc/88/69/70/1135886970.db2.gz SKWJXCXXQHLKQB-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000809790809 1135893053 /nfs/dbraw/zinc/89/30/53/1135893053.db2.gz PQSFNASNTHZGPG-KRWDZBQOSA-N 1 1 344.421 3.756 20 10 EHCDMO CN(C)c1cc[nH+]cc1C(=O)N(Cc1ccccc1)c1ccc(N)cc1 ZINC001199349134 1135896761 /nfs/dbraw/zinc/89/67/61/1135896761.db2.gz BPWKUSWMTQDBMB-UHFFFAOYSA-N 1 1 346.434 3.577 20 10 EHCDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC/C=C/c1ccc(N(C)C)cc1 ZINC001199677958 1135919152 /nfs/dbraw/zinc/91/91/52/1135919152.db2.gz IEAPQEMXVBCCPS-ZRAQOITDSA-N 1 1 329.532 3.722 20 10 EHCDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001199677958 1135919153 /nfs/dbraw/zinc/91/91/53/1135919153.db2.gz IEAPQEMXVBCCPS-ZRAQOITDSA-N 1 1 329.532 3.722 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCCOC(C)C)c1 ZINC001201625916 1136048982 /nfs/dbraw/zinc/04/89/82/1136048982.db2.gz GKLKAYHCPJSZNJ-UHFFFAOYSA-N 1 1 330.266 3.758 20 10 EHCDMO CCOc1ccc(O)c(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000811508449 1136101703 /nfs/dbraw/zinc/10/17/03/1136101703.db2.gz QNAYZULBFLZCRF-SFHVURJKSA-N 1 1 338.451 3.776 20 10 EHCDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000107323652 1136165780 /nfs/dbraw/zinc/16/57/80/1136165780.db2.gz URBGALBFTSRZPB-MRXNPFEDSA-N 1 1 328.431 3.855 20 10 EHCDMO CCN1CCC[C@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850098983 1136211023 /nfs/dbraw/zinc/21/10/23/1136211023.db2.gz PXEPIULDIYGVIT-OAHLLOKOSA-N 1 1 334.504 3.520 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CC(=O)N(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812739955 1136240687 /nfs/dbraw/zinc/24/06/87/1136240687.db2.gz JAVKPFPZWGOZRU-XJKSGUPXSA-N 1 1 346.377 3.517 20 10 EHCDMO COc1ccnc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c1F ZINC000850380298 1136245815 /nfs/dbraw/zinc/24/58/15/1136245815.db2.gz DPOAJNKCLUYTCJ-UHFFFAOYSA-N 1 1 329.419 3.509 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)cc1 ZINC000812780282 1136246375 /nfs/dbraw/zinc/24/63/75/1136246375.db2.gz YTIGEBFDRRSCQR-JOCHJYFZSA-N 1 1 338.495 3.570 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)CC1(COC)CCC1 ZINC000812827058 1136251104 /nfs/dbraw/zinc/25/11/04/1136251104.db2.gz CKVUPSXTKBDHDQ-UHFFFAOYSA-N 1 1 342.277 3.793 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1cccc(C(F)(F)F)c1O ZINC000850494401 1136270951 /nfs/dbraw/zinc/27/09/51/1136270951.db2.gz OQEVCUCCNQPHMU-NWDGAFQWSA-N 1 1 330.394 3.934 20 10 EHCDMO CC[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1)c1ccc(F)cc1O ZINC000850540198 1136281933 /nfs/dbraw/zinc/28/19/33/1136281933.db2.gz JFERPJLRHZGBCG-JLSDUUJJSA-N 1 1 331.435 3.717 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](O)c1cc(F)c(F)c(F)c1)c1ccc(F)cc1O ZINC000850580536 1136292205 /nfs/dbraw/zinc/29/22/05/1136292205.db2.gz OFZYKMIASQCJMX-ZBFHGGJFSA-N 1 1 343.320 3.723 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)c1cccc(F)c1 ZINC000109761230 1136339209 /nfs/dbraw/zinc/33/92/09/1136339209.db2.gz SOIRDXXCFWTNGM-FQEVSTJZSA-N 1 1 341.382 3.860 20 10 EHCDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccccc1O ZINC000109772033 1136339634 /nfs/dbraw/zinc/33/96/34/1136339634.db2.gz FIHUZOFNKVCQNW-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nnc2n1CCCCC2 ZINC000852627109 1136471568 /nfs/dbraw/zinc/47/15/68/1136471568.db2.gz DESPRKBQYMXPMZ-KRWDZBQOSA-N 1 1 341.503 3.620 20 10 EHCDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC000852650537 1136473875 /nfs/dbraw/zinc/47/38/75/1136473875.db2.gz LTDDZXKVFSXTMO-PKOBYXMFSA-N 1 1 344.499 3.616 20 10 EHCDMO Cc1ccc(O)c([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1 ZINC000854224234 1136599799 /nfs/dbraw/zinc/59/97/99/1136599799.db2.gz MDZFCQNNVDKVHH-POZUXBRTSA-N 1 1 328.431 3.636 20 10 EHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2[O-])C1 ZINC000815564052 1136611273 /nfs/dbraw/zinc/61/12/73/1136611273.db2.gz WAPNTVVEDZXRKW-OLZOCXBDSA-N 1 1 330.394 3.794 20 10 EHCDMO CN1CCC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578241 1136613616 /nfs/dbraw/zinc/61/36/16/1136613616.db2.gz KGBMLPNSHCLWFO-FPOVZHCZSA-N 1 1 338.495 3.998 20 10 EHCDMO C[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815581236 1136614127 /nfs/dbraw/zinc/61/41/27/1136614127.db2.gz ZMVALAKJKVCSGB-SJCJKPOMSA-N 1 1 339.357 3.969 20 10 EHCDMO C[C@@H]([NH2+]CCNC(=O)OC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815572645 1136617997 /nfs/dbraw/zinc/61/79/97/1136617997.db2.gz JSHWQAQPPRTSNA-SNVBAGLBSA-N 1 1 348.365 3.586 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@](O)(c3ccc(F)cc3)C1)CCCC2 ZINC000776766047 1136655139 /nfs/dbraw/zinc/65/51/39/1136655139.db2.gz PFCDPSLUIXEHMB-NRFANRHFSA-N 1 1 341.426 3.504 20 10 EHCDMO COc1ccccc1C[N@@H+](CCO)Cc1ccc2ccccc2c1O ZINC000816491685 1136724485 /nfs/dbraw/zinc/72/44/85/1136724485.db2.gz VLMJFUHCZHMASP-UHFFFAOYSA-N 1 1 337.419 3.549 20 10 EHCDMO O=C1CCCCN1[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816505233 1136728173 /nfs/dbraw/zinc/72/81/73/1136728173.db2.gz QQQYVCGMIVHNIN-SFHVURJKSA-N 1 1 338.451 3.522 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000816534169 1136730478 /nfs/dbraw/zinc/73/04/78/1136730478.db2.gz YSFMMKOXHVDLIW-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccccc1-n1ccnc1 ZINC000816539172 1136731369 /nfs/dbraw/zinc/73/13/69/1136731369.db2.gz UTGIUDUHZBJJIL-UHFFFAOYSA-N 1 1 331.778 3.660 20 10 EHCDMO Cn1cc([C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C(C)(C)C)cn1 ZINC000816555784 1136736135 /nfs/dbraw/zinc/73/61/35/1136736135.db2.gz PRHOBYUJQVKLKB-OAHLLOKOSA-N 1 1 325.815 3.795 20 10 EHCDMO COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817938479 1136847200 /nfs/dbraw/zinc/84/72/00/1136847200.db2.gz LDVGIIVWNIGIFU-SCLBCKFNSA-N 1 1 347.890 3.765 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000817938494 1136847896 /nfs/dbraw/zinc/84/78/96/1136847896.db2.gz LPQLIJMHOVVWJZ-OALUTQOASA-N 1 1 333.426 3.772 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000817943528 1136849239 /nfs/dbraw/zinc/84/92/39/1136849239.db2.gz UXCYUKXFKOEYMA-SUMWQHHRSA-N 1 1 340.496 3.713 20 10 EHCDMO CC[C@@H]([NH2+]CC[C@@H](O)COCc1ccccc1)c1ccc(F)cc1O ZINC000858594317 1136981185 /nfs/dbraw/zinc/98/11/85/1136981185.db2.gz BZJYMWFLRIMKRR-IEBWSBKVSA-N 1 1 347.430 3.540 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859613146 1137022855 /nfs/dbraw/zinc/02/28/55/1137022855.db2.gz YPGUPTOWOUTEFT-YJBOKZPZSA-N 1 1 332.488 3.552 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H](O)c1ccc(F)cc1 ZINC000822179755 1137051787 /nfs/dbraw/zinc/05/17/87/1137051787.db2.gz CNOOQCSYEKIZBB-NRFANRHFSA-N 1 1 342.458 3.981 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c(O)c1 ZINC000822530193 1137062432 /nfs/dbraw/zinc/06/24/32/1137062432.db2.gz TTWCVKWPMUWXAW-LJQANCHMSA-N 1 1 331.456 3.572 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@@H]1O ZINC000823490173 1137102290 /nfs/dbraw/zinc/10/22/90/1137102290.db2.gz WCLDKWCGIKNULH-LPHOPBHVSA-N 1 1 330.497 3.587 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c1O ZINC000823660272 1137108429 /nfs/dbraw/zinc/10/84/29/1137108429.db2.gz IVNOMGZWZBRENW-LJQANCHMSA-N 1 1 347.430 3.515 20 10 EHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)ccc1N(C)C ZINC000823661428 1137108621 /nfs/dbraw/zinc/10/86/21/1137108621.db2.gz YFCAEURRBJJCHK-HXUWFJFHSA-N 1 1 328.500 3.842 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000862023894 1137127395 /nfs/dbraw/zinc/12/73/95/1137127395.db2.gz KDJMAHOQZXSORT-SJORKVTESA-N 1 1 333.520 3.658 20 10 EHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862242810 1137134494 /nfs/dbraw/zinc/13/44/94/1137134494.db2.gz RKSVFWLDCHOGBS-HNNXBMFYSA-N 1 1 326.431 3.812 20 10 EHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC000862369030 1137141019 /nfs/dbraw/zinc/14/10/19/1137141019.db2.gz RXNQKFAWCYTCHK-MRXNPFEDSA-N 1 1 334.414 3.708 20 10 EHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC000862369030 1137141021 /nfs/dbraw/zinc/14/10/21/1137141021.db2.gz RXNQKFAWCYTCHK-MRXNPFEDSA-N 1 1 334.414 3.708 20 10 EHCDMO COCc1csc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000824506990 1137142345 /nfs/dbraw/zinc/14/23/45/1137142345.db2.gz CPIMUBOBIGYVDL-QGZVFWFLSA-N 1 1 347.480 3.781 20 10 EHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(Br)cc2O)on1 ZINC000824597234 1137144640 /nfs/dbraw/zinc/14/46/40/1137144640.db2.gz OICLNOAGLRNQQL-ZDUSSCGKSA-N 1 1 337.217 3.788 20 10 EHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(Br)cc2O)on1 ZINC000824597234 1137144641 /nfs/dbraw/zinc/14/46/41/1137144641.db2.gz OICLNOAGLRNQQL-ZDUSSCGKSA-N 1 1 337.217 3.788 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1O ZINC000824636868 1137145718 /nfs/dbraw/zinc/14/57/18/1137145718.db2.gz UPDFFXOXVKBYMV-HKUYNNGSSA-N 1 1 349.833 3.654 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000862484934 1137146682 /nfs/dbraw/zinc/14/66/82/1137146682.db2.gz CVWQXBKEOPAKDX-RHSMWYFYSA-N 1 1 349.471 3.591 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824696829 1137147095 /nfs/dbraw/zinc/14/70/95/1137147095.db2.gz UULXIVHCPJGUPR-KCPJHIHWSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824696829 1137147097 /nfs/dbraw/zinc/14/70/97/1137147097.db2.gz UULXIVHCPJGUPR-KCPJHIHWSA-N 1 1 327.827 3.700 20 10 EHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)cc1F ZINC000862540329 1137148818 /nfs/dbraw/zinc/14/88/18/1137148818.db2.gz CLMTYXCFOLDNNP-CQSZACIVSA-N 1 1 331.387 3.538 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1OC ZINC000825104131 1137163633 /nfs/dbraw/zinc/16/36/33/1137163633.db2.gz OHYTVUHPUXSQAF-SFHVURJKSA-N 1 1 329.396 3.730 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1OC ZINC000825104131 1137163635 /nfs/dbraw/zinc/16/36/35/1137163635.db2.gz OHYTVUHPUXSQAF-SFHVURJKSA-N 1 1 329.396 3.730 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@](C)(c3ccc(F)cc3)C2)cc1OC ZINC000794891550 1137327727 /nfs/dbraw/zinc/32/77/27/1137327727.db2.gz GEVJKCMHUZAMSS-HXUWFJFHSA-N 1 1 345.414 3.712 20 10 EHCDMO COc1cccc([C@H](C)N[C@@H](C[NH+]2CCCC2)c2ccccc2)c1O ZINC000846136670 1137338147 /nfs/dbraw/zinc/33/81/47/1137338147.db2.gz MVVUJCBOIOWWLW-LPHOPBHVSA-N 1 1 340.467 3.889 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CCCC(=O)N(C)C)Cc1ccccc1O ZINC000846841397 1137371141 /nfs/dbraw/zinc/37/11/41/1137371141.db2.gz MVSFTTFNLZTAME-KRWDZBQOSA-N 1 1 340.467 3.824 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000773009253 1137458785 /nfs/dbraw/zinc/45/87/85/1137458785.db2.gz NHRSEZSRHREKKG-FZKQIMNGSA-N 1 1 334.410 3.805 20 10 EHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)n1 ZINC000872807530 1137584838 /nfs/dbraw/zinc/58/48/38/1137584838.db2.gz UBVKWDZTCXGOJZ-AWEZNQCLSA-N 1 1 325.437 3.695 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000825709957 1137609361 /nfs/dbraw/zinc/60/93/61/1137609361.db2.gz DIHZONPDEXTFBQ-VIFPVBQESA-N 1 1 338.167 3.929 20 10 EHCDMO Cc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c(O)c1 ZINC000876532108 1137654700 /nfs/dbraw/zinc/65/47/00/1137654700.db2.gz YCTCTKINNMLCPI-GOSISDBHSA-N 1 1 327.424 3.587 20 10 EHCDMO COc1ccccc1-c1noc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)n1 ZINC000877469896 1137677292 /nfs/dbraw/zinc/67/72/92/1137677292.db2.gz BDIGSSBVWOKKFY-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@@H](C4CCC4)C3)cc2)CC1 ZINC000877638789 1137683932 /nfs/dbraw/zinc/68/39/32/1137683932.db2.gz NZDIIJKXXUIODT-LJQANCHMSA-N 1 1 328.500 3.660 20 10 EHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CC2(CO1)CCOCC2 ZINC000878565071 1137720454 /nfs/dbraw/zinc/72/04/54/1137720454.db2.gz HRDFSCUCIGPSLR-SFHVURJKSA-N 1 1 333.472 3.580 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)[C@H]1CCCOC1 ZINC000880465636 1137779436 /nfs/dbraw/zinc/77/94/36/1137779436.db2.gz GVQFDZCMESKHNV-BLLLJJGKSA-N 1 1 325.836 3.543 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H](O)c1ccccc1C(F)(F)F ZINC000882926505 1137838808 /nfs/dbraw/zinc/83/88/08/1137838808.db2.gz WNVQLJNRZKKDDX-AWEZNQCLSA-N 1 1 347.283 3.512 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H](O)c1c(F)cccc1Cl ZINC000883025950 1137841860 /nfs/dbraw/zinc/84/18/60/1137841860.db2.gz CRYCKRPOZWHNQT-ANRSDYALSA-N 1 1 345.748 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000883075908 1137843591 /nfs/dbraw/zinc/84/35/91/1137843591.db2.gz ORBBIOYQHKFKTF-SCLBCKFNSA-N 1 1 333.378 3.928 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000883088231 1137844243 /nfs/dbraw/zinc/84/42/43/1137844243.db2.gz XLEMYWKYZQYQSG-RDJZCZTQSA-N 1 1 337.341 3.819 20 10 EHCDMO COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883106998 1137844775 /nfs/dbraw/zinc/84/47/75/1137844775.db2.gz LATRDQVCIGVWHW-KRWDZBQOSA-N 1 1 335.394 3.798 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1O ZINC000121349112 1137957063 /nfs/dbraw/zinc/95/70/63/1137957063.db2.gz CGSWRASHJQUGNH-UHFFFAOYSA-N 1 1 337.423 3.609 20 10 EHCDMO CCC[N@@H+](CCC(=O)N(C)c1ccccc1)Cc1ccccc1O ZINC000135111112 1137963711 /nfs/dbraw/zinc/96/37/11/1137963711.db2.gz SMODBPLUAKHLBN-UHFFFAOYSA-N 1 1 326.440 3.657 20 10 EHCDMO CCCNC(=O)c1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886505026 1138085267 /nfs/dbraw/zinc/08/52/67/1138085267.db2.gz FPTFHPHFZAKEOW-ZDUSSCGKSA-N 1 1 330.403 3.522 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1c(O)cccc1F ZINC000886603723 1138101105 /nfs/dbraw/zinc/10/11/05/1138101105.db2.gz UUYZBVWPOZIOLM-PSLIRLAXSA-N 1 1 327.758 3.708 20 10 EHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Br)ccc1O ZINC000093764390 1138240665 /nfs/dbraw/zinc/24/06/65/1138240665.db2.gz PRXLXYNWISNICZ-UHFFFAOYSA-N 1 1 341.274 3.676 20 10 EHCDMO CCn1cc(C[N@H+](Cc2ccccc2O)[C@@H](C)c2ccccc2)nn1 ZINC000887546207 1138411131 /nfs/dbraw/zinc/41/11/31/1138411131.db2.gz GLFGSARMNDGBOO-INIZCTEOSA-N 1 1 336.439 3.767 20 10 EHCDMO CCn1cc(C[N@@H+](Cc2ccccc2O)[C@@H](C)c2ccccc2)nn1 ZINC000887546207 1138411133 /nfs/dbraw/zinc/41/11/33/1138411133.db2.gz GLFGSARMNDGBOO-INIZCTEOSA-N 1 1 336.439 3.767 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000180799922 1139864615 /nfs/dbraw/zinc/86/46/15/1139864615.db2.gz ZZCOWLPSEXEHGK-CYBMUJFWSA-N 1 1 343.324 3.584 20 10 EHCDMO C[C@@H](CO[C@H]1CCOC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192943233 1140556199 /nfs/dbraw/zinc/55/61/99/1140556199.db2.gz RYOLBUFGXKQNOZ-DCAQKATOSA-N 1 1 334.243 3.544 20 10 EHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 ZINC000268850088 1141007926 /nfs/dbraw/zinc/00/79/26/1141007926.db2.gz OSRROGQAFCJCBA-CRAIPNDOSA-N 1 1 341.503 3.872 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1OC ZINC000271056816 1141301145 /nfs/dbraw/zinc/30/11/45/1141301145.db2.gz AQUAUABNDYSYGM-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO COc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC000155249292 1016355914 /nfs/dbraw/zinc/35/59/14/1016355914.db2.gz UWJBKWOAUUOKHO-QGZVFWFLSA-N 1 1 333.815 3.628 20 10 EHCDMO COc1cccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC000155249292 1016355923 /nfs/dbraw/zinc/35/59/23/1016355923.db2.gz UWJBKWOAUUOKHO-QGZVFWFLSA-N 1 1 333.815 3.628 20 10 EHCDMO OC[C@@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC000293971891 1017803775 /nfs/dbraw/zinc/80/37/75/1017803775.db2.gz KDICFKHFCTUSGD-QGZVFWFLSA-N 1 1 341.451 3.566 20 10 EHCDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000160465487 1019107899 /nfs/dbraw/zinc/10/78/99/1019107899.db2.gz MDQIPVHIBULURK-GOSISDBHSA-N 1 1 325.456 3.514 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H](O)C(F)F ZINC000834875873 1020988207 /nfs/dbraw/zinc/98/82/07/1020988207.db2.gz UXWZKSTUNMKYET-MDSUWVFBSA-N 1 1 328.186 3.754 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCCOCC(F)(F)F)Cc1ccco1 ZINC000077284160 1021386161 /nfs/dbraw/zinc/38/61/61/1021386161.db2.gz MKELBAHWDPKYRB-UHFFFAOYSA-N 1 1 343.345 3.956 20 10 EHCDMO CCCCN1CCC([NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000164474335 1021431961 /nfs/dbraw/zinc/43/19/61/1021431961.db2.gz PPVIRYUMXPFSOX-UHFFFAOYSA-N 1 1 345.531 3.518 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000894746678 1022828431 /nfs/dbraw/zinc/82/84/31/1022828431.db2.gz AVXIRGLKSGKDEC-ZHALLVOQSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000894746678 1022828446 /nfs/dbraw/zinc/82/84/46/1022828446.db2.gz AVXIRGLKSGKDEC-ZHALLVOQSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000894746678 1022828460 /nfs/dbraw/zinc/82/84/60/1022828460.db2.gz AVXIRGLKSGKDEC-ZHALLVOQSA-N 1 1 345.389 3.675 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2c2ccnn2C)c1O ZINC000281107958 1024663680 /nfs/dbraw/zinc/66/36/80/1024663680.db2.gz AZRKCINCXPSBNI-HNNXBMFYSA-N 1 1 335.835 3.515 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2c2ccnn2C)c1O ZINC000281107958 1024663687 /nfs/dbraw/zinc/66/36/87/1024663687.db2.gz AZRKCINCXPSBNI-HNNXBMFYSA-N 1 1 335.835 3.515 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000896227212 1025258788 /nfs/dbraw/zinc/25/87/88/1025258788.db2.gz KVPZTEYSUWUMCD-AWEZNQCLSA-N 1 1 333.325 3.657 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC000896515735 1025523704 /nfs/dbraw/zinc/52/37/04/1025523704.db2.gz HSKYPJSEHALJNB-ZDUSSCGKSA-N 1 1 344.480 3.726 20 10 EHCDMO Cc1cccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)n1 ZINC000127229555 1027628833 /nfs/dbraw/zinc/62/88/33/1027628833.db2.gz BAUJWPYIPSVUCS-OAHLLOKOSA-N 1 1 345.874 3.731 20 10 EHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(F)c(OC(F)(F)F)c1)CC2 ZINC001143447546 1027701523 /nfs/dbraw/zinc/70/15/23/1027701523.db2.gz XALIFEGNBNHAJU-UHFFFAOYSA-N 1 1 341.304 3.988 20 10 EHCDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)cc2O)s1 ZINC000274144220 1027711064 /nfs/dbraw/zinc/71/10/64/1027711064.db2.gz DQUCZEYYTGZCFN-JGVFFNPUSA-N 1 1 342.262 3.726 20 10 EHCDMO Cc1cc(C[NH2+]Cc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1C ZINC000840942895 1027861901 /nfs/dbraw/zinc/86/19/01/1027861901.db2.gz LMQJLZYUWZCLHH-CQSZACIVSA-N 1 1 346.906 3.908 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000271751992 1029153395 /nfs/dbraw/zinc/15/33/95/1029153395.db2.gz VSAVNNPTXWUFGX-SFHVURJKSA-N 1 1 337.423 3.625 20 10 EHCDMO C[C@H]([NH2+][C@H](C(N)=O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000126123298 1029668555 /nfs/dbraw/zinc/66/85/55/1029668555.db2.gz VACTWYXWYNWTLT-JXFKEZNVSA-N 1 1 337.467 3.554 20 10 EHCDMO Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000278246803 1029803293 /nfs/dbraw/zinc/80/32/93/1029803293.db2.gz MBOONBWBZYSBKG-SNVBAGLBSA-N 1 1 328.243 3.945 20 10 EHCDMO CC(C)(C)n1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cn1 ZINC000160207705 1030599800 /nfs/dbraw/zinc/59/98/00/1030599800.db2.gz VHYIVXMQAKJONW-SFHVURJKSA-N 1 1 343.471 3.525 20 10 EHCDMO c1coc([C@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)CCO2)c1 ZINC000093841227 1030679820 /nfs/dbraw/zinc/67/98/20/1030679820.db2.gz YOFSOJICBMLABB-HXUWFJFHSA-N 1 1 326.440 3.843 20 10 EHCDMO c1coc([C@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)CCO2)c1 ZINC000093841227 1030679822 /nfs/dbraw/zinc/67/98/22/1030679822.db2.gz YOFSOJICBMLABB-HXUWFJFHSA-N 1 1 326.440 3.843 20 10 EHCDMO COc1ccc([C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C2CC2)cn1 ZINC000527840366 1031309755 /nfs/dbraw/zinc/30/97/55/1031309755.db2.gz FGLQPZXWPLZMRZ-QGZVFWFLSA-N 1 1 336.794 3.829 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)CC(C)(C)NC(=O)OC(C)(C)C ZINC000761196008 1034392484 /nfs/dbraw/zinc/39/24/84/1034392484.db2.gz RQDCAWRGOUHRLX-UHFFFAOYSA-N 1 1 336.476 3.908 20 10 EHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761202806 1034409223 /nfs/dbraw/zinc/40/92/23/1034409223.db2.gz MSRBTOOMUZIINO-KRWDZBQOSA-N 1 1 349.858 3.827 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1C ZINC000761226799 1034819290 /nfs/dbraw/zinc/81/92/90/1034819290.db2.gz VFWYAENWDZLHGQ-HXUWFJFHSA-N 1 1 325.452 3.782 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccccc1-n1cccn1 ZINC000190903747 1036300788 /nfs/dbraw/zinc/30/07/88/1036300788.db2.gz LKDGEMMRIGXOKJ-UHFFFAOYSA-N 1 1 331.778 3.660 20 10 EHCDMO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3cc(C(C)C)c(C)cc3O)[C@H]2C1 ZINC000165275067 1036374789 /nfs/dbraw/zinc/37/47/89/1036374789.db2.gz VREFFPUUQPCINP-IMFGXOCKSA-N 1 1 333.472 3.592 20 10 EHCDMO CC(=O)N1CCCCC[C@H]1C1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000378497475 1038675953 /nfs/dbraw/zinc/67/59/53/1038675953.db2.gz QDWNMWINFFFDIQ-IBGZPJMESA-N 1 1 348.462 3.534 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc(-c2cccc(F)c2)no1 ZINC000237607114 1039397725 /nfs/dbraw/zinc/39/77/25/1039397725.db2.gz JKKIBQJMHXWONW-ZDUSSCGKSA-N 1 1 340.402 3.793 20 10 EHCDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000162736840 1041282475 /nfs/dbraw/zinc/28/24/75/1041282475.db2.gz GDPPEMOVGDHBGK-MRXNPFEDSA-N 1 1 343.471 3.638 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000278882494 1042823160 /nfs/dbraw/zinc/82/31/60/1042823160.db2.gz OHSISNBMMLWQEY-MRXNPFEDSA-N 1 1 328.368 3.550 20 10 EHCDMO CC(C)(C)c1cnc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)s1 ZINC000279120494 1043385020 /nfs/dbraw/zinc/38/50/20/1043385020.db2.gz LOTYNWLIEYQDMA-UHFFFAOYSA-N 1 1 345.512 3.567 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1ccc(F)cc1O ZINC000279508153 1044152810 /nfs/dbraw/zinc/15/28/10/1044152810.db2.gz NEFNIJBUOOKICR-JDNHERCYSA-N 1 1 327.758 3.708 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1ccc(F)cc1O ZINC000185010774 1126735359 /nfs/dbraw/zinc/73/53/59/1126735359.db2.gz GIYVNSUOWYILRN-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000734448755 1131237665 /nfs/dbraw/zinc/23/76/65/1131237665.db2.gz OYWCEEGWTXWZKS-GOSISDBHSA-N 1 1 339.483 3.508 20 10 EHCDMO COc1ccc(COCCC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185321248 1126866925 /nfs/dbraw/zinc/86/69/25/1126866925.db2.gz PNCYFMRDAPZSJJ-AWEZNQCLSA-N 1 1 333.403 3.797 20 10 EHCDMO C[C@H]([NH2+]C[C@@](O)(c1ccccc1)C(F)(F)F)c1ccc(F)cc1O ZINC000185326203 1126870412 /nfs/dbraw/zinc/87/04/12/1126870412.db2.gz KVWYRMLKDKYZMF-MEDUHNTESA-N 1 1 343.320 3.632 20 10 EHCDMO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cc1OC ZINC000185390757 1126883546 /nfs/dbraw/zinc/88/35/46/1126883546.db2.gz WWYDZKXJUNKZDN-OLZOCXBDSA-N 1 1 333.403 3.830 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1O ZINC000185680901 1126982167 /nfs/dbraw/zinc/98/21/67/1126982167.db2.gz IMCOGSPXHLPRHI-AAEUAGOBSA-N 1 1 336.357 3.739 20 10 EHCDMO C[C@@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1O ZINC000185680920 1126982273 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/nfs/dbraw/zinc/13/94/54/1134139454.db2.gz BBTBEEOAVSSBSB-UHFFFAOYSA-N 1 1 348.424 3.581 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)cc1F ZINC000788584729 1134148200 /nfs/dbraw/zinc/14/82/00/1134148200.db2.gz PXCQCCLGIFZLOJ-MRXNPFEDSA-N 1 1 334.822 3.906 20 10 EHCDMO C[C@@H]([NH2+]CCN(C)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788595793 1134149765 /nfs/dbraw/zinc/14/97/65/1134149765.db2.gz VVBBMHKPGUEAQM-GFCCVEGCSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cccc(C(F)(F)F)c1O ZINC000788694047 1134158337 /nfs/dbraw/zinc/15/83/37/1134158337.db2.gz UJUKWQNOPGYIGH-VXGBXAGGSA-N 1 1 345.361 3.747 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCN(c3ccccc3F)C[C@@H]2C)c1O ZINC000788785237 1134174550 /nfs/dbraw/zinc/17/45/50/1134174550.db2.gz YAEJYKCCQQDPIH-HNNXBMFYSA-N 1 1 344.430 3.559 20 10 EHCDMO COc1c(O)c(C[NH2+]CC(C)(C)c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000775015490 1134211583 /nfs/dbraw/zinc/21/15/83/1134211583.db2.gz GLKXQRIHSPGCFU-UHFFFAOYSA-N 1 1 348.374 3.516 20 10 EHCDMO COc1c(O)c(C[NH2+]C2(Cc3ccccc3)CCC2)ccc1[N+](=O)[O-] ZINC000775032197 1134233245 /nfs/dbraw/zinc/23/32/45/1134233245.db2.gz GEDSDXHXPHNKML-UHFFFAOYSA-N 1 1 342.395 3.564 20 10 EHCDMO Oc1ccc(Br)cc1C[N@@H+](C1CCC1)C1CCOCC1 ZINC001203648073 1134261889 /nfs/dbraw/zinc/26/18/89/1134261889.db2.gz CTPQJMMYGBVIGO-UHFFFAOYSA-N 1 1 340.261 3.688 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@@H](COc2ccccc2)C1 ZINC000790467313 1134426847 /nfs/dbraw/zinc/42/68/47/1134426847.db2.gz OARFJWFKASOBCY-LJQANCHMSA-N 1 1 349.430 3.825 20 10 EHCDMO CC[C@H](C)CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000790788452 1134465194 /nfs/dbraw/zinc/46/51/94/1134465194.db2.gz XRXCSTYSUZQQSM-BBRMVZONSA-N 1 1 338.879 3.562 20 10 EHCDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc(Br)cc(C)c1O ZINC000775175168 1134475830 /nfs/dbraw/zinc/47/58/30/1134475830.db2.gz GKXACJRSRDYMFZ-MRXNPFEDSA-N 1 1 342.277 3.590 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000790977320 1134494973 /nfs/dbraw/zinc/49/49/73/1134494973.db2.gz HPYICGBNADPRQD-UHFFFAOYSA-N 1 1 335.762 3.692 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)cc1F ZINC000775190270 1134499038 /nfs/dbraw/zinc/49/90/38/1134499038.db2.gz PBXZTTQKISYVEX-QGZVFWFLSA-N 1 1 344.478 3.785 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)cn1 ZINC000792156419 1134658761 /nfs/dbraw/zinc/65/87/61/1134658761.db2.gz CYNWPXJSYHTVSV-UHFFFAOYSA-N 1 1 326.488 3.626 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H](N3CCCC3=O)C2)cc1 ZINC000792185128 1134665642 /nfs/dbraw/zinc/66/56/42/1134665642.db2.gz HSPKHKNGPWLPKZ-FQEVSTJZSA-N 1 1 343.515 3.510 20 10 EHCDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792831090 1134797895 /nfs/dbraw/zinc/79/78/95/1134797895.db2.gz HRBPWXQRYGNHDG-AWEZNQCLSA-N 1 1 343.437 3.545 20 10 EHCDMO CO[C@@]1(C)CCC[N@H+](Cc2cccc(Br)c2O)CC1 ZINC000793341373 1134901591 /nfs/dbraw/zinc/90/15/91/1134901591.db2.gz SSXHTZOKIIROOQ-HNNXBMFYSA-N 1 1 328.250 3.546 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cccc(Br)c2O)CC1 ZINC000793341373 1134901599 /nfs/dbraw/zinc/90/15/99/1134901599.db2.gz SSXHTZOKIIROOQ-HNNXBMFYSA-N 1 1 328.250 3.546 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ncnn2CC)cc1 ZINC000793344364 1134903252 /nfs/dbraw/zinc/90/32/52/1134903252.db2.gz RHIIRDWCMBZBTC-UHFFFAOYSA-N 1 1 349.482 3.614 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1O ZINC000793609699 1134971670 /nfs/dbraw/zinc/97/16/70/1134971670.db2.gz RFZKAFLANIIUGY-LSDHHAIUSA-N 1 1 340.261 3.607 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC=C(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000793620059 1134973441 /nfs/dbraw/zinc/97/34/41/1134973441.db2.gz KFIGGIIVVPKOSS-UHFFFAOYSA-N 1 1 340.379 3.598 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1 ZINC001129679265 1135133783 /nfs/dbraw/zinc/13/37/83/1135133783.db2.gz LOMNWDIVWRMXLJ-FQEVSTJZSA-N 1 1 339.483 3.649 20 10 EHCDMO Cc1cccc(C[N@H+](C)Cc2cc(Br)cc(C)c2O)n1 ZINC000775715206 1135558820 /nfs/dbraw/zinc/55/88/20/1135558820.db2.gz DQBBHJDGXBLEDD-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)c1 ZINC000775720948 1135570134 /nfs/dbraw/zinc/57/01/34/1135570134.db2.gz QQNGAMJQNMOMBK-HRAATJIYSA-N 1 1 341.451 3.980 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CCOC23CCCCC3)c1O ZINC001198397962 1135815603 /nfs/dbraw/zinc/81/56/03/1135815603.db2.gz VQWZSMWSBKNHPT-INIZCTEOSA-N 1 1 337.847 3.830 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H](C)[S@@]1=O ZINC000809700462 1135869369 /nfs/dbraw/zinc/86/93/69/1135869369.db2.gz HCSFQEIOTPWYNN-BQMFCVJUSA-N 1 1 343.492 3.791 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1O ZINC000809688681 1135871812 /nfs/dbraw/zinc/87/18/12/1135871812.db2.gz NTNXXRKLNMHLJB-UHFFFAOYSA-N 1 1 334.803 3.937 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1F ZINC000809767404 1135879962 /nfs/dbraw/zinc/87/99/62/1135879962.db2.gz JYVJMLLHKBIOFR-PKOBYXMFSA-N 1 1 333.495 3.588 20 10 EHCDMO CCN(CC)c1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1F ZINC000809767404 1135879966 /nfs/dbraw/zinc/87/99/66/1135879966.db2.gz JYVJMLLHKBIOFR-PKOBYXMFSA-N 1 1 333.495 3.588 20 10 EHCDMO CCOc1cccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c1O ZINC000809738349 1135882972 /nfs/dbraw/zinc/88/29/72/1135882972.db2.gz VPSYETBZWSLRKN-UHFFFAOYSA-N 1 1 327.424 3.909 20 10 EHCDMO CC(C)[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)N1CCCCCC1 ZINC001199162709 1135884448 /nfs/dbraw/zinc/88/44/48/1135884448.db2.gz YAEDGAWPZWCDIG-HXUWFJFHSA-N 1 1 335.511 3.882 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCCN(CC(F)F)CC1 ZINC000809757469 1135887072 /nfs/dbraw/zinc/88/70/72/1135887072.db2.gz NLULLINFWYTMOE-UHFFFAOYSA-N 1 1 346.421 3.832 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(N2CCOCC2)cc1 ZINC000809972102 1135907029 /nfs/dbraw/zinc/90/70/29/1135907029.db2.gz RAPMZFKLSUXGNX-OAHLLOKOSA-N 1 1 343.471 3.660 20 10 EHCDMO C[C@@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1cc(F)cc(F)c1O ZINC000810253247 1135949538 /nfs/dbraw/zinc/94/95/38/1135949538.db2.gz PSQZQFWDRHQISG-BMLIUANNSA-N 1 1 339.407 3.871 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CC3Cc4ccccc4C3)CC2)cc1 ZINC000811457838 1136089843 /nfs/dbraw/zinc/08/98/43/1136089843.db2.gz OEHKTPHYAYGTPA-UHFFFAOYSA-N 1 1 336.479 3.622 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000811781521 1136134713 /nfs/dbraw/zinc/13/47/13/1136134713.db2.gz CZIKASCPWMLRJX-SFHVURJKSA-N 1 1 345.446 3.577 20 10 EHCDMO Oc1ccc2c(c1CNc1cc[nH+]c(N3CCCCC3)n1)CCCC2 ZINC000811808293 1136139251 /nfs/dbraw/zinc/13/92/51/1136139251.db2.gz CJSDLXPTEAATPV-UHFFFAOYSA-N 1 1 338.455 3.663 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCCCC23CCCC3)ccc1[N+](=O)[O-] ZINC000812781023 1136246419 /nfs/dbraw/zinc/24/64/19/1136246419.db2.gz XWDFAWNYKSVSFM-HNNXBMFYSA-N 1 1 334.416 3.902 20 10 EHCDMO C[C@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1cccc2ccccc21 ZINC000109772844 1136339894 /nfs/dbraw/zinc/33/98/94/1136339894.db2.gz QNIJGICURXUMAP-INIZCTEOSA-N 1 1 348.446 3.855 20 10 EHCDMO c1cc(N2CCCCC2)ccc1CNC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093130 1136508603 /nfs/dbraw/zinc/50/86/03/1136508603.db2.gz DCIFCCYJDNHUPY-OAQYLSRUSA-N 1 1 341.543 3.889 20 10 EHCDMO c1cc(N2CCCCC2)ccc1CNC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853093130 1136508606 /nfs/dbraw/zinc/50/86/06/1136508606.db2.gz DCIFCCYJDNHUPY-OAQYLSRUSA-N 1 1 341.543 3.889 20 10 EHCDMO CC[C@@H](NC(=O)C[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000111236234 1136525200 /nfs/dbraw/zinc/52/52/00/1136525200.db2.gz PWURFURYDQFMOT-QGZVFWFLSA-N 1 1 346.858 3.745 20 10 EHCDMO CC(=O)Nc1cccc2c1CC[N@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC000815021791 1136538373 /nfs/dbraw/zinc/53/83/73/1136538373.db2.gz PNAYCZSQNTYKGS-UHFFFAOYSA-N 1 1 337.467 3.578 20 10 EHCDMO Cc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089109 1136543613 /nfs/dbraw/zinc/54/36/13/1136543613.db2.gz OBAMFQRKOKEJCZ-MJGOQNOKSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(CN[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089109 1136543616 /nfs/dbraw/zinc/54/36/16/1136543616.db2.gz OBAMFQRKOKEJCZ-MJGOQNOKSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(CN[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1N(C)C ZINC000815089109 1136543620 /nfs/dbraw/zinc/54/36/20/1136543620.db2.gz OBAMFQRKOKEJCZ-MJGOQNOKSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)ccc1N(C)C ZINC000815061264 1136545741 /nfs/dbraw/zinc/54/57/41/1136545741.db2.gz OFCAEQPSJPZTHJ-IEBWSBKVSA-N 1 1 328.456 3.742 20 10 EHCDMO C[C@H]([NH2+]CCN1CCC[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815559202 1136610582 /nfs/dbraw/zinc/61/05/82/1136610582.db2.gz AALCREGVZJJZKW-STQMWFEESA-N 1 1 330.394 3.794 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815558619 1136610723 /nfs/dbraw/zinc/61/07/23/1136610723.db2.gz IXONBNHLZKGLNE-LLVKDONJSA-N 1 1 339.361 3.723 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000815578626 1136613610 /nfs/dbraw/zinc/61/36/10/1136613610.db2.gz SHYYBDUALRUDIC-AAEUAGOBSA-N 1 1 328.378 3.546 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815589098 1136615630 /nfs/dbraw/zinc/61/56/30/1136615630.db2.gz IOKIAOFGEHUWAM-NHYWBVRUSA-N 1 1 325.330 3.795 20 10 EHCDMO Oc1c(C[N@@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)ccc2ccccc21 ZINC000816592385 1136735549 /nfs/dbraw/zinc/73/55/49/1136735549.db2.gz IILAFPLJMWYKOY-YOEHRIQHSA-N 1 1 339.357 3.681 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1cccc(C(F)(F)F)n1 ZINC000816626960 1136739403 /nfs/dbraw/zinc/73/94/03/1136739403.db2.gz AKLHSKHOKUYMGX-UHFFFAOYSA-N 1 1 348.727 3.931 20 10 EHCDMO CCc1nocc1C[N@@H+](C)Cc1cc(C)cc(Br)c1[O-] ZINC000816652179 1136744776 /nfs/dbraw/zinc/74/47/76/1136744776.db2.gz CBUHTTQSOZMXQM-UHFFFAOYSA-N 1 1 339.233 3.646 20 10 EHCDMO CCc1nocc1C[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000816652179 1136744783 /nfs/dbraw/zinc/74/47/83/1136744783.db2.gz CBUHTTQSOZMXQM-UHFFFAOYSA-N 1 1 339.233 3.646 20 10 EHCDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000817412811 1136806088 /nfs/dbraw/zinc/80/60/88/1136806088.db2.gz POADQZDDWWIXIB-AEFFLSMTSA-N 1 1 344.524 3.835 20 10 EHCDMO Cc1ccc2c(c1)OCCC[C@H]2NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940826 1136848701 /nfs/dbraw/zinc/84/87/01/1136848701.db2.gz HZDDJKNDNZZJFZ-WOJBJXKFSA-N 1 1 339.483 3.564 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000817940674 1136848822 /nfs/dbraw/zinc/84/88/22/1136848822.db2.gz GOOGTQZDUQOXMF-KZULUSFZSA-N 1 1 335.854 3.896 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858013538 1136931151 /nfs/dbraw/zinc/93/11/51/1136931151.db2.gz FFQHJUZTMQOVTC-KRWDZBQOSA-N 1 1 344.842 3.971 20 10 EHCDMO CC1CCN(c2ccc(CN[C@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132281 1136942441 /nfs/dbraw/zinc/94/24/41/1136942441.db2.gz YSZXCRQYMBQAIF-IBGZPJMESA-N 1 1 329.532 3.885 20 10 EHCDMO CC1CCN(c2ccc(CN[C@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132281 1136942444 /nfs/dbraw/zinc/94/24/44/1136942444.db2.gz YSZXCRQYMBQAIF-IBGZPJMESA-N 1 1 329.532 3.885 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)cc2)CC1 ZINC000858132281 1136942446 /nfs/dbraw/zinc/94/24/46/1136942446.db2.gz YSZXCRQYMBQAIF-IBGZPJMESA-N 1 1 329.532 3.885 20 10 EHCDMO Cc1cc(Cl)nc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC000858162362 1136945759 /nfs/dbraw/zinc/94/57/59/1136945759.db2.gz YHYVFYVKXFTTMU-UHFFFAOYSA-N 1 1 325.790 3.677 20 10 EHCDMO [O-]c1cccc(Br)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000858168102 1136946121 /nfs/dbraw/zinc/94/61/21/1136946121.db2.gz NGTWWXPPSDLDLD-UHFFFAOYSA-N 1 1 341.293 3.510 20 10 EHCDMO C[C@H]([NH2+]C[C@]1(C)COc2ccccc2O1)c1cc(F)cc(F)c1O ZINC000858447878 1136968529 /nfs/dbraw/zinc/96/85/29/1136968529.db2.gz XSAZDWVNSNQZCX-BBATYDOGSA-N 1 1 335.350 3.551 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@H](CCO)C2)cc1 ZINC000823436659 1137099586 /nfs/dbraw/zinc/09/95/86/1137099586.db2.gz BMRIQNMQARAUMX-QGZVFWFLSA-N 1 1 344.524 3.979 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2[nH]ccc2c1 ZINC000862214102 1137132531 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COc1cc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000824863443 1137155161 /nfs/dbraw/zinc/15/51/61/1137155161.db2.gz QPVKFEQHFZSSOC-HOCLYGCPSA-N 1 1 334.504 3.613 20 10 EHCDMO Cc1cccc(C[N@H+](C)C2(CNC(=O)OC(C)(C)C)CCC2)c1O ZINC000824931583 1137158125 /nfs/dbraw/zinc/15/81/25/1137158125.db2.gz AHWHJGYYUNOFFJ-UHFFFAOYSA-N 1 1 334.460 3.580 20 10 EHCDMO COc1ncc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cc1C ZINC001137004661 1137169098 /nfs/dbraw/zinc/16/90/98/1137169098.db2.gz IJRXFEBJOIUDNM-UHFFFAOYSA-N 1 1 325.456 3.631 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H](OC(C)C)C3)c2c1 ZINC000844719615 1137247784 /nfs/dbraw/zinc/24/77/84/1137247784.db2.gz KHGQRHPVOSXDJC-KRWDZBQOSA-N 1 1 329.440 3.943 20 10 EHCDMO CCn1cc(C[N@@H+](Cc2cc(Cl)cc(OC)c2O)C(C)C)cn1 ZINC000846056785 1137331347 /nfs/dbraw/zinc/33/13/47/1137331347.db2.gz ZOBOSUTXGQJDCQ-UHFFFAOYSA-N 1 1 337.851 3.681 20 10 EHCDMO COc1cccc([C@H](C)[NH2+]CC[C@H](C)N(C)Cc2ccccc2)c1O ZINC000846144591 1137338936 /nfs/dbraw/zinc/33/89/36/1137338936.db2.gz IAXZTHGPZILSFL-IRXDYDNUSA-N 1 1 342.483 3.962 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc2ccccc2n(C)c1=O ZINC000846810492 1137368662 /nfs/dbraw/zinc/36/86/62/1137368662.db2.gz WMMVYRBAIQJZCT-UHFFFAOYSA-N 1 1 336.435 3.656 20 10 EHCDMO COCC[C@@H](c1ccccc1)[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001171729019 1137506756 /nfs/dbraw/zinc/50/67/56/1137506756.db2.gz FADYCGFPYWSUCW-NRFANRHFSA-N 1 1 342.483 3.841 20 10 EHCDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]2CCCC[C@H]12 ZINC001171810032 1137514371 /nfs/dbraw/zinc/51/43/71/1137514371.db2.gz MLYHIPOPJTYYHT-QWFCFKBJSA-N 1 1 344.499 3.615 20 10 EHCDMO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000124074587 1137578987 /nfs/dbraw/zinc/57/89/87/1137578987.db2.gz KBSMJZUAKHPXSC-NRFANRHFSA-N 1 1 340.442 3.999 20 10 EHCDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876551203 1137655334 /nfs/dbraw/zinc/65/53/34/1137655334.db2.gz RIWOWOGJWWJQJZ-HNNXBMFYSA-N 1 1 342.508 3.829 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCS[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC000876771804 1137661054 /nfs/dbraw/zinc/66/10/54/1137661054.db2.gz ZGSONBAZZUYDAC-VQTJNVASSA-N 1 1 346.540 3.508 20 10 EHCDMO CC[N@H+](Cc1ccc(Br)cc1O)[C@@H]1CCOC(C)(C)C1 ZINC000825943290 1137671900 /nfs/dbraw/zinc/67/19/00/1137671900.db2.gz BMQNQUQTOBUIPG-CQSZACIVSA-N 1 1 342.277 3.934 20 10 EHCDMO CC[N@@H+](Cc1ccc(Br)cc1O)[C@@H]1CCOC(C)(C)C1 ZINC000825943290 1137671901 /nfs/dbraw/zinc/67/19/01/1137671901.db2.gz BMQNQUQTOBUIPG-CQSZACIVSA-N 1 1 342.277 3.934 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3Cc4ccccc4C4(CC4)C3)cc2)CC1 ZINC000877423048 1137675867 /nfs/dbraw/zinc/67/58/67/1137675867.db2.gz RTPKYXYOBZOZIH-UHFFFAOYSA-N 1 1 348.490 3.695 20 10 EHCDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825991755 1137684387 /nfs/dbraw/zinc/68/43/87/1137684387.db2.gz MIDAQLSVYFBTJP-NSHDSACASA-N 1 1 330.291 3.730 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1 ZINC000877672416 1137685122 /nfs/dbraw/zinc/68/51/22/1137685122.db2.gz DUSMBFFXLRJNDC-VDCFCKFASA-N 1 1 336.479 3.964 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](Cc2cccc(C(N)=O)c2)C2CC2)cc1Cl ZINC000826036624 1137711603 /nfs/dbraw/zinc/71/16/03/1137711603.db2.gz NFFPTHVLYLZYEZ-UHFFFAOYSA-N 1 1 344.842 3.618 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccccc3OC(C)C)CC2)cc1 ZINC001137133505 1137721328 /nfs/dbraw/zinc/72/13/28/1137721328.db2.gz FNLXVVNHCIEEEH-UHFFFAOYSA-N 1 1 340.467 3.805 20 10 EHCDMO CCC[N@@H+](CC)CCNC(=O)c1ccc(-n2c(C)ccc2C)cc1 ZINC001137137421 1137728152 /nfs/dbraw/zinc/72/81/52/1137728152.db2.gz QIYRAIJGHFXENB-UHFFFAOYSA-N 1 1 327.472 3.556 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000883088229 1137844315 /nfs/dbraw/zinc/84/43/15/1137844315.db2.gz XLEMYWKYZQYQSG-DOTOQJQBSA-N 1 1 337.341 3.819 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000883136831 1137846032 /nfs/dbraw/zinc/84/60/32/1137846032.db2.gz PIKZHBLVUGBORK-TZMCWYRMSA-N 1 1 325.380 3.742 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CCN1CCCC1=O)Cc1ccccc1O ZINC000119282879 1137940032 /nfs/dbraw/zinc/94/00/32/1137940032.db2.gz SGGKGZFNULJBJT-KRWDZBQOSA-N 1 1 338.451 3.578 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1c(O)cccc1F ZINC000886495040 1138083284 /nfs/dbraw/zinc/08/32/84/1138083284.db2.gz GDJMSSRNYXUZEP-ZDUSSCGKSA-N 1 1 328.387 3.509 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(F)cc2c1OCOC2 ZINC000068973719 1138086893 /nfs/dbraw/zinc/08/68/93/1138086893.db2.gz VBJNDOLQAABWJT-UHFFFAOYSA-N 1 1 331.387 3.810 20 10 EHCDMO COCCCOc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886608791 1138101439 /nfs/dbraw/zinc/10/14/39/1138101439.db2.gz GBFBPBUJLLCWIN-AWEZNQCLSA-N 1 1 333.403 3.797 20 10 EHCDMO C[C@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1c(O)cccc1F ZINC000886713347 1138123414 /nfs/dbraw/zinc/12/34/14/1138123414.db2.gz ZUWBRBCCIZIIQA-GJZGRUSLSA-N 1 1 337.435 3.548 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@H]2C)O1)c1ccc(F)cc1O ZINC000886768665 1138136677 /nfs/dbraw/zinc/13/66/77/1138136677.db2.gz FYPYAHMUSWZFKR-BOGNXNQPSA-N 1 1 337.435 3.545 20 10 EHCDMO CN(C)C(=O)Sc1cccc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000084075408 1138177205 /nfs/dbraw/zinc/17/72/05/1138177205.db2.gz ZFDIEXSKEKCFNJ-UHFFFAOYSA-N 1 1 330.453 3.798 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@H]2c2nncn2C)cc1 ZINC000093810295 1138241396 /nfs/dbraw/zinc/24/13/96/1138241396.db2.gz BHOZRADRUOKUNA-IBGZPJMESA-N 1 1 341.503 3.779 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H]2c2nncn2C)cc1 ZINC000093810295 1138241397 /nfs/dbraw/zinc/24/13/97/1138241397.db2.gz BHOZRADRUOKUNA-IBGZPJMESA-N 1 1 341.503 3.779 20 10 EHCDMO CNC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1 ZINC000264630449 1138586156 /nfs/dbraw/zinc/58/61/56/1138586156.db2.gz UJJRLJFZTLXVSP-UHFFFAOYSA-N 1 1 339.483 3.523 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)cc1 ZINC000179766509 1139780124 /nfs/dbraw/zinc/78/01/24/1139780124.db2.gz MIQNYVGGHYBUCO-DEOSSOPVSA-N 1 1 344.524 3.902 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](c2nccn2C)C2CC2)cc1F ZINC000183274479 1140026680 /nfs/dbraw/zinc/02/66/80/1140026680.db2.gz HTFKFMHHISTGFN-GOSISDBHSA-N 1 1 330.451 3.646 20 10 EHCDMO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000185077477 1140135259 /nfs/dbraw/zinc/13/52/59/1140135259.db2.gz WNKKDQWFNBDGTE-CYBMUJFWSA-N 1 1 336.451 3.609 20 10 EHCDMO CC(C)NC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185087151 1140135692 /nfs/dbraw/zinc/13/56/92/1140135692.db2.gz MRLVFAREZFJPID-CYBMUJFWSA-N 1 1 345.418 3.912 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 ZINC000268850091 1141007763 /nfs/dbraw/zinc/00/77/63/1141007763.db2.gz OSRROGQAFCJCBA-MAUKXSAKSA-N 1 1 341.503 3.872 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 ZINC000268850097 1141008379 /nfs/dbraw/zinc/00/83/79/1141008379.db2.gz OSRROGQAFCJCBA-YJBOKZPZSA-N 1 1 341.503 3.872 20 10 EHCDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000271225212 1141328758 /nfs/dbraw/zinc/32/87/58/1141328758.db2.gz QNUCHOPFKYYBGP-SHACYNPGSA-N 1 1 348.487 3.822 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000821109271 945636078 /nfs/dbraw/zinc/63/60/78/945636078.db2.gz FIRQHWVMDLQIKG-AWEZNQCLSA-N 1 1 337.427 3.546 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1OC ZINC000160223335 1014526309 /nfs/dbraw/zinc/52/63/09/1014526309.db2.gz SYLUJJBFXMRGDX-HNNXBMFYSA-N 1 1 345.414 3.613 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1OCc1ccccn1 ZINC000091956772 1020173247 /nfs/dbraw/zinc/17/32/47/1020173247.db2.gz KXTMFKWAINEFEN-UHFFFAOYSA-N 1 1 334.419 3.998 20 10 EHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(OC)c(OC)c2O)cc1 ZINC000891565870 1021949561 /nfs/dbraw/zinc/94/95/61/1021949561.db2.gz KMRZABRUTRCHPM-ZDUSSCGKSA-N 1 1 331.412 3.611 20 10 EHCDMO CC(C)(CO)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccs1 ZINC000894962426 1022308555 /nfs/dbraw/zinc/30/85/55/1022308555.db2.gz IGCKZBVCUVKILT-OAHLLOKOSA-N 1 1 327.396 3.581 20 10 EHCDMO Cc1nnc([C@H](C)[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)[nH]1 ZINC000894774105 1022869493 /nfs/dbraw/zinc/86/94/93/1022869493.db2.gz OEBUCWYSZMQSLT-ZDUSSCGKSA-N 1 1 341.484 3.662 20 10 EHCDMO COCCCCc1ccc[nH+]c1NCc1cc(C)cc(OC)c1O ZINC000894820054 1022953854 /nfs/dbraw/zinc/95/38/54/1022953854.db2.gz HFOHPSDQCQSJKZ-UHFFFAOYSA-N 1 1 330.428 3.685 20 10 EHCDMO [O-]c1c(Br)cccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895585615 1024629627 /nfs/dbraw/zinc/62/96/27/1024629627.db2.gz YTCXDWMUOFOKNB-LLVKDONJSA-N 1 1 339.258 3.601 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895585615 1024629632 /nfs/dbraw/zinc/62/96/32/1024629632.db2.gz YTCXDWMUOFOKNB-LLVKDONJSA-N 1 1 339.258 3.601 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895585615 1024629640 /nfs/dbraw/zinc/62/96/40/1024629640.db2.gz YTCXDWMUOFOKNB-LLVKDONJSA-N 1 1 339.258 3.601 20 10 EHCDMO COC[C@@H]1CCCC[N@@H+](Cc2cc(Br)cc(C)c2O)C1 ZINC000696621030 1024759743 /nfs/dbraw/zinc/75/97/43/1024759743.db2.gz 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EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2C)ccc1[N+](=O)[O-] ZINC000774831921 1134040083 /nfs/dbraw/zinc/04/00/83/1134040083.db2.gz FMGNDCUAZOHCIR-MRXNPFEDSA-N 1 1 342.395 3.955 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000774909416 1134117121 /nfs/dbraw/zinc/11/71/21/1134117121.db2.gz MSGKAZAFKGUFQB-IUODEOHRSA-N 1 1 346.383 3.875 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775139304 1134370695 /nfs/dbraw/zinc/37/06/95/1134370695.db2.gz YTZBZNJSYLGWMA-VIFPVBQESA-N 1 1 338.167 3.929 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775139304 1134370701 /nfs/dbraw/zinc/37/07/01/1134370701.db2.gz YTZBZNJSYLGWMA-VIFPVBQESA-N 1 1 338.167 3.929 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)c2nc(C)cc(=O)[nH]2)cc1 ZINC000790268493 1134392284 /nfs/dbraw/zinc/39/22/84/1134392284.db2.gz RARVOABBGOLREL-OAHLLOKOSA-N 1 1 328.460 3.530 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCO[C@H](C(C)(C)C)C3)c2c1 ZINC000790414631 1134413440 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EHCDMO C[C@H](CCNCc1ccc(N(C)C)c(F)c1)[N@H+](C)Cc1ccccc1 ZINC001200940985 1135971297 /nfs/dbraw/zinc/97/12/97/1135971297.db2.gz BQTYIMONFOKYJP-QGZVFWFLSA-N 1 1 343.490 3.892 20 10 EHCDMO C[C@H](CCNCc1ccc(N(C)C)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC001200940985 1135971300 /nfs/dbraw/zinc/97/13/00/1135971300.db2.gz BQTYIMONFOKYJP-QGZVFWFLSA-N 1 1 343.490 3.892 20 10 EHCDMO CC(C)C[C@@H](C[N@@H+](C)Cc1ccccc1O)NC(=O)OC(C)(C)C ZINC000811456564 1136089395 /nfs/dbraw/zinc/08/93/95/1136089395.db2.gz CYCLPHOCTGSVFJ-INIZCTEOSA-N 1 1 336.476 3.763 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](CO)c2ccc(F)cc2F)cc1 ZINC000850410479 1136252411 /nfs/dbraw/zinc/25/24/11/1136252411.db2.gz NEQZLMVDAFVMHR-IBGZPJMESA-N 1 1 334.410 3.634 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000747830865 1136279225 /nfs/dbraw/zinc/27/92/25/1136279225.db2.gz MQWDIFBZODDARH-HUUCEWRRSA-N 1 1 333.472 3.644 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](O)c1cc(F)c(F)c(F)c1)c1ccc(F)cc1O ZINC000850580535 1136292187 /nfs/dbraw/zinc/29/21/87/1136292187.db2.gz OFZYKMIASQCJMX-HOCLYGCPSA-N 1 1 343.320 3.723 20 10 EHCDMO CCOCc1cc(CN[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1OC ZINC000747854589 1136326075 /nfs/dbraw/zinc/32/60/75/1136326075.db2.gz PYWHFEQCZCRIIB-KSZLIROESA-N 1 1 348.531 3.688 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](C)CN2C[C@H](C)C[C@H](C)C2)ccc1OC ZINC000747854589 1136326078 /nfs/dbraw/zinc/32/60/78/1136326078.db2.gz PYWHFEQCZCRIIB-KSZLIROESA-N 1 1 348.531 3.688 20 10 EHCDMO COC[C@H](C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1)OC ZINC000851880076 1136415582 /nfs/dbraw/zinc/41/55/82/1136415582.db2.gz SVUAQRJGZMHTKP-APWZRJJASA-N 1 1 329.440 3.617 20 10 EHCDMO Cc1cc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c(C)n1-c1ccccc1C ZINC000110694246 1136467831 /nfs/dbraw/zinc/46/78/31/1136467831.db2.gz VCOMOLFKIPDPTC-MRXNPFEDSA-N 1 1 339.483 3.615 20 10 EHCDMO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)C[N@@H+](C)Cc1ccccc1O ZINC000111236371 1136525097 /nfs/dbraw/zinc/52/50/97/1136525097.db2.gz YWACXPRXVWIHGM-AWEZNQCLSA-N 1 1 346.858 3.697 20 10 EHCDMO Cc1cccc(C)c1[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@H]2O ZINC000853522003 1136540490 /nfs/dbraw/zinc/54/04/90/1136540490.db2.gz ICMCWSYPCNWIGO-IEBWSBKVSA-N 1 1 339.435 3.772 20 10 EHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)ccc1N(C)C ZINC000815033705 1136543372 /nfs/dbraw/zinc/54/33/72/1136543372.db2.gz QHZFPPONAKVNEW-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)ccc1N(C)C ZINC000815033705 1136543376 /nfs/dbraw/zinc/54/33/76/1136543376.db2.gz QHZFPPONAKVNEW-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO C[N@@H+](CC1=CCCOC1)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000853561503 1136544137 /nfs/dbraw/zinc/54/41/37/1136544137.db2.gz GIYMXJMVYDYWAC-UHFFFAOYSA-N 1 1 327.424 3.796 20 10 EHCDMO COC1(CC[NH2+]Cc2cc(C)cc(Br)c2O)CCC1 ZINC000815148038 1136562171 /nfs/dbraw/zinc/56/21/71/1136562171.db2.gz KAJAAMUMNADAFZ-UHFFFAOYSA-N 1 1 328.250 3.512 20 10 EHCDMO CC[C@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000854222748 1136599218 /nfs/dbraw/zinc/59/92/18/1136599218.db2.gz LJBGAJXFRFJQNI-NZSAHSFTSA-N 1 1 328.431 3.718 20 10 EHCDMO CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1[O-] ZINC000854230060 1136600305 /nfs/dbraw/zinc/60/03/05/1136600305.db2.gz FQUXMQWDFXFBMM-ZIAGYGMSSA-N 1 1 329.282 3.569 20 10 EHCDMO CC[C@@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)N1CCCC1 ZINC000815559107 1136610682 /nfs/dbraw/zinc/61/06/82/1136610682.db2.gz XXYVFKXDBZHGAX-OLZOCXBDSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)N1CCCCC1 ZINC000815562483 1136610764 /nfs/dbraw/zinc/61/07/64/1136610764.db2.gz GPCYWSYENROBII-STQMWFEESA-N 1 1 330.394 3.936 20 10 EHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C[C@@H]1OCCc2ccccc21 ZINC000816495817 1136725163 /nfs/dbraw/zinc/72/51/63/1136725163.db2.gz KMXFOPVHIXQZEG-SFHVURJKSA-N 1 1 335.806 3.931 20 10 EHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)C[C@@H]1OCCc2ccccc21 ZINC000816495817 1136725165 /nfs/dbraw/zinc/72/51/65/1136725165.db2.gz KMXFOPVHIXQZEG-SFHVURJKSA-N 1 1 335.806 3.931 20 10 EHCDMO CN(C)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1cccc(F)c1 ZINC000816528683 1136730132 /nfs/dbraw/zinc/73/01/32/1136730132.db2.gz MYGOKYAJZDDGSA-INIZCTEOSA-N 1 1 340.801 3.716 20 10 EHCDMO CCOC(=O)CC[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521565 1136733048 /nfs/dbraw/zinc/73/30/48/1136733048.db2.gz SHPUHRUSHBPWPQ-GFCCVEGCSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521565 1136733051 /nfs/dbraw/zinc/73/30/51/1136733051.db2.gz SHPUHRUSHBPWPQ-GFCCVEGCSA-N 1 1 343.826 3.740 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](O)c1c(F)cccc1Cl ZINC000816553352 1136736235 /nfs/dbraw/zinc/73/62/35/1136736235.db2.gz RQIUEFFBMRTCDW-CQSZACIVSA-N 1 1 348.176 3.800 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](Cn1cccn1)c1ccccc1 ZINC000816553387 1136736321 /nfs/dbraw/zinc/73/63/21/1136736321.db2.gz UBPGVFJTBFRRHL-KRWDZBQOSA-N 1 1 345.805 3.912 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000816616663 1136742664 /nfs/dbraw/zinc/74/26/64/1136742664.db2.gz CAURVCYIMWPRIY-GFCCVEGCSA-N 1 1 338.785 3.692 20 10 EHCDMO CN1CCC[C@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642837 1136743926 /nfs/dbraw/zinc/74/39/26/1136743926.db2.gz MWCWOTIYBPDJAC-QFIPXVFZSA-N 1 1 336.479 3.977 20 10 EHCDMO CN1CCC[C@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642837 1136743929 /nfs/dbraw/zinc/74/39/29/1136743929.db2.gz MWCWOTIYBPDJAC-QFIPXVFZSA-N 1 1 336.479 3.977 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2cc(C)nc(C)c2)c1 ZINC000817409531 1136805697 /nfs/dbraw/zinc/80/56/97/1136805697.db2.gz DJHCIOHECJBOCQ-UHFFFAOYSA-N 1 1 335.245 3.765 20 10 EHCDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000817412850 1136806150 /nfs/dbraw/zinc/80/61/50/1136806150.db2.gz POADQZDDWWIXIB-WMZOPIPTSA-N 1 1 344.524 3.835 20 10 EHCDMO CC[C@H]1C[C@@H]([NH2+]Cc2cc(C)cc(Br)c2O)CCO1 ZINC000817415809 1136806608 /nfs/dbraw/zinc/80/66/08/1136806608.db2.gz ZNQZIRWAKRIBNG-STQMWFEESA-N 1 1 328.250 3.510 20 10 EHCDMO CCCN1C[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CC1=O ZINC000817588976 1136826958 /nfs/dbraw/zinc/82/69/58/1136826958.db2.gz KMDPMGJMVOYHPX-GHMZBOCLSA-N 1 1 345.270 3.608 20 10 EHCDMO CCOc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938487 1136847180 /nfs/dbraw/zinc/84/71/80/1136847180.db2.gz LGOUQTGZGTWRSS-QRWLVFNGSA-N 1 1 327.472 3.502 20 10 EHCDMO CSc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1F ZINC000817943593 1136849016 /nfs/dbraw/zinc/84/90/16/1136849016.db2.gz VSWYRORWTHRJAO-ACJLOTCBSA-N 1 1 347.503 3.964 20 10 EHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000817943526 1136849033 /nfs/dbraw/zinc/84/90/33/1136849033.db2.gz UXCYUKXFKOEYMA-DYVFJYSZSA-N 1 1 340.496 3.713 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1[O-] ZINC000817948449 1136850410 /nfs/dbraw/zinc/85/04/10/1136850410.db2.gz KGXCMYIXQDGODK-LBPRGKRZSA-N 1 1 349.272 3.507 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1[O-] ZINC000817969507 1136853587 /nfs/dbraw/zinc/85/35/87/1136853587.db2.gz VKYPJDLNBVOJMM-NSHDSACASA-N 1 1 347.256 3.609 20 10 EHCDMO COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)c3ccc(F)cc3O)C2)cc1 ZINC000818342208 1136871958 /nfs/dbraw/zinc/87/19/58/1136871958.db2.gz NHXWNRNOEZLHNB-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC000858090517 1136938877 /nfs/dbraw/zinc/93/88/77/1136938877.db2.gz HZNAWEVSRHLUAM-GFCCVEGCSA-N 1 1 347.409 3.840 20 10 EHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC000858090521 1136938882 /nfs/dbraw/zinc/93/88/82/1136938882.db2.gz HZNAWEVSRHLUAM-LBPRGKRZSA-N 1 1 347.409 3.840 20 10 EHCDMO CC(C)[N@H+](Cc1ccccn1)Cc1c(O)cccc1Br ZINC000862229591 1137133564 /nfs/dbraw/zinc/13/35/64/1137133564.db2.gz HBWGFZYTXORTIP-UHFFFAOYSA-N 1 1 335.245 3.960 20 10 EHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1c(O)cccc1Br ZINC000862229591 1137133566 /nfs/dbraw/zinc/13/35/66/1137133566.db2.gz HBWGFZYTXORTIP-UHFFFAOYSA-N 1 1 335.245 3.960 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597975 1137144667 /nfs/dbraw/zinc/14/46/67/1137144667.db2.gz YKJLZAZSTKXHKC-CQSZACIVSA-N 1 1 343.471 3.801 20 10 EHCDMO COc1cc(C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597975 1137144668 /nfs/dbraw/zinc/14/46/68/1137144668.db2.gz YKJLZAZSTKXHKC-CQSZACIVSA-N 1 1 343.471 3.801 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)c(O)c(C(C)(C)C)c1 ZINC000824597975 1137144669 /nfs/dbraw/zinc/14/46/69/1137144669.db2.gz YKJLZAZSTKXHKC-CQSZACIVSA-N 1 1 343.471 3.801 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000862473309 1137146049 /nfs/dbraw/zinc/14/60/49/1137146049.db2.gz NKFXYCIRVKDPEX-OLZOCXBDSA-N 1 1 342.302 3.933 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000862473309 1137146051 /nfs/dbraw/zinc/14/60/51/1137146051.db2.gz NKFXYCIRVKDPEX-OLZOCXBDSA-N 1 1 342.302 3.933 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1O ZINC000824696982 1137147212 /nfs/dbraw/zinc/14/72/12/1137147212.db2.gz WXJVMCKVEGRIOB-BZUAXINKSA-N 1 1 339.863 3.570 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)c(O)c1 ZINC000824690771 1137148526 /nfs/dbraw/zinc/14/85/26/1137148526.db2.gz LIJZFYAXLLHLII-QGZVFWFLSA-N 1 1 335.831 3.610 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)NCc2cc(C)ccc2O)cc1)C(C)C ZINC000862758815 1137156084 /nfs/dbraw/zinc/15/60/84/1137156084.db2.gz MMOSTOIJJSCDSD-UHFFFAOYSA-N 1 1 340.467 3.861 20 10 EHCDMO Cc1[nH+]cc(CN2CCCc3cc(OC(F)(F)F)ccc32)n1C ZINC000825461870 1137178654 /nfs/dbraw/zinc/17/86/54/1137178654.db2.gz RASZLCNSITXFJR-UHFFFAOYSA-N 1 1 325.334 3.580 20 10 EHCDMO C[C@@H](CCO)[N@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000844447669 1137220853 /nfs/dbraw/zinc/22/08/53/1137220853.db2.gz QWMKZPULAQJJKJ-HNNXBMFYSA-N 1 1 340.427 3.743 20 10 EHCDMO C[C@@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000844447669 1137220855 /nfs/dbraw/zinc/22/08/55/1137220855.db2.gz QWMKZPULAQJJKJ-HNNXBMFYSA-N 1 1 340.427 3.743 20 10 EHCDMO Cn1c2ccc(C(F)(F)F)cc2nc1C[N@H+](C)Cc1ccccc1O ZINC000120047406 1137227581 /nfs/dbraw/zinc/22/75/81/1137227581.db2.gz MEQAPJBIUHJMIP-UHFFFAOYSA-N 1 1 349.356 3.930 20 10 EHCDMO Cn1c2ccc(C(F)(F)F)cc2nc1C[N@@H+](C)Cc1ccccc1O ZINC000120047406 1137227582 /nfs/dbraw/zinc/22/75/82/1137227582.db2.gz MEQAPJBIUHJMIP-UHFFFAOYSA-N 1 1 349.356 3.930 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@]2(CCOC2)O1 ZINC000794690579 1137233922 /nfs/dbraw/zinc/23/39/22/1137233922.db2.gz BKUWLDDIPLZBGJ-UWJYYQICSA-N 1 1 347.499 3.768 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@@]2(CCOC2)O1 ZINC000794690569 1137233928 /nfs/dbraw/zinc/23/39/28/1137233928.db2.gz BKUWLDDIPLZBGJ-DYESRHJHSA-N 1 1 347.499 3.768 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000844760670 1137250239 /nfs/dbraw/zinc/25/02/39/1137250239.db2.gz RRBJOEHYVZANMI-KRWDZBQOSA-N 1 1 325.399 3.929 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001144293941 1137267661 /nfs/dbraw/zinc/26/76/61/1137267661.db2.gz WLARNXMJEBBDSA-GHMZBOCLSA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001144293941 1137267662 /nfs/dbraw/zinc/26/76/62/1137267662.db2.gz WLARNXMJEBBDSA-GHMZBOCLSA-N 1 1 328.225 3.916 20 10 EHCDMO Oc1cc(F)c(Br)cc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001144299251 1137268423 /nfs/dbraw/zinc/26/84/23/1137268423.db2.gz TVWRKHZVHBHZEE-QWRGUYRKSA-N 1 1 328.225 3.916 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1c(O)cc(O)cc1O ZINC001144500483 1137301204 /nfs/dbraw/zinc/30/12/04/1137301204.db2.gz UUHUYQBHUXDGOG-UHFFFAOYSA-N 1 1 328.195 3.742 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000773009252 1137458726 /nfs/dbraw/zinc/45/87/26/1137458726.db2.gz NHRSEZSRHREKKG-ACJLOTCBSA-N 1 1 334.410 3.805 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@H]1CCc3c(F)cccc3C1)CCC2 ZINC001171442846 1137486038 /nfs/dbraw/zinc/48/60/38/1137486038.db2.gz TUCCPKIGWOWMCG-INIZCTEOSA-N 1 1 327.399 3.543 20 10 EHCDMO C[N@H+](Cc1ccc(Cl)nc1)Cc1cccc(Br)c1O ZINC000125742619 1137643568 /nfs/dbraw/zinc/64/35/68/1137643568.db2.gz SUNCTWLCINKCOQ-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cccc(Br)c1O ZINC000125742619 1137643569 /nfs/dbraw/zinc/64/35/69/1137643569.db2.gz SUNCTWLCINKCOQ-UHFFFAOYSA-N 1 1 341.636 3.835 20 10 EHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876590348 1137656383 /nfs/dbraw/zinc/65/63/83/1137656383.db2.gz UIYIENDKUAKLOF-OAHLLOKOSA-N 1 1 330.497 3.902 20 10 EHCDMO C[N@@H+](Cc1c(C(F)(F)F)nc2n1CCCC2)Cc1ccccc1O ZINC000876616527 1137657152 /nfs/dbraw/zinc/65/71/52/1137657152.db2.gz YVLJRGCVEWGLJR-UHFFFAOYSA-N 1 1 339.361 3.576 20 10 EHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876797264 1137661738 /nfs/dbraw/zinc/66/17/38/1137661738.db2.gz SXIUQHGLSLJYSJ-UYAOXDASSA-N 1 1 348.556 3.754 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC[C@](CO)(Cc3ccccc3)C2)c(O)c1 ZINC000877544761 1137680714 /nfs/dbraw/zinc/68/07/14/1137680714.db2.gz WOOPSSBPURDUDT-NRFANRHFSA-N 1 1 325.452 3.518 20 10 EHCDMO Cc1ccc(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)cc1C ZINC000877577397 1137681982 /nfs/dbraw/zinc/68/19/82/1137681982.db2.gz WXOXTZHGSMHJMZ-UHFFFAOYSA-N 1 1 338.495 3.897 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@H](C4CCCC4)C3)cc2)CC1 ZINC000877594826 1137682464 /nfs/dbraw/zinc/68/24/64/1137682464.db2.gz KNMXVNNHZBDUSV-IBGZPJMESA-N 1 1 328.500 3.660 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@H](C4CCC4)C3)cc2)CC1 ZINC000877638788 1137683937 /nfs/dbraw/zinc/68/39/37/1137683937.db2.gz NZDIIJKXXUIODT-IBGZPJMESA-N 1 1 328.500 3.660 20 10 EHCDMO CC(=O)Nc1cccc2c1C[N@H+](Cc1c(O)cccc1Cl)CC2 ZINC000877681607 1137685600 /nfs/dbraw/zinc/68/56/00/1137685600.db2.gz QJOOOFSIHZBFQJ-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO CC(=O)Nc1cccc2c1C[N@@H+](Cc1c(O)cccc1Cl)CC2 ZINC000877681607 1137685601 /nfs/dbraw/zinc/68/56/01/1137685601.db2.gz QJOOOFSIHZBFQJ-UHFFFAOYSA-N 1 1 330.815 3.562 20 10 EHCDMO COc1cc(Cl)cc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000877758508 1137688461 /nfs/dbraw/zinc/68/84/61/1137688461.db2.gz GEKPWAXHINBSDD-CQSZACIVSA-N 1 1 327.758 3.994 20 10 EHCDMO Oc1c(C[N@H+]2CCO[C@H](C(F)(F)F)CC2)ccc2ccccc21 ZINC000877821765 1137691661 /nfs/dbraw/zinc/69/16/61/1137691661.db2.gz NABPHCXMRYOELT-HNNXBMFYSA-N 1 1 325.330 3.699 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cncc(C)c2)c1O ZINC000879748222 1137757677 /nfs/dbraw/zinc/75/76/77/1137757677.db2.gz ACKNNHIUQSURML-GOSISDBHSA-N 1 1 328.387 3.774 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cncc(C)c2)c1O ZINC000879748222 1137757678 /nfs/dbraw/zinc/75/76/78/1137757678.db2.gz ACKNNHIUQSURML-GOSISDBHSA-N 1 1 328.387 3.774 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cncc(C)c2)c1O ZINC000879748224 1137757686 /nfs/dbraw/zinc/75/76/86/1137757686.db2.gz ACKNNHIUQSURML-SFHVURJKSA-N 1 1 328.387 3.774 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H]2c2cncc(C)c2)c1O ZINC000879748224 1137757687 /nfs/dbraw/zinc/75/76/87/1137757687.db2.gz ACKNNHIUQSURML-SFHVURJKSA-N 1 1 328.387 3.774 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130670520 1137840586 /nfs/dbraw/zinc/84/05/86/1137840586.db2.gz JWLKCQFJJOGZIG-MGPUTAFESA-N 1 1 327.424 3.753 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)c1cccs1 ZINC000883289336 1137852883 /nfs/dbraw/zinc/85/28/83/1137852883.db2.gz LEKPYGSKORAYES-SFHVURJKSA-N 1 1 329.513 3.741 20 10 EHCDMO COC(=O)c1cc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)oc1C ZINC000028793171 1137869712 /nfs/dbraw/zinc/86/97/12/1137869712.db2.gz HAMMUAILKDEHOE-UHFFFAOYSA-N 1 1 339.391 3.865 20 10 EHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000111911747 1137906095 /nfs/dbraw/zinc/90/60/95/1137906095.db2.gz BFMBPVRFYMOTEI-MRXNPFEDSA-N 1 1 336.439 3.783 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc2c(c1)CCC(=O)N2 ZINC000886505019 1138085465 /nfs/dbraw/zinc/08/54/65/1138085465.db2.gz FCZFRYFXUAWMMW-NEPJUHHUSA-N 1 1 328.387 3.828 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1c(O)cccc1F ZINC000886539439 1138093109 /nfs/dbraw/zinc/09/31/09/1138093109.db2.gz ZLSNGGDEGPJRMG-RYUDHWBXSA-N 1 1 335.810 3.509 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1c(O)cccc1F ZINC000886558664 1138096850 /nfs/dbraw/zinc/09/68/50/1138096850.db2.gz PDZOLEWLGGGZFY-VFZGTOFNSA-N 1 1 327.758 3.708 20 10 EHCDMO COCCCOc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886608792 1138101460 /nfs/dbraw/zinc/10/14/60/1138101460.db2.gz GBFBPBUJLLCWIN-CQSZACIVSA-N 1 1 333.403 3.797 20 10 EHCDMO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3F)no2)c1 ZINC000886714168 1138123727 /nfs/dbraw/zinc/12/37/27/1138123727.db2.gz CYXHDFSDXSMIGE-CYBMUJFWSA-N 1 1 341.386 3.664 20 10 EHCDMO CCn1cc(C[N@H+](Cc2ccccc2O)[C@H](C)c2ccccc2)nn1 ZINC000887546208 1138411108 /nfs/dbraw/zinc/41/11/08/1138411108.db2.gz GLFGSARMNDGBOO-MRXNPFEDSA-N 1 1 336.439 3.767 20 10 EHCDMO CCn1cc(C[N@@H+](Cc2ccccc2O)[C@H](C)c2ccccc2)nn1 ZINC000887546208 1138411110 /nfs/dbraw/zinc/41/11/10/1138411110.db2.gz GLFGSARMNDGBOO-MRXNPFEDSA-N 1 1 336.439 3.767 20 10 EHCDMO COCc1cccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000179236262 1139744982 /nfs/dbraw/zinc/74/49/82/1139744982.db2.gz IQLBHNAZMWWBBA-HXUWFJFHSA-N 1 1 341.451 3.720 20 10 EHCDMO COCCOCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179643143 1139771558 /nfs/dbraw/zinc/77/15/58/1139771558.db2.gz RLQQWCAKCVKRAV-KRWDZBQOSA-N 1 1 329.440 3.618 20 10 EHCDMO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185050951 1140133746 /nfs/dbraw/zinc/13/37/46/1140133746.db2.gz UZQKCPHHMJBRBE-UONOGXRCSA-N 1 1 344.430 3.910 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)c1ccc(F)cc1O ZINC000186148412 1140189040 /nfs/dbraw/zinc/18/90/40/1140189040.db2.gz ZHHCLFJHNUTFHN-KSSFIOAISA-N 1 1 331.431 3.984 20 10 EHCDMO Cc1cc(O)c(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)cc1C ZINC000191593612 1140474050 /nfs/dbraw/zinc/47/40/50/1140474050.db2.gz KAWQKZFFIPUXQI-OAHLLOKOSA-N 1 1 337.423 3.834 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193824046 1140588012 /nfs/dbraw/zinc/58/80/12/1140588012.db2.gz WHNIMOSFLOCGHB-UHFFFAOYSA-N 1 1 345.355 3.621 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1OC ZINC000271072413 1141304586 /nfs/dbraw/zinc/30/45/86/1141304586.db2.gz FQCPLDHVIBZNPL-AWEZNQCLSA-N 1 1 331.387 3.538 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)cc1F ZINC000271224774 1141328301 /nfs/dbraw/zinc/32/83/01/1141328301.db2.gz ACKRIICHIPLTGF-MAUKXSAKSA-N 1 1 332.419 3.573 20 10 EHCDMO CCCC[N@@H+](Cc1c[nH]nc1-c1cccnc1)Cc1ccccc1O ZINC000283081782 1141550305 /nfs/dbraw/zinc/55/03/05/1141550305.db2.gz REZNPVXFVIXUQI-UHFFFAOYSA-N 1 1 336.439 3.980 20 10 EHCDMO COc1ccc(O)c(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000274593796 1014289871 /nfs/dbraw/zinc/28/98/71/1014289871.db2.gz KIBPHKSSNKOTHR-MRVPVSSYSA-N 1 1 332.347 3.727 20 10 EHCDMO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000799729866 1014861121 /nfs/dbraw/zinc/86/11/21/1014861121.db2.gz UPKWVSXMKCEERH-DVJZZOLTSA-N 1 1 346.240 3.902 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H](O)c1c(F)cccc1F)c1ccc(F)cc1O ZINC000796817042 1014899860 /nfs/dbraw/zinc/89/98/60/1014899860.db2.gz LYIZCTXGHNPMMG-GDBMZVCRSA-N 1 1 325.330 3.584 20 10 EHCDMO COc1ccc2c(c1)C[C@@H]([N@@H+](C)Cc1ccc(N3CCCC3)cc1)C2 ZINC001168280057 1032836178 /nfs/dbraw/zinc/83/61/78/1032836178.db2.gz LRCPLYMGTOLKIK-NRFANRHFSA-N 1 1 336.479 3.895 20 10 EHCDMO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cc(Cl)c(F)cc1O ZINC000835077790 1023408335 /nfs/dbraw/zinc/40/83/35/1023408335.db2.gz VDEAOBXBHVFXCP-UHFFFAOYSA-N 1 1 325.815 3.576 20 10 EHCDMO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cc(Cl)c(F)cc1O ZINC000835077790 1023408342 /nfs/dbraw/zinc/40/83/42/1023408342.db2.gz VDEAOBXBHVFXCP-UHFFFAOYSA-N 1 1 325.815 3.576 20 10 EHCDMO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2O)c2ccccc2)n1 ZINC000277213627 1024227482 /nfs/dbraw/zinc/22/74/82/1024227482.db2.gz WXZXAXFJDYAIBO-YVEFUNNKSA-N 1 1 341.386 3.857 20 10 EHCDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 ZINC000729545333 1024658844 /nfs/dbraw/zinc/65/88/44/1024658844.db2.gz UUXSLGAIQCVGOH-SJORKVTESA-N 1 1 345.531 3.610 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)c(O)c1OC ZINC000892154424 1025051344 /nfs/dbraw/zinc/05/13/44/1025051344.db2.gz YEQMSGSSGBLLGD-ZFWWWQNUSA-N 1 1 331.412 3.976 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1ccc(F)cc1O ZINC000281597077 1025253754 /nfs/dbraw/zinc/25/37/54/1025253754.db2.gz LYGPXFUYMBANCN-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCCSC[C@H]3C)cc2)CC1 ZINC000934297589 1025316092 /nfs/dbraw/zinc/31/60/92/1025316092.db2.gz IMQXGESDVHBITF-MRXNPFEDSA-N 1 1 334.529 3.629 20 10 EHCDMO Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2c(O)cccc2F)c(C)c1 ZINC000896636747 1025790155 /nfs/dbraw/zinc/79/01/55/1025790155.db2.gz GTMUPFJCTFOZDT-AWEZNQCLSA-N 1 1 330.403 3.655 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)ccc1F ZINC000121307085 1027393865 /nfs/dbraw/zinc/39/38/65/1027393865.db2.gz LSLXXWFIJYVSMK-UHFFFAOYSA-N 1 1 328.431 3.603 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1 ZINC000273364215 1027394593 /nfs/dbraw/zinc/39/45/93/1027394593.db2.gz AZAYVHXUHLDHJX-KSSFIOAISA-N 1 1 342.439 3.930 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCOc3ccccc32)c1 ZINC000273368944 1027398222 /nfs/dbraw/zinc/39/82/22/1027398222.db2.gz CBZAMABDJBXYLK-SUMWQHHRSA-N 1 1 341.407 3.743 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3nc(C)cs3)C2)c1 ZINC000897299073 1027401329 /nfs/dbraw/zinc/40/13/29/1027401329.db2.gz UBQFGHMGVMOVPE-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000273584234 1027505894 /nfs/dbraw/zinc/50/58/94/1027505894.db2.gz NHRAEBHFSGGVLF-DIFFPNOSSA-N 1 1 329.371 3.656 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000359879022 1027868047 /nfs/dbraw/zinc/86/80/47/1027868047.db2.gz YYVNJXBPSOXZMU-HZUJVAHNSA-N 1 1 340.467 3.744 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@H](C)Sc2ccccc2)ccc1[N+](=O)[O-] ZINC000278554506 1031360935 /nfs/dbraw/zinc/36/09/35/1031360935.db2.gz ZQPVBRWIRJNYTA-LBPRGKRZSA-N 1 1 348.424 3.579 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccc(C)cc1C)Cc1ccccc1O ZINC000170779334 1033601238 /nfs/dbraw/zinc/60/12/38/1033601238.db2.gz UFZOPKWOSXQIOC-UHFFFAOYSA-N 1 1 326.440 3.860 20 10 EHCDMO Oc1c(F)cccc1C[NH+]1CCC(OCc2ccccc2F)CC1 ZINC000373110158 1034879384 /nfs/dbraw/zinc/87/93/84/1034879384.db2.gz BWEABBGOPHVNSM-UHFFFAOYSA-N 1 1 333.378 3.852 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(I)cc2O)[C@@H]1C ZINC001232979123 1035638256 /nfs/dbraw/zinc/63/82/56/1035638256.db2.gz SKTGMPFCSLYLRH-GHMZBOCLSA-N 1 1 345.224 3.617 20 10 EHCDMO COc1ccc(CCC[NH2+][C@H](C)c2ccc(F)cc2O)cc1OC ZINC000185147366 1039029466 /nfs/dbraw/zinc/02/94/66/1039029466.db2.gz VJBIDSXATWFCKB-CYBMUJFWSA-N 1 1 333.403 3.832 20 10 EHCDMO CSc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)o1 ZINC000893879038 1039786144 /nfs/dbraw/zinc/78/61/44/1039786144.db2.gz CGIRUBCVEYJQIA-HNNXBMFYSA-N 1 1 333.453 3.888 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000893986266 1039941157 /nfs/dbraw/zinc/94/11/57/1039941157.db2.gz JMCLCKBZEFIGQL-UHFFFAOYSA-N 1 1 325.399 3.984 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000894052689 1040015233 /nfs/dbraw/zinc/01/52/33/1040015233.db2.gz DSAGYXJHFWQUOO-HNNXBMFYSA-N 1 1 333.378 3.709 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000894052689 1040015246 /nfs/dbraw/zinc/01/52/46/1040015246.db2.gz DSAGYXJHFWQUOO-HNNXBMFYSA-N 1 1 333.378 3.709 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)ccc1N1CCCCC1 ZINC000828035733 1040310071 /nfs/dbraw/zinc/31/00/71/1040310071.db2.gz AGCGSFJGEAJATF-TZIWHRDSSA-N 1 1 328.500 3.986 20 10 EHCDMO COc1cc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000164048380 1041140550 /nfs/dbraw/zinc/14/05/50/1041140550.db2.gz JBLZDLBJZYHXEN-CQSZACIVSA-N 1 1 333.472 3.699 20 10 EHCDMO COc1ccc(CNc2c(C)cc([NH+](C)C)cc2C)c(O)c1OC ZINC000893587650 1042769774 /nfs/dbraw/zinc/76/97/74/1042769774.db2.gz HQFULVYIGFWIPT-UHFFFAOYSA-N 1 1 330.428 3.704 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000734446733 1131236795 /nfs/dbraw/zinc/23/67/95/1131236795.db2.gz CRGUQLWXKXSRMN-INIZCTEOSA-N 1 1 345.512 3.569 20 10 EHCDMO CCC[N@@H+](CCC(=O)Nc1ccccc1C)Cc1ccccc1O ZINC000072597752 1126794110 /nfs/dbraw/zinc/79/41/10/1126794110.db2.gz UQTJSDQARYTLMZ-UHFFFAOYSA-N 1 1 326.440 3.941 20 10 EHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N1CCc2sccc2C1 ZINC000185174124 1126803381 /nfs/dbraw/zinc/80/33/81/1126803381.db2.gz SNYXDVJVPDYDNS-STQMWFEESA-N 1 1 334.460 3.690 20 10 EHCDMO C[C@@H]([NH2+]CCOCC1CCC1)c1cc(Br)c(F)cc1O ZINC000765805912 1128410586 /nfs/dbraw/zinc/41/05/86/1128410586.db2.gz ALGKRXPAQMYWAZ-SNVBAGLBSA-N 1 1 346.240 3.761 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H](Cn3ccnn3)C2)c(O)c(C(C)(C)C)c1 ZINC000154999701 1123077625 /nfs/dbraw/zinc/07/76/25/1123077625.db2.gz HIKKKTMRNAHLCW-MRXNPFEDSA-N 1 1 342.487 3.502 20 10 EHCDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000921052944 1123458792 /nfs/dbraw/zinc/45/87/92/1123458792.db2.gz HNTVKAKDMBPDEQ-IRXDYDNUSA-N 1 1 332.488 3.526 20 10 EHCDMO Cc1cc([NH+]2CCCC2)ccc1NCc1cc2c(cc1O)OCO2 ZINC000237673164 1123805218 /nfs/dbraw/zinc/80/52/18/1123805218.db2.gz ZLIGTFQXFUABQP-UHFFFAOYSA-N 1 1 326.396 3.642 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000180275041 1123975386 /nfs/dbraw/zinc/97/53/86/1123975386.db2.gz NSLMDRPPXAJWDW-HKUYNNGSSA-N 1 1 333.378 3.759 20 10 EHCDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(OC)c(OC)cc1O ZINC000180444693 1124011949 /nfs/dbraw/zinc/01/19/49/1124011949.db2.gz GCONUHOCXYSTKL-QGZVFWFLSA-N 1 1 329.440 3.863 20 10 EHCDMO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cs1 ZINC000182413473 1125276453 /nfs/dbraw/zinc/27/64/53/1125276453.db2.gz DUPHHBISDGHFFP-VXGBXAGGSA-N 1 1 336.457 3.806 20 10 EHCDMO CCO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cs1 ZINC000182413434 1125277037 /nfs/dbraw/zinc/27/70/37/1125277037.db2.gz DUPHHBISDGHFFP-NWDGAFQWSA-N 1 1 336.457 3.806 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H](C)c2cn(C)nn2)cc1 ZINC000922636267 1129609463 /nfs/dbraw/zinc/60/94/63/1129609463.db2.gz KFEXYWLXAQHVLK-QGZVFWFLSA-N 1 1 349.482 3.692 20 10 EHCDMO C[C@@H]1Cc2cc(C[NH2+]Cc3cccc(Br)c3O)ccc2O1 ZINC000922702503 1129637180 /nfs/dbraw/zinc/63/71/80/1129637180.db2.gz MUDBLBMZVHFHEL-LLVKDONJSA-N 1 1 348.240 3.768 20 10 EHCDMO CCc1noc([C@H]2CC[C@@H]([NH2+]Cc3c(O)ccc(Cl)c3F)C2)n1 ZINC000922866056 1129694835 /nfs/dbraw/zinc/69/48/35/1129694835.db2.gz ZAHBHYAVHDLHRF-VHSXEESVSA-N 1 1 339.798 3.556 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccc(SC)cc1)Cc1ccccc1O ZINC000727830839 1130598588 /nfs/dbraw/zinc/59/85/88/1130598588.db2.gz QILHDHNQKKKWEJ-UHFFFAOYSA-N 1 1 344.480 3.965 20 10 EHCDMO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000733298423 1131018281 /nfs/dbraw/zinc/01/82/81/1131018281.db2.gz GOXFFULXZYLMAR-FQEVSTJZSA-N 1 1 325.408 3.675 20 10 EHCDMO C[C@@H]1SCC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1c1ccccc1 ZINC000738259152 1131464983 /nfs/dbraw/zinc/46/49/83/1131464983.db2.gz SVYJEHFQQUDBNT-DJJJIMSYSA-N 1 1 343.448 3.800 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c(C)n1-c1ccccc1C ZINC000741718771 1131636715 /nfs/dbraw/zinc/63/67/15/1131636715.db2.gz CEIUURKZGBJUSY-SFHVURJKSA-N 1 1 339.483 3.569 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000743841696 1131980479 /nfs/dbraw/zinc/98/04/79/1131980479.db2.gz SJPNONIHEKDLQZ-UHFFFAOYSA-N 1 1 336.479 3.895 20 10 EHCDMO CC[N@@H+](CCCCCCCO)Cc1cc(Br)ccc1O ZINC000743871033 1131996515 /nfs/dbraw/zinc/99/65/15/1131996515.db2.gz NDHDYHPVNUSTQU-UHFFFAOYSA-N 1 1 344.293 3.919 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)C[C@@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000745983895 1132343049 /nfs/dbraw/zinc/34/30/49/1132343049.db2.gz IEWKEFXPDRJWSB-SFHVURJKSA-N 1 1 340.467 3.635 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)C[C@@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000745983895 1132343057 /nfs/dbraw/zinc/34/30/57/1132343057.db2.gz IEWKEFXPDRJWSB-SFHVURJKSA-N 1 1 340.467 3.635 20 10 EHCDMO CCc1cnccc1[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000773428458 1132520485 /nfs/dbraw/zinc/52/04/85/1132520485.db2.gz POSTUJQAAFDTRA-NSHDSACASA-N 1 1 335.245 3.963 20 10 EHCDMO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C ZINC001169124018 1132665134 /nfs/dbraw/zinc/66/51/34/1132665134.db2.gz PJOJUOCAVOWUQZ-IHSNIMORSA-N 1 1 328.500 3.847 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000768190849 1133110548 /nfs/dbraw/zinc/11/05/48/1133110548.db2.gz CDRIPDVDBMCTBU-KRWDZBQOSA-N 1 1 325.408 3.809 20 10 EHCDMO CN(Cc1c(O)cccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768243062 1133120367 /nfs/dbraw/zinc/12/03/67/1133120367.db2.gz GUCXGGWMWMBPBX-INIZCTEOSA-N 1 1 330.859 3.752 20 10 EHCDMO CNC(=O)c1ccc(C[N@@H+](Cc2c(O)cccc2Cl)C2CC2)cc1 ZINC000768423784 1133137300 /nfs/dbraw/zinc/13/73/00/1133137300.db2.gz VXXVYBMTJYCMOD-UHFFFAOYSA-N 1 1 344.842 3.570 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1CC1CCCCC1)[C@H](O)CO2 ZINC000768443601 1133140314 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3.541 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2cc(OC)cc(OC)c2)cc1 ZINC000773748983 1133177406 /nfs/dbraw/zinc/17/74/06/1133177406.db2.gz IBCAEWHUTFIKIW-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO CC(C)[N@H+](Cc1ccccn1)Cc1cccc(Br)c1O ZINC000768927559 1133205087 /nfs/dbraw/zinc/20/50/87/1133205087.db2.gz YJGPRBNRBNQZSM-UHFFFAOYSA-N 1 1 335.245 3.960 20 10 EHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cccc(Br)c1O ZINC000768927559 1133205094 /nfs/dbraw/zinc/20/50/94/1133205094.db2.gz YJGPRBNRBNQZSM-UHFFFAOYSA-N 1 1 335.245 3.960 20 10 EHCDMO Cc1c2ccccc2n(C)c1C[NH2+]C(C)(C)c1cn(C(C)C)nn1 ZINC001178976774 1133213591 /nfs/dbraw/zinc/21/35/91/1133213591.db2.gz AEAAGNIXTUYXFW-UHFFFAOYSA-N 1 1 325.460 3.684 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccnc4ccccc34)CC2)cc1 ZINC000768997750 1133218396 /nfs/dbraw/zinc/21/83/96/1133218396.db2.gz HBVMKOFZNHEHEC-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCCN(c3ccccc3)CC2)cc1F ZINC000768999839 1133219145 /nfs/dbraw/zinc/21/91/45/1133219145.db2.gz PZNWFPQKLXKESZ-UHFFFAOYSA-N 1 1 327.447 3.604 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cncc4ccccc43)CC2)cc1 ZINC000768999106 1133219366 /nfs/dbraw/zinc/21/93/66/1133219366.db2.gz UDZJOHJPFUYZMF-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769120266 1133229566 /nfs/dbraw/zinc/22/95/66/1133229566.db2.gz JLFSFGPGBREDBK-FQEVSTJZSA-N 1 1 343.515 3.510 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000773805843 1133236598 /nfs/dbraw/zinc/23/65/98/1133236598.db2.gz HJLKTLYSAZWTNX-WIYYLYMNSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000773805843 1133236602 /nfs/dbraw/zinc/23/66/02/1133236602.db2.gz HJLKTLYSAZWTNX-WIYYLYMNSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000773805843 1133236609 /nfs/dbraw/zinc/23/66/09/1133236609.db2.gz HJLKTLYSAZWTNX-WIYYLYMNSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000773805843 1133236616 /nfs/dbraw/zinc/23/66/16/1133236616.db2.gz HJLKTLYSAZWTNX-WIYYLYMNSA-N 1 1 327.516 3.591 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000773805843 1133236622 /nfs/dbraw/zinc/23/66/22/1133236622.db2.gz HJLKTLYSAZWTNX-WIYYLYMNSA-N 1 1 327.516 3.591 20 10 EHCDMO CC(C)(C)[N@H+]1CCCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769186651 1133241097 /nfs/dbraw/zinc/24/10/97/1133241097.db2.gz KCHCXXDOWBVAIG-UHFFFAOYSA-N 1 1 329.532 3.983 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000769214175 1133245958 /nfs/dbraw/zinc/24/59/58/1133245958.db2.gz SRVCDRROJNVRBQ-KBPBESRZSA-N 1 1 338.879 3.562 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1 ZINC000769311093 1133258540 /nfs/dbraw/zinc/25/85/40/1133258540.db2.gz LWEBYNSSBAEGFQ-KRWDZBQOSA-N 1 1 325.408 3.809 20 10 EHCDMO O[C@H]([C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1)C(F)(F)F ZINC000769380508 1133272986 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1136543780 /nfs/dbraw/zinc/54/37/80/1136543780.db2.gz OBAMFQRKOKEJCZ-PKOBYXMFSA-N 1 1 329.532 3.804 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)ccc1N(C)C ZINC000815061263 1136545749 /nfs/dbraw/zinc/54/57/49/1136545749.db2.gz OFCAEQPSJPZTHJ-HKUYNNGSSA-N 1 1 328.456 3.742 20 10 EHCDMO C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@](C)(C(F)F)O1 ZINC000853631074 1136551237 /nfs/dbraw/zinc/55/12/37/1136551237.db2.gz SAYRUGNJPGKBGD-VOJFVSQTSA-N 1 1 343.414 3.640 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@](C)(C(F)F)O1 ZINC000853631074 1136551242 /nfs/dbraw/zinc/55/12/42/1136551242.db2.gz SAYRUGNJPGKBGD-VOJFVSQTSA-N 1 1 343.414 3.640 20 10 EHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H](O)Cc1ccc(F)cc1 ZINC000815111973 1136557350 /nfs/dbraw/zinc/55/73/50/1136557350.db2.gz IPFMBSNUNAIZLX-IBGZPJMESA-N 1 1 331.431 3.737 20 10 EHCDMO C[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815555075 1136609851 /nfs/dbraw/zinc/60/98/51/1136609851.db2.gz PBJUEZKJVSVCRY-QWHCGFSZSA-N 1 1 347.377 3.647 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccccc1F)c1cccc(C(F)(F)F)c1O ZINC000815563292 1136611248 /nfs/dbraw/zinc/61/12/48/1136611248.db2.gz YIJUUTOWLDPHJZ-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815576002 1136613099 /nfs/dbraw/zinc/61/30/99/1136613099.db2.gz GUAPZJDBDDAOJJ-UWVGGRQHSA-N 1 1 327.350 3.865 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CSCCS1)c1cccc(C(F)(F)F)c1O ZINC000815587738 1136615520 /nfs/dbraw/zinc/61/55/20/1136615520.db2.gz SDFXSFKUSUDSEW-NXEZZACHSA-N 1 1 337.432 3.910 20 10 EHCDMO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815625807 1136620943 /nfs/dbraw/zinc/62/09/43/1136620943.db2.gz MTELROXVOAGRGB-OLZOCXBDSA-N 1 1 330.394 3.936 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)cc1F ZINC000113332524 1136697456 /nfs/dbraw/zinc/69/74/56/1136697456.db2.gz IZHLPDXULNHRED-UHFFFAOYSA-N 1 1 325.387 3.837 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cccc(O)c3Cl)CC2)cc1 ZINC000816495035 1136724744 /nfs/dbraw/zinc/72/47/44/1136724744.db2.gz HXPUNKOEARGAOK-UHFFFAOYSA-N 1 1 346.858 3.767 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000816520320 1136727196 /nfs/dbraw/zinc/72/71/96/1136727196.db2.gz LZWCVSOCZMHZPD-LRDDRELGSA-N 1 1 339.794 3.866 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000816520320 1136727199 /nfs/dbraw/zinc/72/71/99/1136727199.db2.gz LZWCVSOCZMHZPD-LRDDRELGSA-N 1 1 339.794 3.866 20 10 EHCDMO COc1ccc([C@H](CO)[N@@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816512031 1136729543 /nfs/dbraw/zinc/72/95/43/1136729543.db2.gz UZLYTMSWKYNAOW-FQEVSTJZSA-N 1 1 337.419 3.719 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(OCC2CC2)nc1 ZINC000816545546 1136732523 /nfs/dbraw/zinc/73/25/23/1136732523.db2.gz VFUREBXDGZVQMC-UHFFFAOYSA-N 1 1 336.794 3.658 20 10 EHCDMO CN(CC[NH2+]Cc1cc(Cl)c(F)cc1O)Cc1ccc(F)cc1 ZINC000816556044 1136736291 /nfs/dbraw/zinc/73/62/91/1136736291.db2.gz XUJBOOCCGOXPSZ-UHFFFAOYSA-N 1 1 340.801 3.545 20 10 EHCDMO CCCCn1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(C)n1 ZINC000816560655 1136736555 /nfs/dbraw/zinc/73/65/55/1136736555.db2.gz WNZFWJUHVPBUEY-UHFFFAOYSA-N 1 1 325.815 3.780 20 10 EHCDMO CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816557962 1136736632 /nfs/dbraw/zinc/73/66/32/1136736632.db2.gz HTFGYMFVPCYCTI-ZDUSSCGKSA-N 1 1 328.859 3.642 20 10 EHCDMO Cc1cccc(C)c1NC(=O)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816562028 1136737251 /nfs/dbraw/zinc/73/72/51/1136737251.db2.gz WIBBPZZTUOZMAH-UHFFFAOYSA-N 1 1 336.794 3.530 20 10 EHCDMO C[C@@]1(C[NH2+]Cc2cc(Cl)c(F)cc2O)OCCc2sccc21 ZINC000816615330 1136741651 /nfs/dbraw/zinc/74/16/51/1136741651.db2.gz TVPJVSLVIZLSFX-INIZCTEOSA-N 1 1 341.835 3.824 20 10 EHCDMO CN(C)c1ccc([C@H](N)C[NH2+][C@H]2CCSc3c(F)cccc32)cc1 ZINC000817938911 1136846783 /nfs/dbraw/zinc/84/67/83/1136846783.db2.gz VJYBFJWAEVOYQV-MSOLQXFVSA-N 1 1 345.487 3.718 20 10 EHCDMO CC(C)Oc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938104 1136847453 /nfs/dbraw/zinc/84/74/53/1136847453.db2.gz DPOCEFVYHOFMHW-KKSFZXQISA-N 1 1 341.499 3.890 20 10 EHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000817938918 1136847571 /nfs/dbraw/zinc/84/75/71/1136847571.db2.gz VKIVWTNWZLUODS-FZKQIMNGSA-N 1 1 349.425 3.705 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000817938920 1136847706 /nfs/dbraw/zinc/84/77/06/1136847706.db2.gz VKIVWTNWZLUODS-UGSOOPFHSA-N 1 1 349.425 3.705 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000817940672 1136848456 /nfs/dbraw/zinc/84/84/56/1136848456.db2.gz GOOGTQZDUQOXMF-KPZWWZAWSA-N 1 1 335.854 3.896 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000818357108 1136875744 /nfs/dbraw/zinc/87/57/44/1136875744.db2.gz VPLHUDZFASIJQR-IUCAKERBSA-N 1 1 340.832 3.701 20 10 EHCDMO COC[C@@H]([NH2+]Cc1c(O)cccc1Br)c1ccc(C)o1 ZINC000858147893 1136944131 /nfs/dbraw/zinc/94/41/31/1136944131.db2.gz CXZABJHHQVZGOR-CYBMUJFWSA-N 1 1 340.217 3.533 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccnc(C(F)(F)F)c2)cc1F ZINC000858171309 1136946205 /nfs/dbraw/zinc/94/62/05/1136946205.db2.gz PAYDGMOJTVAEST-UHFFFAOYSA-N 1 1 345.315 3.734 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)c1cc(Cl)c(Cl)cc1O ZINC000858603083 1136982001 /nfs/dbraw/zinc/98/20/01/1136982001.db2.gz QRJYMYOSMHSPCT-YMTOWFKASA-N 1 1 343.254 3.503 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)c1ncc(Br)cn1)c1ccccc1O ZINC000805749036 1136994831 /nfs/dbraw/zinc/99/48/31/1136994831.db2.gz UMNQMQJYAHNWBK-GWCFXTLKSA-N 1 1 336.233 3.747 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1 ZINC000822525884 1137062238 /nfs/dbraw/zinc/06/22/38/1137062238.db2.gz PGERVIFJQMQBQO-RTBURBONSA-N 1 1 347.842 3.752 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CC[C@@H]1O ZINC000824214213 1137128441 /nfs/dbraw/zinc/12/84/41/1137128441.db2.gz BYOKBZDWXIMXJA-KXBFYZLASA-N 1 1 330.497 3.587 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)c1O ZINC000013993993 1137133872 /nfs/dbraw/zinc/13/38/72/1137133872.db2.gz SKBGDUSLVJKLQR-SFHVURJKSA-N 1 1 345.414 3.721 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCC[C@@H](CO)CC2)cc1 ZINC000824438966 1137137613 /nfs/dbraw/zinc/13/76/13/1137137613.db2.gz DROFQZJXLMXVLM-GOSISDBHSA-N 1 1 344.524 3.979 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1O ZINC000824636869 1137145602 /nfs/dbraw/zinc/14/56/02/1137145602.db2.gz UPDFFXOXVKBYMV-IEBWSBKVSA-N 1 1 349.833 3.654 20 10 EHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c(O)c1 ZINC000862485144 1137146601 /nfs/dbraw/zinc/14/66/01/1137146601.db2.gz HXGADADCMIDJSX-PBHICJAKSA-N 1 1 349.471 3.591 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+]2CCO[C@H](CCF)C2)cc1 ZINC000862530547 1137148297 /nfs/dbraw/zinc/14/82/97/1137148297.db2.gz OIRFWTHIHNEDKF-GOSISDBHSA-N 1 1 348.487 3.945 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCO[C@H](CCF)C2)cc1 ZINC000862530547 1137148298 /nfs/dbraw/zinc/14/82/98/1137148298.db2.gz OIRFWTHIHNEDKF-GOSISDBHSA-N 1 1 348.487 3.945 20 10 EHCDMO Cc1cc(O)c(C[NH+]2CCN([C@@H](C)c3cccnc3)CC2)cc1Cl ZINC000824813722 1137153611 /nfs/dbraw/zinc/15/36/11/1137153611.db2.gz IJNOKKZQPORODU-HNNXBMFYSA-N 1 1 345.874 3.628 20 10 EHCDMO COc1cc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000824863444 1137155177 /nfs/dbraw/zinc/15/51/77/1137155177.db2.gz QPVKFEQHFZSSOC-ZBFHGGJFSA-N 1 1 334.504 3.613 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824952681 1137159205 /nfs/dbraw/zinc/15/92/05/1137159205.db2.gz DGPCUSKOJDXESK-SUMWQHHRSA-N 1 1 336.794 3.590 20 10 EHCDMO CCn1ccnc1[C@H](C)[NH2+]Cc1cc(C)cc(Br)c1O ZINC000825005571 1137160075 /nfs/dbraw/zinc/16/00/75/1137160075.db2.gz PLAJWUKJTXMVFP-NSHDSACASA-N 1 1 338.249 3.530 20 10 EHCDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000825513190 1137180770 /nfs/dbraw/zinc/18/07/70/1137180770.db2.gz DSHZCKKCKNUOII-MRXNPFEDSA-N 1 1 329.444 3.759 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000825513190 1137180771 /nfs/dbraw/zinc/18/07/71/1137180771.db2.gz DSHZCKKCKNUOII-MRXNPFEDSA-N 1 1 329.444 3.759 20 10 EHCDMO CC(C)(C)c1ncc(/C=C/C(=O)N2CC[NH2+]Cc3ccccc32)s1 ZINC000844163877 1137203028 /nfs/dbraw/zinc/20/30/28/1137203028.db2.gz MCDDEEZIEJNQSA-CMDGGOBGSA-N 1 1 341.480 3.590 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1c(O)cc(O)cc1O ZINC001144515977 1137304310 /nfs/dbraw/zinc/30/43/10/1137304310.db2.gz LOFOVMWMTVYECZ-UHFFFAOYSA-N 1 1 341.329 3.844 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2noc3ccc(F)cc23)ccc1OC ZINC000865760186 1137309437 /nfs/dbraw/zinc/30/94/37/1137309437.db2.gz CMZNCLAJFFKWJV-UHFFFAOYSA-N 1 1 344.386 3.802 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846109046 1137332676 /nfs/dbraw/zinc/33/26/76/1137332676.db2.gz SLDVHMVFYFRVAE-CYBMUJFWSA-N 1 1 332.188 3.776 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846107529 1137332866 /nfs/dbraw/zinc/33/28/66/1137332866.db2.gz IXDJGDBXAAINGL-ZDUSSCGKSA-N 1 1 332.188 3.776 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846107529 1137332867 /nfs/dbraw/zinc/33/28/67/1137332867.db2.gz IXDJGDBXAAINGL-ZDUSSCGKSA-N 1 1 332.188 3.776 20 10 EHCDMO COc1cccc([C@@H](C)NC[C@H]2CCC[N@@H+]2C2CCCCC2)c1O ZINC000846167960 1137337443 /nfs/dbraw/zinc/33/74/43/1137337443.db2.gz PKFDGGKGCSDCLP-NVXWUHKLSA-N 1 1 332.488 3.849 20 10 EHCDMO COc1cccc([C@@H](C)NC[C@H]2CCC[N@H+]2C2CCCCC2)c1O ZINC000846167960 1137337445 /nfs/dbraw/zinc/33/74/45/1137337445.db2.gz PKFDGGKGCSDCLP-NVXWUHKLSA-N 1 1 332.488 3.849 20 10 EHCDMO C[C@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000846206044 1137339230 /nfs/dbraw/zinc/33/92/30/1137339230.db2.gz UHWRTRLJJHHJHA-ZJUUUORDSA-N 1 1 346.240 3.760 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000866407881 1137352370 /nfs/dbraw/zinc/35/23/70/1137352370.db2.gz YOVSKOIWVGBGLA-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000124074372 1137579022 /nfs/dbraw/zinc/57/90/22/1137579022.db2.gz KBSMJZUAKHPXSC-OAQYLSRUSA-N 1 1 340.442 3.999 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000825709955 1137609311 /nfs/dbraw/zinc/60/93/11/1137609311.db2.gz DIHZONPDEXTFBQ-SECBINFHSA-N 1 1 338.167 3.929 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2OCCCCO)cc1 ZINC000876511858 1137654424 /nfs/dbraw/zinc/65/44/24/1137654424.db2.gz VVMZHYNXRWYNCR-UHFFFAOYSA-N 1 1 342.483 3.536 20 10 EHCDMO Cc1ccc(C[N@H+](C)[C@H](c2cnn(C)c2)c2cccc(F)c2)c(O)c1 ZINC000876660758 1137658555 /nfs/dbraw/zinc/65/85/55/1137658555.db2.gz HBLMHQCIRWEUPK-FQEVSTJZSA-N 1 1 339.414 3.795 20 10 EHCDMO CC[N@@H+](CCC[C@@H]1CCO1)Cc1cc(Br)ccc1O ZINC000876794005 1137661490 /nfs/dbraw/zinc/66/14/90/1137661490.db2.gz KGSSLPJOBOJRMJ-CQSZACIVSA-N 1 1 328.250 3.546 20 10 EHCDMO CC[N@@H+](CCC[C@H]1CCO1)Cc1cc(Br)ccc1O ZINC000876794004 1137661578 /nfs/dbraw/zinc/66/15/78/1137661578.db2.gz KGSSLPJOBOJRMJ-AWEZNQCLSA-N 1 1 328.250 3.546 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000825903787 1137661717 /nfs/dbraw/zinc/66/17/17/1137661717.db2.gz RPSUXEREEWDYJM-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO COc1cc(C[N@@H+](C)C2CCC(CO)CC2)c(O)c(C(C)(C)C)c1 ZINC000825934833 1137669366 /nfs/dbraw/zinc/66/93/66/1137669366.db2.gz LHINKFUQJIKNJT-UHFFFAOYSA-N 1 1 335.488 3.681 20 10 EHCDMO CC1([NH+]2CCCC2)CCN(Cc2cc(Cl)cc(F)c2O)CC1 ZINC000877673269 1137685332 /nfs/dbraw/zinc/68/53/32/1137685332.db2.gz FPJKEWCYRBDRDL-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCc2ncnn21 ZINC000878326727 1137710919 /nfs/dbraw/zinc/71/09/19/1137710919.db2.gz UYTIHOUNPTZQHV-LPHOPBHVSA-N 1 1 348.450 3.734 20 10 EHCDMO COc1ccc(-c2noc([C@H](C)[NH2+][C@H](C)c3ccccc3O)n2)cc1 ZINC000879648432 1137753621 /nfs/dbraw/zinc/75/36/21/1137753621.db2.gz ONZSRYBDHJHHKM-OLZOCXBDSA-N 1 1 339.395 3.863 20 10 EHCDMO CC(C)C(=O)Nc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882882069 1137836569 /nfs/dbraw/zinc/83/65/69/1137836569.db2.gz RTBZNHZRZUNIDN-UHFFFAOYSA-N 1 1 334.366 3.555 20 10 EHCDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)s1 ZINC000883289198 1137852802 /nfs/dbraw/zinc/85/28/02/1137852802.db2.gz HLMVXWIRXQYFMX-INIZCTEOSA-N 1 1 329.513 3.659 20 10 EHCDMO C[C@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000883289453 1137852820 /nfs/dbraw/zinc/85/28/20/1137852820.db2.gz PHAJQDUAPYGWSO-HNNXBMFYSA-N 1 1 345.437 3.567 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2ccc(C)nc2Cl)ccc1OC ZINC000883291523 1137853052 /nfs/dbraw/zinc/85/30/52/1137853052.db2.gz IKLHFGJHKPFHSP-UHFFFAOYSA-N 1 1 334.847 3.878 20 10 EHCDMO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Br)ccc1O ZINC000883311738 1137854073 /nfs/dbraw/zinc/85/40/73/1137854073.db2.gz KBYLXDIVIZSRNA-NSHDSACASA-N 1 1 348.244 3.675 20 10 EHCDMO F[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000883384274 1137858737 /nfs/dbraw/zinc/85/87/37/1137858737.db2.gz OEVDBMAATFBINJ-LEWJYISDSA-N 1 1 340.442 3.638 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000007361027 1137891345 /nfs/dbraw/zinc/89/13/45/1137891345.db2.gz JXYBBRDEODSJSX-UHFFFAOYSA-N 1 1 339.483 3.748 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000007361027 1137891346 /nfs/dbraw/zinc/89/13/46/1137891346.db2.gz JXYBBRDEODSJSX-UHFFFAOYSA-N 1 1 339.483 3.748 20 10 EHCDMO C[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000282913609 1137948833 /nfs/dbraw/zinc/94/88/33/1137948833.db2.gz XLTIQZZBOLSCAQ-INIZCTEOSA-N 1 1 341.503 3.874 20 10 EHCDMO CCCCNC(=O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000216480929 1137980852 /nfs/dbraw/zinc/98/08/52/1137980852.db2.gz WQKMWLBFEABGRS-KRWDZBQOSA-N 1 1 340.467 3.872 20 10 EHCDMO CC(C)NC(=O)Nc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886508657 1138086226 /nfs/dbraw/zinc/08/62/26/1138086226.db2.gz JERSBVAZXFYDKL-ZDUSSCGKSA-N 1 1 345.418 3.912 20 10 EHCDMO C[C@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)c1c(O)cccc1F ZINC000886553240 1138095034 /nfs/dbraw/zinc/09/50/34/1138095034.db2.gz HPIZDYQAPSAPJW-GJZGRUSLSA-N 1 1 343.446 3.803 20 10 EHCDMO COCCCOc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886555093 1138095293 /nfs/dbraw/zinc/09/52/93/1138095293.db2.gz KRBSTPBDOUMBTQ-CQSZACIVSA-N 1 1 333.403 3.797 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)[C@H]1CCCOC1 ZINC000886789532 1138140812 /nfs/dbraw/zinc/14/08/12/1138140812.db2.gz XEDYUGVCIWMLKL-HUBLWGQQSA-N 1 1 347.377 3.503 20 10 EHCDMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N2CCOCC2)cc1 ZINC000090458312 1138210634 /nfs/dbraw/zinc/21/06/34/1138210634.db2.gz GKFYOCUDJHVZSR-CQSZACIVSA-N 1 1 343.496 3.708 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000127484354 1138359795 /nfs/dbraw/zinc/35/97/95/1138359795.db2.gz JDSPAPNCFNSJAP-BEFAXECRSA-N 1 1 339.483 3.649 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)c1 ZINC000180396334 1139830707 /nfs/dbraw/zinc/83/07/07/1139830707.db2.gz CUKYRBXTGXYMOB-ORAYPTAESA-N 1 1 331.387 3.502 20 10 EHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2cc(Cl)cc(OC)c2O)o1 ZINC000184708452 1140116374 /nfs/dbraw/zinc/11/63/74/1140116374.db2.gz MOUFZKLSPZPGLV-CQSZACIVSA-N 1 1 339.819 3.687 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc(F)c(F)c1 ZINC000186225681 1140192744 /nfs/dbraw/zinc/19/27/44/1140192744.db2.gz KIQUUDFLWHQIKJ-HWPZZCPQSA-N 1 1 325.330 3.848 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CCC(C(=O)C(F)(F)F)CC2)c1O ZINC000187659149 1140265958 /nfs/dbraw/zinc/26/59/58/1140265958.db2.gz CETPLYUFWPCIKO-UHFFFAOYSA-N 1 1 335.753 3.697 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777440496 1140290751 /nfs/dbraw/zinc/29/07/51/1140290751.db2.gz XYTPPGMATHNCCA-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777440496 1140290756 /nfs/dbraw/zinc/29/07/56/1140290756.db2.gz XYTPPGMATHNCCA-OAHLLOKOSA-N 1 1 340.261 3.546 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2csc([C@H](C)OC)n2)cc1 ZINC000267638598 1140814503 /nfs/dbraw/zinc/81/45/03/1140814503.db2.gz QCIAMRHBVIIOGN-AWEZNQCLSA-N 1 1 333.501 3.987 20 10 EHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)sc1C ZINC000268703936 1140974266 /nfs/dbraw/zinc/97/42/66/1140974266.db2.gz WAAVHQHORFZBMB-MRXNPFEDSA-N 1 1 332.469 3.647 20 10 EHCDMO Cc1nc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)sc1C ZINC000268703936 1140974271 /nfs/dbraw/zinc/97/42/71/1140974271.db2.gz WAAVHQHORFZBMB-MRXNPFEDSA-N 1 1 332.469 3.647 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 ZINC000268850094 1141008480 /nfs/dbraw/zinc/00/84/80/1141008480.db2.gz OSRROGQAFCJCBA-QAPCUYQASA-N 1 1 341.503 3.872 20 10 EHCDMO COc1cccc(C[N@H+]2CCCCC[C@H]2C[C@@H](O)c2ccco2)c1O ZINC000271232883 1141329965 /nfs/dbraw/zinc/32/99/65/1141329965.db2.gz CPLMVHJQFLRMQZ-DLBZAZTESA-N 1 1 345.439 3.862 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCS[C@H]2COCC[C@H]21 ZINC000271297344 1141340893 /nfs/dbraw/zinc/34/08/93/1141340893.db2.gz SMKAXHSFECHENJ-QUCCMNQESA-N 1 1 341.476 3.766 20 10 EHCDMO Cn1ncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1C1CC1 ZINC000891394849 1020894504 /nfs/dbraw/zinc/89/45/04/1020894504.db2.gz RDLIELRQQFWSIL-UHFFFAOYSA-N 1 1 337.423 3.799 20 10 EHCDMO Cn1ncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1C1CC1 ZINC000891394849 1020894509 /nfs/dbraw/zinc/89/45/09/1020894509.db2.gz RDLIELRQQFWSIL-UHFFFAOYSA-N 1 1 337.423 3.799 20 10 EHCDMO COc1ccc(C[N@@H+](Cc2ccc(OC)c(OC)c2O)C2CC2)cc1 ZINC000891519566 1021817130 /nfs/dbraw/zinc/81/71/30/1021817130.db2.gz RDIVHLZQKBCIFJ-UHFFFAOYSA-N 1 1 343.423 3.583 20 10 EHCDMO COC[C@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894952316 1022291686 /nfs/dbraw/zinc/29/16/86/1022291686.db2.gz IYLHUMUSGSFNHW-NSHDSACASA-N 1 1 346.240 3.542 20 10 EHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000894952316 1022291701 /nfs/dbraw/zinc/29/17/01/1022291701.db2.gz IYLHUMUSGSFNHW-NSHDSACASA-N 1 1 346.240 3.542 20 10 EHCDMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1ccc(N(CC)CC)cc1 ZINC000843769448 1022401780 /nfs/dbraw/zinc/40/17/80/1022401780.db2.gz GMRSPELHYNUHCP-MRXNPFEDSA-N 1 1 342.487 3.559 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000894501878 1022429616 /nfs/dbraw/zinc/42/96/16/1022429616.db2.gz IWCVBTAUFVYDBQ-MRVPVSSYSA-N 1 1 332.347 3.727 20 10 EHCDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000176164011 1023438973 /nfs/dbraw/zinc/43/89/73/1023438973.db2.gz FLBIJVZKXFNSCO-CYBMUJFWSA-N 1 1 349.471 3.559 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c1O ZINC000161130371 1025149439 /nfs/dbraw/zinc/14/94/39/1025149439.db2.gz DAHGUQKZWBBRGY-LJQANCHMSA-N 1 1 345.414 3.730 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c1O ZINC000161130371 1025149444 /nfs/dbraw/zinc/14/94/44/1025149444.db2.gz DAHGUQKZWBBRGY-LJQANCHMSA-N 1 1 345.414 3.730 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281937901 1025732204 /nfs/dbraw/zinc/73/22/04/1025732204.db2.gz DUXNBWVZRBYCAV-GOSISDBHSA-N 1 1 338.499 3.665 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(OC)c2)c1 ZINC000273426680 1027422740 /nfs/dbraw/zinc/42/27/40/1027422740.db2.gz ULEZLOZYVSWCFD-CHWSQXEVSA-N 1 1 329.396 3.599 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000273615743 1027520478 /nfs/dbraw/zinc/52/04/78/1027520478.db2.gz XGZKUQHHFZFFOC-NSHDSACASA-N 1 1 348.468 3.784 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1O ZINC000162540836 1028956866 /nfs/dbraw/zinc/95/68/66/1028956866.db2.gz XWMDVOIQCAQQNS-MRXNPFEDSA-N 1 1 341.407 3.509 20 10 EHCDMO Cc1cc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)c(C)n1-c1ccccc1 ZINC000126041431 1029654489 /nfs/dbraw/zinc/65/44/89/1029654489.db2.gz WTEBXFVSIUVNAG-YWZLYKJASA-N 1 1 339.483 3.506 20 10 EHCDMO CC[C@H](C)NC(=O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176677038 1029656463 /nfs/dbraw/zinc/65/64/63/1029656463.db2.gz RMENQSPRQKBPAE-IRXDYDNUSA-N 1 1 340.467 3.870 20 10 EHCDMO CC(C)O[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000404586965 1029810856 /nfs/dbraw/zinc/81/08/56/1029810856.db2.gz VDPOCZSNXPNYNH-CYBMUJFWSA-N 1 1 328.250 3.544 20 10 EHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000404586965 1029810871 /nfs/dbraw/zinc/81/08/71/1029810871.db2.gz VDPOCZSNXPNYNH-CYBMUJFWSA-N 1 1 328.250 3.544 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc(Br)c1 ZINC000708409394 1031207010 /nfs/dbraw/zinc/20/70/10/1031207010.db2.gz OWIPFLXWSAADBK-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO COc1ccc(CC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)cn1 ZINC000527989753 1031548608 /nfs/dbraw/zinc/54/86/08/1031548608.db2.gz GIGVAOPYDXTVCQ-NSHDSACASA-N 1 1 340.345 3.708 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2nc(-c3ccoc3)no2)C2CC2)cc1 ZINC000729876573 1031752727 /nfs/dbraw/zinc/75/27/27/1031752727.db2.gz OHOOGMAZDIBTMG-UHFFFAOYSA-N 1 1 338.411 3.560 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2nc(-c3ccoc3)no2)C2CC2)cc1 ZINC000729876573 1031752744 /nfs/dbraw/zinc/75/27/44/1031752744.db2.gz OHOOGMAZDIBTMG-UHFFFAOYSA-N 1 1 338.411 3.560 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000195133536 1032046195 /nfs/dbraw/zinc/04/61/95/1032046195.db2.gz ZFRAFUZPLGEOIB-AEFFLSMTSA-N 1 1 340.467 3.574 20 10 EHCDMO CCN(CCC[NH2+][C@H](C)c1ccc(F)cc1O)C(=O)OC(C)(C)C ZINC000310081132 1034255062 /nfs/dbraw/zinc/25/50/62/1034255062.db2.gz WVDHCAVDBZOFAP-CYBMUJFWSA-N 1 1 340.439 3.829 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c1O ZINC000761216041 1034584024 /nfs/dbraw/zinc/58/40/24/1034584024.db2.gz OGQJKVMXOBMZTF-AWEZNQCLSA-N 1 1 347.842 3.955 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000171943277 1034729951 /nfs/dbraw/zinc/72/99/51/1034729951.db2.gz FJKHENKKSXOQRY-UHFFFAOYSA-N 1 1 329.396 3.717 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)cc1F ZINC000761226909 1034817510 /nfs/dbraw/zinc/81/75/10/1034817510.db2.gz XAUDBYCKWNPNOW-UHFFFAOYSA-N 1 1 338.430 3.866 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1cc(F)ccc1O ZINC000186113559 1035585104 /nfs/dbraw/zinc/58/51/04/1035585104.db2.gz ATNMATIGVHYOAU-OLZOCXBDSA-N 1 1 326.375 3.524 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1cn(-c2ccccc2)nn1 ZINC000157288523 1037345564 /nfs/dbraw/zinc/34/55/64/1037345564.db2.gz ISOGPQNBLVEZLO-MRXNPFEDSA-N 1 1 336.439 3.946 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c(O)c1OC ZINC000893940635 1039855896 /nfs/dbraw/zinc/85/58/96/1039855896.db2.gz KRAAYOZPPZIYAO-LBPRGKRZSA-N 1 1 333.350 3.572 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000894045813 1040004737 /nfs/dbraw/zinc/00/47/37/1040004737.db2.gz KEEYPIZQBJDLTQ-UHFFFAOYSA-N 1 1 348.240 3.770 20 10 EHCDMO C[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)[C@@H]1CCOC1 ZINC000106858167 1043061166 /nfs/dbraw/zinc/06/11/66/1043061166.db2.gz KKAGRLIUUIWVQR-CYBMUJFWSA-N 1 1 336.229 3.529 20 10 EHCDMO Cc1cc(C[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)n[nH]1 ZINC000279784374 1044662683 /nfs/dbraw/zinc/66/26/83/1044662683.db2.gz BEWJALCWYNENGQ-LLVKDONJSA-N 1 1 340.393 3.524 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H]1CCCN(CC(C)(C)C)C1=O ZINC000763834262 1126880120 /nfs/dbraw/zinc/88/01/20/1126880120.db2.gz KPVWFHLVRBLCQM-QGZVFWFLSA-N 1 1 332.488 3.641 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H]1CCCN(CC(C)(C)C)C1=O ZINC000763834260 1126880438 /nfs/dbraw/zinc/88/04/38/1126880438.db2.gz KPVWFHLVRBLCQM-KRWDZBQOSA-N 1 1 332.488 3.641 20 10 EHCDMO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)[C@@H]1SC ZINC000842922770 1127664773 /nfs/dbraw/zinc/66/47/73/1127664773.db2.gz DAMQGGNPHTUKAA-FWHFQCOYSA-N 1 1 349.418 3.971 20 10 EHCDMO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cs1 ZINC000765855171 1128604622 /nfs/dbraw/zinc/60/46/22/1128604622.db2.gz VDFNFWMEVTWSKD-KGLIPLIRSA-N 1 1 331.485 3.700 20 10 EHCDMO COc1ccc([C@@H]2C[C@H]([N@@H+](C)Cc3ccccc3O)CCO2)cc1 ZINC001168665127 1128745050 /nfs/dbraw/zinc/74/50/50/1128745050.db2.gz MJIBROKVSDWKHQ-XLIONFOSSA-N 1 1 327.424 3.753 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C[C@H](O)c2c(F)cccc2F)C2CC2)cc1 ZINC000917013474 1122438889 /nfs/dbraw/zinc/43/88/89/1122438889.db2.gz CDJOJUQXYNWKDC-IBGZPJMESA-N 1 1 346.421 3.729 20 10 EHCDMO CCCNc1cc[nH+]c(NCc2cc(Cl)c3cccnc3c2O)n1 ZINC001168523519 1122741366 /nfs/dbraw/zinc/74/13/66/1122741366.db2.gz DWBVSMIMGFUIHX-UHFFFAOYSA-N 1 1 343.818 3.818 20 10 EHCDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cc(OC)ccc1O ZINC000188581056 1123764472 /nfs/dbraw/zinc/76/44/72/1123764472.db2.gz AWUHIGHAXFXXPS-FQEVSTJZSA-N 1 1 329.440 3.564 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](C)Cc2cc(Cl)ccc2O)c1C ZINC000179653921 1123818564 /nfs/dbraw/zinc/81/85/64/1123818564.db2.gz AJNZYFKIGWBHBA-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Cc1cccc(NC(=O)C[N@H+](C)Cc2cc(Cl)ccc2O)c1C ZINC000179653921 1123818567 /nfs/dbraw/zinc/81/85/67/1123818567.db2.gz AJNZYFKIGWBHBA-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000179951485 1123905379 /nfs/dbraw/zinc/90/53/79/1123905379.db2.gz USJIIQNHHNXPHE-UHFFFAOYSA-N 1 1 338.167 3.929 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2cccc(F)c2)cc1 ZINC000180010763 1123916877 /nfs/dbraw/zinc/91/68/77/1123916877.db2.gz XQOMYBYRRTXDKU-HXUWFJFHSA-N 1 1 338.430 3.504 20 10 EHCDMO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cs1 ZINC000182413456 1125276719 /nfs/dbraw/zinc/27/67/19/1125276719.db2.gz DUPHHBISDGHFFP-NEPJUHHUSA-N 1 1 336.457 3.806 20 10 EHCDMO COc1cc(C[NH2+][C@H](c2ncccn2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000922577192 1129578829 /nfs/dbraw/zinc/57/88/29/1129578829.db2.gz NLAQTNJREOJBPE-KRWDZBQOSA-N 1 1 341.455 3.729 20 10 EHCDMO CO[C@@](C)(C[NH2+][C@@H](C)c1ccc(F)cc1O)COCc1ccccc1 ZINC000702804298 1130249590 /nfs/dbraw/zinc/24/95/90/1130249590.db2.gz OUNPMABVIZHXBH-YWZLYKJASA-N 1 1 347.430 3.804 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccc(OCC)cc1)Cc1ccccc1O ZINC000727831031 1130598480 /nfs/dbraw/zinc/59/84/80/1130598480.db2.gz DEZBIVBYRWQMCI-UHFFFAOYSA-N 1 1 342.439 3.642 20 10 EHCDMO C[C@H]1CCCC[C@H]1NC(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731847744 1130850120 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CCC[N@@H+]1CC[C@@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930697 1134827470 /nfs/dbraw/zinc/82/74/70/1134827470.db2.gz QNSAOQHBYGWINP-AWEZNQCLSA-N 1 1 343.437 3.593 20 10 EHCDMO CCC[N@H+]1CC[C@@H](CNCc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930697 1134827485 /nfs/dbraw/zinc/82/74/85/1134827485.db2.gz QNSAOQHBYGWINP-AWEZNQCLSA-N 1 1 343.437 3.593 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCO[C@]3(CCO[C@@H]3C)C2)cc1 ZINC000793230312 1134879578 /nfs/dbraw/zinc/87/95/78/1134879578.db2.gz FVKIAONNUCKPGZ-WIYYLYMNSA-N 1 1 346.515 3.693 20 10 EHCDMO CC1(C)CCC[C@H](C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)O1 ZINC001192014979 1134956845 /nfs/dbraw/zinc/95/68/45/1134956845.db2.gz XUKUOTIOYNTUQH-QZTJIDSGSA-N 1 1 333.472 3.721 20 10 EHCDMO CC[C@@H](Cc1ccc2c(c1)OCO2)[N@H+]1CCc2cccc(O)c2C1 ZINC001170449263 1135060707 /nfs/dbraw/zinc/06/07/07/1135060707.db2.gz LLBMPURSNBTIBD-INIZCTEOSA-N 1 1 325.408 3.500 20 10 EHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H]1CCN(C2CCCCC2)C1=O ZINC001193838161 1135184652 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ZINC000811520749 1136097873 /nfs/dbraw/zinc/09/78/73/1136097873.db2.gz UJOCCNVBUROGGY-LJQANCHMSA-N 1 1 344.890 3.974 20 10 EHCDMO CCOc1cccc(C[N@H+]2Cc3ccc(OC)cc3C3(CC3)C2)c1O ZINC000811519508 1136098515 /nfs/dbraw/zinc/09/85/15/1136098515.db2.gz YEJXKZPIUOEZFP-UHFFFAOYSA-N 1 1 339.435 3.847 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1Cl ZINC000825537353 1136165013 /nfs/dbraw/zinc/16/50/13/1136165013.db2.gz WLLJLGLEEOBGDT-LJQANCHMSA-N 1 1 329.827 3.985 20 10 EHCDMO Cc1cc(C[NH2+][C@@H]2C[C@H](C)n3ncnc32)c(C)n1-c1cccc(C)c1 ZINC000850352261 1136239251 /nfs/dbraw/zinc/23/92/51/1136239251.db2.gz QCOAYXZADDTTBH-HNAYVOBHSA-N 1 1 335.455 3.790 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812736848 1136240041 /nfs/dbraw/zinc/24/00/41/1136240041.db2.gz OQKGHEJUKDNDMY-UONOGXRCSA-N 1 1 332.394 3.848 20 10 EHCDMO Cc1ccc2oc(C[NH2+]Cc3ccc(N4CCN(C)CC4)cc3)cc2c1 ZINC000850376899 1136245001 /nfs/dbraw/zinc/24/50/01/1136245001.db2.gz NJILHFJVMYIOJG-UHFFFAOYSA-N 1 1 349.478 3.783 20 10 EHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850843 1136261514 /nfs/dbraw/zinc/26/15/14/1136261514.db2.gz YNHXTMXTWDRZLO-BFUOFWGJSA-N 1 1 345.414 3.678 20 10 EHCDMO COC[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C1CCOCC1 ZINC000850494679 1136271102 /nfs/dbraw/zinc/27/11/02/1136271102.db2.gz WDWUYRDJIXFDBR-IAQYHMDHSA-N 1 1 347.377 3.503 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cscn1 ZINC000850511784 1136273714 /nfs/dbraw/zinc/27/37/14/1136273714.db2.gz NAIKXGMZLUTFQF-STQMWFEESA-N 1 1 335.448 3.531 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cscn1 ZINC000850511783 1136274003 /nfs/dbraw/zinc/27/40/03/1136274003.db2.gz NAIKXGMZLUTFQF-QWHCGFSZSA-N 1 1 335.448 3.531 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)c1nccn1C ZINC000850572909 1136289408 /nfs/dbraw/zinc/28/94/08/1136289408.db2.gz QOCZXMHEDBLHID-GJZGRUSLSA-N 1 1 330.451 3.961 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](C)CN2C[C@H](C)C[C@@H](C)C2)ccc1OC ZINC000747854590 1136326267 /nfs/dbraw/zinc/32/62/67/1136326267.db2.gz PYWHFEQCZCRIIB-KZNAEPCWSA-N 1 1 348.531 3.688 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1 ZINC000814175712 1136410725 /nfs/dbraw/zinc/41/07/25/1136410725.db2.gz JPAZZXLGZAEAFS-WBVHZDCISA-N 1 1 346.471 3.532 20 10 EHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000814179431 1136412294 /nfs/dbraw/zinc/41/22/94/1136412294.db2.gz TUSYZLGQZDOJBI-LLVKDONJSA-N 1 1 330.291 3.730 20 10 EHCDMO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1cc(F)cc(F)c1O ZINC000853241818 1136521522 /nfs/dbraw/zinc/52/15/22/1136521522.db2.gz NMUPMSYIOVWGGC-MRVPVSSYSA-N 1 1 332.272 3.935 20 10 EHCDMO Cc1cccc(C)c1[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000853522002 1136540170 /nfs/dbraw/zinc/54/01/70/1136540170.db2.gz ICMCWSYPCNWIGO-HKUYNNGSSA-N 1 1 339.435 3.772 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)ccc1N(C)C ZINC000815076634 1136548047 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EHCDMO CCc1nocc1C[N@H+](CC)Cc1cc(Br)ccc1O ZINC000816519212 1136730105 /nfs/dbraw/zinc/73/01/05/1136730105.db2.gz BWQDGIVYYRMUIE-UHFFFAOYSA-N 1 1 339.233 3.727 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521566 1136732927 /nfs/dbraw/zinc/73/29/27/1136732927.db2.gz SHPUHRUSHBPWPQ-LBPRGKRZSA-N 1 1 343.826 3.740 20 10 EHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521566 1136732931 /nfs/dbraw/zinc/73/29/31/1136732931.db2.gz SHPUHRUSHBPWPQ-LBPRGKRZSA-N 1 1 343.826 3.740 20 10 EHCDMO CC(C)(C)c1nnc(C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816556332 1136736054 /nfs/dbraw/zinc/73/60/54/1136736054.db2.gz GJFAOECOTZXEHF-UHFFFAOYSA-N 1 1 327.453 3.984 20 10 EHCDMO C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)Oc1ccccc1F ZINC000816554162 1136736231 /nfs/dbraw/zinc/73/62/31/1136736231.db2.gz QUOLAJBXAMRCNX-SNVBAGLBSA-N 1 1 327.758 3.881 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1 ZINC000816559885 1136736914 /nfs/dbraw/zinc/73/69/14/1136736914.db2.gz 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CCOc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938486 1136847880 /nfs/dbraw/zinc/84/78/80/1136847880.db2.gz LGOUQTGZGTWRSS-MGPUTAFESA-N 1 1 327.472 3.502 20 10 EHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc2ccccc2n1 ZINC000817942508 1136849315 /nfs/dbraw/zinc/84/93/15/1136849315.db2.gz PCXJQVIZENCHMC-KXBFYZLASA-N 1 1 334.467 3.651 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)cc1F ZINC000858150541 1136944573 /nfs/dbraw/zinc/94/45/73/1136944573.db2.gz ARNLMKBXNBXMOH-UHFFFAOYSA-N 1 1 346.377 3.538 20 10 EHCDMO C[C@@H]([NH2+]C[C@]1(C)COc2ccccc2O1)c1cc(F)cc(F)c1O ZINC000858447877 1136968814 /nfs/dbraw/zinc/96/88/14/1136968814.db2.gz XSAZDWVNSNQZCX-ADLMAVQZSA-N 1 1 335.350 3.551 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c1O ZINC000822530366 1137062393 /nfs/dbraw/zinc/06/23/93/1137062393.db2.gz YYIOGAKPJSKLQV-LJQANCHMSA-N 1 1 331.456 3.572 20 10 EHCDMO C[C@H]1COCCC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823459424 1137100494 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C[C@@]1(C[NH2+]Cc2cccc(Br)c2O)CC1(Cl)Cl ZINC000824766279 1137150760 /nfs/dbraw/zinc/15/07/60/1137150760.db2.gz SYVCUNFRFMUQMX-NSHDSACASA-N 1 1 339.060 3.828 20 10 EHCDMO Cc1ncccc1C[N@@H+](C)Cc1cc(Br)c(F)cc1O ZINC001144307614 1137270964 /nfs/dbraw/zinc/27/09/64/1137270964.db2.gz BVQGYZCKLBCPQA-UHFFFAOYSA-N 1 1 339.208 3.629 20 10 EHCDMO Cc1ncccc1C[N@H+](C)Cc1cc(Br)c(F)cc1O ZINC001144307614 1137270966 /nfs/dbraw/zinc/27/09/66/1137270966.db2.gz BVQGYZCKLBCPQA-UHFFFAOYSA-N 1 1 339.208 3.629 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)cc1F ZINC000865437663 1137283744 /nfs/dbraw/zinc/28/37/44/1137283744.db2.gz QTMXNTMAGRNTNA-UHFFFAOYSA-N 1 1 328.218 3.883 20 10 EHCDMO Cn1ccc2cc[nH+]c(NCc3cc(Br)ccc3O)c21 ZINC001171175375 1137286409 /nfs/dbraw/zinc/28/64/09/1137286409.db2.gz MSIHCSWEWYCQKQ-UHFFFAOYSA-N 1 1 332.201 3.654 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C(=O)OC)cc1F ZINC001144450161 1137295424 /nfs/dbraw/zinc/29/54/24/1137295424.db2.gz IEBFOVCFQQQPLI-UHFFFAOYSA-N 1 1 344.430 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C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000129722744 1137829478 /nfs/dbraw/zinc/82/94/78/1137829478.db2.gz OUTCMKUOQBMHMB-OAHLLOKOSA-N 1 1 346.421 3.994 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccccc1OCC(F)(F)F ZINC000882910262 1137837764 /nfs/dbraw/zinc/83/77/64/1137837764.db2.gz NWRMQFSEDBKUKW-UHFFFAOYSA-N 1 1 347.283 3.901 20 10 EHCDMO CSCc1cc(F)ccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883036132 1137842267 /nfs/dbraw/zinc/84/22/67/1137842267.db2.gz APMXEHPSCXLAFS-UHFFFAOYSA-N 1 1 327.371 3.962 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000883136125 1137845961 /nfs/dbraw/zinc/84/59/61/1137845961.db2.gz VNMWWEDJISILAY-LBPRGKRZSA-N 1 1 329.268 3.865 20 10 EHCDMO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883290967 1137852995 /nfs/dbraw/zinc/85/29/95/1137852995.db2.gz OJCWOMJLGKRNAV-QGZVFWFLSA-N 1 1 341.474 3.737 20 10 EHCDMO F[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000883384277 1137858734 /nfs/dbraw/zinc/85/87/34/1137858734.db2.gz OEVDBMAATFBINJ-SFTDATJTSA-N 1 1 340.442 3.638 20 10 EHCDMO CCN(CC)C(=O)c1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886498670 1138084031 /nfs/dbraw/zinc/08/40/31/1138084031.db2.gz LFOYIHOIUVVHRR-CQSZACIVSA-N 1 1 344.430 3.864 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc2c(c1)CCC(=O)N2 ZINC000886505022 1138085235 /nfs/dbraw/zinc/08/52/35/1138085235.db2.gz FCZFRYFXUAWMMW-VXGBXAGGSA-N 1 1 328.387 3.828 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1c(O)cccc1F ZINC000886506183 1138085689 /nfs/dbraw/zinc/08/56/89/1138085689.db2.gz FTZNQZBGICDBBC-AWEZNQCLSA-N 1 1 346.471 3.935 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](OC(C)(C)C)[C@H]1n1cccn1)c1c(O)cccc1F ZINC000886621733 1138103162 /nfs/dbraw/zinc/10/31/62/1138103162.db2.gz ACAGJLWBUYUQHF-VYOUMLOHSA-N 1 1 347.434 3.576 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1c([O-])cccc1F ZINC000886629866 1138103654 /nfs/dbraw/zinc/10/36/54/1138103654.db2.gz PXOUIIKOFFVBEK-OIISXLGYSA-N 1 1 328.431 3.527 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCCOC1 ZINC000886788486 1138140546 /nfs/dbraw/zinc/14/05/46/1138140546.db2.gz CLAMHLMNLUYLSE-ZETOZRRWSA-N 1 1 348.270 3.791 20 10 EHCDMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N2CCOCC2)cc1 ZINC000090458310 1138210697 /nfs/dbraw/zinc/21/06/97/1138210697.db2.gz GKFYOCUDJHVZSR-AWEZNQCLSA-N 1 1 343.496 3.708 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3ccsc3)cc2F)CC1 ZINC000177972226 1139659593 /nfs/dbraw/zinc/65/95/93/1139659593.db2.gz MTOZOSOCBIEJMG-HNNXBMFYSA-N 1 1 347.503 3.880 20 10 EHCDMO CC1([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)OCCO1 ZINC000182829246 1139995583 /nfs/dbraw/zinc/99/55/83/1139995583.db2.gz OEEZXJYPPWYGFO-MRXNPFEDSA-N 1 1 327.424 3.520 20 10 EHCDMO C[C@@H](C[N@@H+](C)Cc1cc(Br)ccc1O)c1nccs1 ZINC000183257992 1140025928 /nfs/dbraw/zinc/02/59/28/1140025928.db2.gz WADSWFBSMIAJOE-JTQLQIEISA-N 1 1 341.274 3.847 20 10 EHCDMO Cc1cc(Cl)cc(C[NH2+]Cc2cc(COC(C)(C)C)on2)c1O ZINC000188658998 1140304531 /nfs/dbraw/zinc/30/45/31/1140304531.db2.gz CFDATZMMZXYKCH-UHFFFAOYSA-N 1 1 338.835 3.947 20 10 EHCDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466654 1140419586 /nfs/dbraw/zinc/41/95/86/1140419586.db2.gz CJCWTVJTUJYYMY-QGZVFWFLSA-N 1 1 342.458 3.725 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC3(CCOCC3)C2)c1[O-] ZINC000267415747 1140788457 /nfs/dbraw/zinc/78/84/57/1140788457.db2.gz VDAZZBKWKCWTGG-UHFFFAOYSA-N 1 1 337.847 3.641 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC3(CCOCC3)C2)c1O ZINC000267415747 1140788461 /nfs/dbraw/zinc/78/84/61/1140788461.db2.gz VDAZZBKWKCWTGG-UHFFFAOYSA-N 1 1 337.847 3.641 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC3(CCOCC3)C2)c1O ZINC000267415747 1140788464 /nfs/dbraw/zinc/78/84/64/1140788464.db2.gz VDAZZBKWKCWTGG-UHFFFAOYSA-N 1 1 337.847 3.641 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(-n2ccnc2)nc1 ZINC000269333008 1141094975 /nfs/dbraw/zinc/09/49/75/1141094975.db2.gz AQDURZOMYSTQEI-UHFFFAOYSA-N 1 1 349.482 3.744 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3sccc32)c1 ZINC000274401244 1141516818 /nfs/dbraw/zinc/51/68/18/1141516818.db2.gz QBFFMPPDPLQCEC-NHYWBVRUSA-N 1 1 331.437 3.969 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000049577583 1014422176 /nfs/dbraw/zinc/42/21/76/1014422176.db2.gz BSMRPUQLSGWNJO-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO COc1cccc([C@@H]2C[N@@H+](Cc3cc(C)c(C)cc3O)CCO2)c1 ZINC000166163820 1016590447 /nfs/dbraw/zinc/59/04/47/1016590447.db2.gz ULDJWIWMBGIKFW-FQEVSTJZSA-N 1 1 327.424 3.591 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc(C)c1F ZINC001143377859 1017707344 /nfs/dbraw/zinc/70/73/44/1017707344.db2.gz FQTNCESWHNUQKO-UHFFFAOYSA-N 1 1 342.458 3.911 20 10 EHCDMO COc1cc(C)cc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)c1O ZINC000894325781 1021492563 /nfs/dbraw/zinc/49/25/63/1021492563.db2.gz KQTFOGPUKLYCBC-UHFFFAOYSA-N 1 1 329.293 3.555 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](C)c2nnc([C@@H](C)CC)[nH]2)ccc1OC ZINC000276759690 1022645770 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Cc1nc(NCc2ccc(N3CCSCC3)cc2)c(C)c(C)[nH+]1 ZINC000301431742 1026803552 /nfs/dbraw/zinc/80/35/52/1026803552.db2.gz GZCGMPIIFARDSM-UHFFFAOYSA-N 1 1 328.485 3.567 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000127841978 1027362408 /nfs/dbraw/zinc/36/24/08/1027362408.db2.gz INXNFSZCRQTEBG-OAHLLOKOSA-N 1 1 338.407 3.922 20 10 EHCDMO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cc(OC)c1OC ZINC000273441942 1027427264 /nfs/dbraw/zinc/42/72/64/1027427264.db2.gz YVYZXBXSJDKFAI-NEPJUHHUSA-N 1 1 349.402 3.969 20 10 EHCDMO CCCN(Cc1ccc(C)cc1)C(=O)C[N@@H+](C)Cc1ccccc1O ZINC000303369965 1027538997 /nfs/dbraw/zinc/53/89/97/1027538997.db2.gz LCYXPFJKJVYVEN-UHFFFAOYSA-N 1 1 340.467 3.571 20 10 EHCDMO Cc1cccc(NC(=O)C[N@H+](C)Cc2cc(C)c(C)cc2O)c1C ZINC000192509373 1029922362 /nfs/dbraw/zinc/92/23/62/1029922362.db2.gz NDCSVPWFCGXPTI-UHFFFAOYSA-N 1 1 326.440 3.696 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(-c2ccccc2)n(C)n1 ZINC000527858335 1031336174 /nfs/dbraw/zinc/33/61/74/1031336174.db2.gz PQSKVMDCHSBROD-OAHLLOKOSA-N 1 1 333.435 3.873 20 10 EHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCS[C@@H]2COCC[C@@H]21 ZINC000091855948 1031956678 /nfs/dbraw/zinc/95/66/78/1031956678.db2.gz SMKAXHSFECHENJ-AZUAARDMSA-N 1 1 341.476 3.766 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1Cc2ncccc2N2CCC[C@H]2C1 ZINC000898167932 1033365859 /nfs/dbraw/zinc/36/58/59/1033365859.db2.gz QNSPZJRFJSVQEM-AWEZNQCLSA-N 1 1 347.821 3.564 20 10 EHCDMO [O-]c1c(F)cc(Cl)cc1CN1Cc2ncccc2N2CCC[C@H]2C1 ZINC000898167932 1033365875 /nfs/dbraw/zinc/36/58/75/1033365875.db2.gz QNSPZJRFJSVQEM-AWEZNQCLSA-N 1 1 347.821 3.564 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000761203008 1034407419 /nfs/dbraw/zinc/40/74/19/1034407419.db2.gz HRWYIEXODNCWPE-YVEFUNNKSA-N 1 1 347.842 3.878 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1O ZINC000091966767 1034487375 /nfs/dbraw/zinc/48/73/75/1034487375.db2.gz GTGDDNWIYLJGBC-MSOLQXFVSA-N 1 1 345.414 3.628 20 10 EHCDMO CC(C)(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccccc1O ZINC000179553256 1034496615 /nfs/dbraw/zinc/49/66/15/1034496615.db2.gz WKDROVIKNQISTA-UHFFFAOYSA-N 1 1 330.403 3.771 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1O ZINC000164291910 1035515001 /nfs/dbraw/zinc/51/50/01/1035515001.db2.gz SNTRJFKWFHDKEG-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1O ZINC000164291910 1035515012 /nfs/dbraw/zinc/51/50/12/1035515012.db2.gz SNTRJFKWFHDKEG-GOSISDBHSA-N 1 1 347.842 3.936 20 10 EHCDMO COc1cc(CN2CC[C@@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000164399128 1035536926 /nfs/dbraw/zinc/53/69/26/1035536926.db2.gz AKTFABXXFGWVKE-INIZCTEOSA-N 1 1 346.515 3.616 20 10 EHCDMO CC[N@H+](Cc1nc(Br)cs1)Cc1ccccc1O ZINC001137782380 1037080517 /nfs/dbraw/zinc/08/05/17/1037080517.db2.gz OGZKCQFBDMEFIL-UHFFFAOYSA-N 1 1 327.247 3.633 20 10 EHCDMO CC[N@@H+](Cc1nc(Br)cs1)Cc1ccccc1O ZINC001137782380 1037080536 /nfs/dbraw/zinc/08/05/36/1037080536.db2.gz OGZKCQFBDMEFIL-UHFFFAOYSA-N 1 1 327.247 3.633 20 10 EHCDMO CC[C@@H]([NH2+]Cc1nncn1-c1ccccc1)c1ccc(N(C)C)cc1 ZINC000152666622 1037485553 /nfs/dbraw/zinc/48/55/53/1037485553.db2.gz IFHINLARHVSJSF-LJQANCHMSA-N 1 1 335.455 3.574 20 10 EHCDMO C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@@H+](C)Cc1ccccc1O ZINC000111235463 1037729482 /nfs/dbraw/zinc/72/94/82/1037729482.db2.gz QCYCUUXABADUIZ-GDBMZVCRSA-N 1 1 344.480 3.638 20 10 EHCDMO Cc1nc([C@@H]2CC[N@@H+](Cc3cc(C)cc(C(C)(C)C)c3O)C2)no1 ZINC000905684570 1039038646 /nfs/dbraw/zinc/03/86/46/1039038646.db2.gz AVMLHCYVQMCAKV-CQSZACIVSA-N 1 1 329.444 3.679 20 10 EHCDMO C[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000905741914 1039077390 /nfs/dbraw/zinc/07/73/90/1039077390.db2.gz OYNPZBCVKXCAMJ-WNYOCNMUSA-N 1 1 339.435 3.586 20 10 EHCDMO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)o1 ZINC000278832991 1040881914 /nfs/dbraw/zinc/88/19/14/1040881914.db2.gz UEJHSQXNMVTDGB-XPTSAGLGSA-N 1 1 330.211 3.985 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H]1CCCO1 ZINC000278910648 1042918815 /nfs/dbraw/zinc/91/88/15/1042918815.db2.gz VSHFQTKLEYYTMG-FGEZKYSXSA-N 1 1 334.243 3.544 20 10 EHCDMO CCCOCCNc1[nH+]c(C)c(C)cc1C=C(N=[N+]=[N-])C(=O)OCC ZINC001167872788 1044042284 /nfs/dbraw/zinc/04/22/84/1044042284.db2.gz SUABNTUOFLCFPM-PTNGSMBKSA-N 1 1 347.419 3.751 20 10 EHCDMO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1O ZINC000184999180 1126732326 /nfs/dbraw/zinc/73/23/26/1126732326.db2.gz RKICMZVLNUVOTH-AWEZNQCLSA-N 1 1 325.387 3.627 20 10 EHCDMO C[C@H]([NH2+]CCOc1ncccc1C(F)(F)F)c1ccc(F)cc1O ZINC000186145604 1127354349 /nfs/dbraw/zinc/35/43/49/1127354349.db2.gz PVPVUIFUWNTEHG-JTQLQIEISA-N 1 1 344.308 3.675 20 10 EHCDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccc(N(C)C)cc2)CC1 ZINC000765720269 1127738548 /nfs/dbraw/zinc/73/85/48/1127738548.db2.gz RCJRZGCDJQWUAZ-INIZCTEOSA-N 1 1 329.513 3.693 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1nncn1C ZINC000765747082 1127764032 /nfs/dbraw/zinc/76/40/32/1127764032.db2.gz BLAQFEWFKIGAEW-HOTGVXAUSA-N 1 1 327.476 3.607 20 10 EHCDMO C[C@@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872678 1128629312 /nfs/dbraw/zinc/62/93/12/1128629312.db2.gz KOBWENHZFIJXKY-APWZRJJASA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765872678 1128629314 /nfs/dbraw/zinc/62/93/14/1128629314.db2.gz KOBWENHZFIJXKY-APWZRJJASA-N 1 1 345.506 3.951 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1[O-] ZINC001235068404 1121288053 /nfs/dbraw/zinc/28/80/53/1121288053.db2.gz GMGHHTCESTYWOM-ZDUSSCGKSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001235068404 1121288060 /nfs/dbraw/zinc/28/80/60/1121288060.db2.gz GMGHHTCESTYWOM-ZDUSSCGKSA-N 1 1 346.240 3.683 20 10 EHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001235068404 1121288064 /nfs/dbraw/zinc/28/80/64/1121288064.db2.gz GMGHHTCESTYWOM-ZDUSSCGKSA-N 1 1 346.240 3.683 20 10 EHCDMO Cc1cc(C(=O)NCCC[N@H+](C)C(C)C)c(C)n1-c1ccccc1C ZINC000915262366 1121288978 /nfs/dbraw/zinc/28/89/78/1121288978.db2.gz JHPTTWSOUAYGHC-UHFFFAOYSA-N 1 1 341.499 3.863 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1c(F)cccc1F ZINC000917014269 1122438938 /nfs/dbraw/zinc/43/89/38/1122438938.db2.gz PUZFCYYBXUVKRG-LJQANCHMSA-N 1 1 348.437 3.975 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917074896 1122472480 /nfs/dbraw/zinc/47/24/80/1122472480.db2.gz KIWBCOXWURAWCP-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO Cc1cccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917074896 1122472482 /nfs/dbraw/zinc/47/24/82/1122472482.db2.gz KIWBCOXWURAWCP-UHFFFAOYSA-N 1 1 337.467 3.664 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+](Cc1ccc(Cl)cc1)C1CC1)OCO2 ZINC000917478216 1122613401 /nfs/dbraw/zinc/61/34/01/1122613401.db2.gz SVEWSZQWDILWQR-UHFFFAOYSA-N 1 1 331.799 3.939 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000917500717 1122617068 /nfs/dbraw/zinc/61/70/68/1122617068.db2.gz ZVVOJRIBKXIHFQ-HOTGVXAUSA-N 1 1 343.496 3.512 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000918070941 1122740378 /nfs/dbraw/zinc/74/03/78/1122740378.db2.gz FXWQIRJSXKBBLY-HOTGVXAUSA-N 1 1 343.496 3.512 20 10 EHCDMO C[N@@H+](Cc1cc(F)ccc1O)C1CCN(Cc2ccccc2)CC1 ZINC000180079036 1123933444 /nfs/dbraw/zinc/93/34/44/1123933444.db2.gz FBHFABXIQNTCJF-UHFFFAOYSA-N 1 1 328.431 3.628 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000180272872 1123973183 /nfs/dbraw/zinc/97/31/83/1123973183.db2.gz VNBPUUSLWKSERT-WMZOPIPTSA-N 1 1 333.403 3.993 20 10 EHCDMO CCOCC[NH+](CCOCC)Cc1cc(Cl)c(Cl)cc1O ZINC001236795925 1124973367 /nfs/dbraw/zinc/97/33/67/1124973367.db2.gz KPAWCPFWGKHGPI-UHFFFAOYSA-N 1 1 336.259 3.574 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c1 ZINC000922730626 1129646280 /nfs/dbraw/zinc/64/62/80/1129646280.db2.gz LMVQYWQVGAFUTG-WCBMZHEXSA-N 1 1 338.167 3.751 20 10 EHCDMO C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)[N@@H+](C)Cc1ccccc1O ZINC000732202749 1130900294 /nfs/dbraw/zinc/90/02/94/1130900294.db2.gz AOKFKCTWGKWQCL-HZPDHXFCSA-N 1 1 338.451 3.580 20 10 EHCDMO C[C@H]1CCCCN1C(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613349 1131062001 /nfs/dbraw/zinc/06/20/01/1131062001.db2.gz OGIIOXUWWUTPGN-INIZCTEOSA-N 1 1 330.472 3.538 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1C ZINC000740856037 1131549915 /nfs/dbraw/zinc/54/99/15/1131549915.db2.gz LVODNHPNGIERLS-WBVHZDCISA-N 1 1 348.487 3.744 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000742176538 1131697336 /nfs/dbraw/zinc/69/73/36/1131697336.db2.gz LEOCHIFAMNHIQT-GOSISDBHSA-N 1 1 348.446 3.979 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)[C@@H](c2ccccc2)CO1 ZINC000743407037 1131916831 /nfs/dbraw/zinc/91/68/31/1131916831.db2.gz PTIVFUFBERTFNI-MGPUTAFESA-N 1 1 334.419 3.902 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1COc2cccc(OC)c2C1 ZINC001173168088 1131999339 /nfs/dbraw/zinc/99/93/39/1131999339.db2.gz MWEDYYSPPMYRSR-SFHVURJKSA-N 1 1 340.467 3.587 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)CCN1Cc1ccccc1 ZINC000379657800 1132241407 /nfs/dbraw/zinc/24/14/07/1132241407.db2.gz UMRBKAGKMSZGNO-NQIIRXRSSA-N 1 1 337.511 3.895 20 10 EHCDMO C[C@@H](NCC[N@@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766381824 1132523417 /nfs/dbraw/zinc/52/34/17/1132523417.db2.gz JYMRXIITJXAPPR-DLBZAZTESA-N 1 1 333.495 3.808 20 10 EHCDMO C[C@@H](NCC[N@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766381824 1132523425 /nfs/dbraw/zinc/52/34/25/1132523425.db2.gz JYMRXIITJXAPPR-DLBZAZTESA-N 1 1 333.495 3.808 20 10 EHCDMO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc(N2CCOCC2)cc1 ZINC000766604190 1132667997 /nfs/dbraw/zinc/66/79/97/1132667997.db2.gz XRUTZVLAZMCUHL-AWEZNQCLSA-N 1 1 332.394 3.652 20 10 EHCDMO CCc1cc(C[N@@H+](C)CCCn2ccnc2)c(O)c(C(C)(C)C)c1 ZINC000767758919 1133048343 /nfs/dbraw/zinc/04/83/43/1133048343.db2.gz FRYOKBWQHNLGPQ-UHFFFAOYSA-N 1 1 329.488 3.971 20 10 EHCDMO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000768131211 1133099503 /nfs/dbraw/zinc/09/95/03/1133099503.db2.gz WQBIWFDCLKPWGU-UHFFFAOYSA-N 1 1 328.504 3.953 20 10 EHCDMO CCc1nn(C)c(Cl)c1C[N@@H+](CC)Cc1ccc(N(C)C)cc1 ZINC000768132705 1133100090 /nfs/dbraw/zinc/10/00/90/1133100090.db2.gz IPIRKKUGRISBGC-UHFFFAOYSA-N 1 1 334.895 3.724 20 10 EHCDMO CCc1nn(C)c(Cl)c1C[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC000768132705 1133100093 /nfs/dbraw/zinc/10/00/93/1133100093.db2.gz IPIRKKUGRISBGC-UHFFFAOYSA-N 1 1 334.895 3.724 20 10 EHCDMO CC[N@@H+](Cc1cn2cccc(F)c2n1)Cc1ccc(N(C)C)cc1 ZINC000768134656 1133100257 /nfs/dbraw/zinc/10/02/57/1133100257.db2.gz SMOMQEIPMPCXBD-UHFFFAOYSA-N 1 1 326.419 3.562 20 10 EHCDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1c(O)cccc1OC ZINC000768170136 1133105394 /nfs/dbraw/zinc/10/53/94/1133105394.db2.gz KYRFVMIQFAMPDD-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1c(O)cccc1OC ZINC000768170136 1133105397 /nfs/dbraw/zinc/10/53/97/1133105397.db2.gz KYRFVMIQFAMPDD-UHFFFAOYSA-N 1 1 342.439 3.560 20 10 EHCDMO CC[N@@H+](CC(=O)NC)Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000768308074 1133123459 /nfs/dbraw/zinc/12/34/59/1133123459.db2.gz MHOPCUPQJSKIFH-UHFFFAOYSA-N 1 1 334.504 3.555 20 10 EHCDMO CCOc1ccc(CNc2ccc3c(c2)[nH+]cn3C)cc1OCC ZINC001178037693 1133131041 /nfs/dbraw/zinc/13/10/41/1133131041.db2.gz XDAPOQXOZUSNEV-UHFFFAOYSA-N 1 1 325.412 3.983 20 10 EHCDMO CCC[N@@H+](Cc1cc2c(cc1O)OC[C@H]2O)[C@H]1CCc2ccccc21 ZINC000768443246 1133139576 /nfs/dbraw/zinc/13/95/76/1133139576.db2.gz BZGITQFBZFWJFW-AZUAARDMSA-N 1 1 339.435 3.718 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2ccccc2)cc1OC ZINC000768441536 1133139708 /nfs/dbraw/zinc/13/97/08/1133139708.db2.gz DFPBTPHJSZUGKU-LJQANCHMSA-N 1 1 327.424 3.993 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+]1CCO[C@H](c3cccc(F)c3)C1)CCCC2 ZINC000768452735 1133141483 /nfs/dbraw/zinc/14/14/83/1133141483.db2.gz SBQVQLNNNAVWQQ-NRFANRHFSA-N 1 1 341.426 3.984 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3cccc(F)c3)C1)CCCC2 ZINC000768452735 1133141485 /nfs/dbraw/zinc/14/14/85/1133141485.db2.gz SBQVQLNNNAVWQQ-NRFANRHFSA-N 1 1 341.426 3.984 20 10 EHCDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768530251 1133150394 /nfs/dbraw/zinc/15/03/94/1133150394.db2.gz GFXRTAXZMNTGOV-QGZVFWFLSA-N 1 1 327.424 3.746 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CC(=O)OC(C)C)C2)c1O ZINC000768529147 1133150543 /nfs/dbraw/zinc/15/05/43/1133150543.db2.gz MBRHZGJTRWHPEV-CQSZACIVSA-N 1 1 339.863 3.908 20 10 EHCDMO CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC001178304392 1133155531 /nfs/dbraw/zinc/15/55/31/1133155531.db2.gz GCTHTRWGJCUZIG-DYZYQPBXSA-N 1 1 325.330 3.675 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3cccc(OC)c3)C2)cc1 ZINC000773766281 1133193485 /nfs/dbraw/zinc/19/34/85/1133193485.db2.gz QIYUMZKPVOQLPP-OAQYLSRUSA-N 1 1 340.467 3.725 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](c3cccc(OC)c3)C2)cc1 ZINC000773766281 1133193489 /nfs/dbraw/zinc/19/34/89/1133193489.db2.gz QIYUMZKPVOQLPP-OAQYLSRUSA-N 1 1 340.467 3.725 20 10 EHCDMO CCOc1cccc(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1O ZINC000768914354 1133202010 /nfs/dbraw/zinc/20/20/10/1133202010.db2.gz WUFOYAHZADKASF-JZXOWHBKSA-N 1 1 332.488 3.628 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cnc(Cl)c(C)c3)CC2)cc1 ZINC000768999365 1133219395 /nfs/dbraw/zinc/21/93/95/1133219395.db2.gz WHJVQKKBVPBJSU-UHFFFAOYSA-N 1 1 345.874 3.764 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000769144943 1133231849 /nfs/dbraw/zinc/23/18/49/1133231849.db2.gz LBXZLCXVBYWPLU-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@H]1CN1CCCC1 ZINC000769144943 1133231855 /nfs/dbraw/zinc/23/18/55/1133231855.db2.gz LBXZLCXVBYWPLU-NRFANRHFSA-N 1 1 327.516 3.737 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2cn(C)nc2C(F)(F)F)cc1 ZINC000773811279 1133241921 /nfs/dbraw/zinc/24/19/21/1133241921.db2.gz XUHDJMVIXRJIBY-UHFFFAOYSA-N 1 1 340.393 3.527 20 10 EHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](c2cnn(C)c2)c2cccc(F)c2)c1 ZINC000769232134 1133247920 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c1cc(N2CCOCC2)ccc1C[N@H+]1CCSC2(CCCCC2)C1 ZINC000769501347 1133303196 /nfs/dbraw/zinc/30/31/96/1133303196.db2.gz DEMVZGCEFIHJLE-UHFFFAOYSA-N 1 1 346.540 3.775 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(O)c1 ZINC000769513350 1133306416 /nfs/dbraw/zinc/30/64/16/1133306416.db2.gz BIPJMWNNVOTFEQ-UGSOOPFHSA-N 1 1 333.453 3.814 20 10 EHCDMO CCOc1ccc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(O)c1 ZINC000769513350 1133306420 /nfs/dbraw/zinc/30/64/20/1133306420.db2.gz BIPJMWNNVOTFEQ-UGSOOPFHSA-N 1 1 333.453 3.814 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](OCc3c(C)noc3C)C2)cc1 ZINC000773843497 1133347015 /nfs/dbraw/zinc/34/70/15/1133347015.db2.gz BPJACHYXEQBBEW-LJQANCHMSA-N 1 1 343.471 3.539 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000770288869 1133405245 /nfs/dbraw/zinc/40/52/45/1133405245.db2.gz CFBXGJFVHSLHRQ-XJKSGUPXSA-N 1 1 333.453 3.550 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1 ZINC000770303536 1133408514 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CC[N@@H+](Cc1c2cc(F)ccc2n(C)c1C(=O)OC)CC(C)(C)C ZINC001182021697 1133567701 /nfs/dbraw/zinc/56/77/01/1133567701.db2.gz ZLOIVPLNPHYWAN-UHFFFAOYSA-N 1 1 334.435 3.972 20 10 EHCDMO Oc1cc(F)c(F)cc1CN1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC001182160352 1133581005 /nfs/dbraw/zinc/58/10/05/1133581005.db2.gz ITJZINUHAZHRKU-HNNXBMFYSA-N 1 1 330.378 3.655 20 10 EHCDMO C[C@@H]([NH2+]CCOC[C@H]1CCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774187779 1133629134 /nfs/dbraw/zinc/62/91/34/1133629134.db2.gz HHZFGNFFBIXWFJ-GHMZBOCLSA-N 1 1 334.243 3.545 20 10 EHCDMO C[C@@H]([NH2+]CCCNc1ncccn1)c1cc(Cl)c(Cl)cc1O ZINC000774219554 1133641069 /nfs/dbraw/zinc/64/10/69/1133641069.db2.gz RSVLTGYTAUDVMN-SNVBAGLBSA-N 1 1 341.242 3.642 20 10 EHCDMO C[C@H](Nc1cc[nH+]c(N2CCCCC2)n1)c1ccc(N(C)C)cc1 ZINC000772299825 1133670395 /nfs/dbraw/zinc/67/03/95/1133670395.db2.gz XGYOPGZSWNMVOB-HNNXBMFYSA-N 1 1 325.460 3.706 20 10 EHCDMO CN(C)c1ccc(/C=C/c2ccc(NC(=O)C3([NH+](C)C)CC3)cc2)cc1 ZINC001182601473 1133709491 /nfs/dbraw/zinc/70/94/91/1133709491.db2.gz WQJNFMBHPNITRL-AATRIKPKSA-N 1 1 349.478 3.956 20 10 EHCDMO C[C@@H]([NH2+]CCN1CCc2c(Cl)cccc2C1)c1ccc(F)cc1O ZINC000785569299 1133727761 /nfs/dbraw/zinc/72/77/61/1133727761.db2.gz DFFWUWGISXLAHQ-CYBMUJFWSA-N 1 1 348.849 3.894 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@H](C(C)(C)O)C2)c(O)c(C(C)(C)C)c1 ZINC001183696014 1133842386 /nfs/dbraw/zinc/84/23/86/1133842386.db2.gz HODSTBJEHBCTRM-HNNXBMFYSA-N 1 1 335.488 3.681 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)cc1F ZINC001183801575 1133859752 /nfs/dbraw/zinc/85/97/52/1133859752.db2.gz SOWQUAPBFBXUFO-OXJNMPFZSA-N 1 1 328.406 3.804 20 10 EHCDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccc(OC)c1O ZINC000787330834 1133989313 /nfs/dbraw/zinc/98/93/13/1133989313.db2.gz FDQXFOJYOZNHDO-INIZCTEOSA-N 1 1 335.831 3.874 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000774909413 1134116602 /nfs/dbraw/zinc/11/66/02/1134116602.db2.gz MSGKAZAFKGUFQB-DOMZBBRYSA-N 1 1 346.383 3.875 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccc(C)cc1 ZINC000774942210 1134140210 /nfs/dbraw/zinc/14/02/10/1134140210.db2.gz IVEGCRSFROPNEV-HNNXBMFYSA-N 1 1 330.384 3.858 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCN(c3ccccc3F)C[C@H]2C)c1O ZINC000788785238 1134174934 /nfs/dbraw/zinc/17/49/34/1134174934.db2.gz YAEJYKCCQQDPIH-OAHLLOKOSA-N 1 1 344.430 3.559 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC001203643523 1134242312 /nfs/dbraw/zinc/24/23/12/1134242312.db2.gz WVVCACIDQGFTHW-ZDUSSCGKSA-N 1 1 333.229 3.539 20 10 EHCDMO Cc1cc(C(=O)C[N@H+](C)CCCCCO)c(C)n1-c1ccccc1C ZINC000789339234 1134259131 /nfs/dbraw/zinc/25/91/31/1134259131.db2.gz ASVKQQVVBPYFDN-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CCCCCO)c(C)n1-c1ccccc1C ZINC000789339234 1134259138 /nfs/dbraw/zinc/25/91/38/1134259138.db2.gz ASVKQQVVBPYFDN-UHFFFAOYSA-N 1 1 342.483 3.680 20 10 EHCDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775070049 1134284068 /nfs/dbraw/zinc/28/40/68/1134284068.db2.gz HDJPQOUKMSAVSO-MRXNPFEDSA-N 1 1 342.395 3.646 20 10 EHCDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000789593418 1134304377 /nfs/dbraw/zinc/30/43/77/1134304377.db2.gz PUDKZKBWGPWVLJ-MRXNPFEDSA-N 1 1 342.277 3.528 20 10 EHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1CCC2(CC1)OCCO2 ZINC000789743779 1134330756 /nfs/dbraw/zinc/33/07/56/1134330756.db2.gz GILPAFVUFNBVMC-UHFFFAOYSA-N 1 1 332.488 3.508 20 10 EHCDMO COc1ccc(OC)c(CC[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790957690 1134485789 /nfs/dbraw/zinc/48/57/89/1134485789.db2.gz AEHJYIOAUQVINP-UHFFFAOYSA-N 1 1 339.794 3.534 20 10 EHCDMO CN1CC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)[C@H]1c1ccccc1 ZINC000790981870 1134495756 /nfs/dbraw/zinc/49/57/56/1134495756.db2.gz ZILLDKGROVUEOS-MAUKXSAKSA-N 1 1 334.822 3.720 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@H](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000775203256 1134516728 /nfs/dbraw/zinc/51/67/28/1134516728.db2.gz BRTKNQJCIZYGFG-CQSZACIVSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@H](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000775203256 1134516732 /nfs/dbraw/zinc/51/67/32/1134516732.db2.gz BRTKNQJCIZYGFG-CQSZACIVSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nnc(-c3cccs3)o2)c1 ZINC000775375940 1134684120 /nfs/dbraw/zinc/68/41/20/1134684120.db2.gz POCXIAJYIUGUQM-WDEREUQCSA-N 1 1 345.424 3.924 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3c(F)ccc(C)c3F)CC2)cc1 ZINC001190447428 1134702500 /nfs/dbraw/zinc/70/25/00/1134702500.db2.gz SYVYQUMALPIFJF-UHFFFAOYSA-N 1 1 346.421 3.994 20 10 EHCDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001190549620 1134717427 /nfs/dbraw/zinc/71/74/27/1134717427.db2.gz CYXORVNJEJSHGP-HKUYNNGSSA-N 1 1 345.531 3.578 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c(C(F)(F)F)c1 ZINC000792843520 1134806887 /nfs/dbraw/zinc/80/68/87/1134806887.db2.gz ONOZGMWCJPSKEO-RHSMWYFYSA-N 1 1 342.405 3.772 20 10 EHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Br)ccc1O ZINC000793230313 1134879467 /nfs/dbraw/zinc/87/94/67/1134879467.db2.gz FWCWPGADICJRNB-GZMMTYOYSA-N 1 1 338.167 3.927 20 10 EHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1 ZINC000793340544 1134902048 /nfs/dbraw/zinc/90/20/48/1134902048.db2.gz QJBPCWAIZGDZNN-INIZCTEOSA-N 1 1 342.277 3.854 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)Cc2cnccc2C)c1 ZINC000793338160 1134908530 /nfs/dbraw/zinc/90/85/30/1134908530.db2.gz CTLRSFJXYUNCAQ-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)Cc2cnccc2C)c1 ZINC000793338160 1134908537 /nfs/dbraw/zinc/90/85/37/1134908537.db2.gz CTLRSFJXYUNCAQ-UHFFFAOYSA-N 1 1 335.245 3.799 20 10 EHCDMO COc1ccc(CNC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c(O)c1 ZINC000793390885 1134921491 /nfs/dbraw/zinc/92/14/91/1134921491.db2.gz TYJJNMXOBMCDDR-YJBOKZPZSA-N 1 1 332.488 3.534 20 10 EHCDMO CN1CCN(c2ccc(C[N@H+](C)C(C)(C)c3ccccc3)cc2)CC1 ZINC000793610702 1134971872 /nfs/dbraw/zinc/97/18/72/1134971872.db2.gz WKNDSIMSZAJEHI-UHFFFAOYSA-N 1 1 337.511 3.806 20 10 EHCDMO CN1CCN(c2ccc(C[N@@H+](C)C(C)(C)c3ccccc3)cc2)CC1 ZINC000793610702 1134971879 /nfs/dbraw/zinc/97/18/79/1134971879.db2.gz WKNDSIMSZAJEHI-UHFFFAOYSA-N 1 1 337.511 3.806 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCOC1(C)C)c1cc(Br)c(F)cc1O ZINC000834875715 1135396154 /nfs/dbraw/zinc/39/61/54/1135396154.db2.gz SJVCYLHURBLHFA-AMIZOPFISA-N 1 1 332.213 3.512 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000775646522 1135401623 /nfs/dbraw/zinc/40/16/23/1135401623.db2.gz JRFUGBMQDWLFIM-UHFFFAOYSA-N 1 1 328.456 3.879 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cc1 ZINC001195500101 1135434818 /nfs/dbraw/zinc/43/48/18/1135434818.db2.gz ZXZSJSVQVJWSPT-LPHOPBHVSA-N 1 1 346.515 3.942 20 10 EHCDMO CN(C)c1ccc(C[N@@H+]2C[C@@H](C(=O)OC(C)(C)C)[C@H](C3CC3)C2)cc1 ZINC001197621818 1135709377 /nfs/dbraw/zinc/70/93/77/1135709377.db2.gz LDERSWDABNEJEW-RBUKOAKNSA-N 1 1 344.499 3.552 20 10 EHCDMO Cc1ccc(-c2nnc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)o2)cc1 ZINC000775834495 1135789673 /nfs/dbraw/zinc/78/96/73/1135789673.db2.gz TXQLFHBIDRPLBW-HNNXBMFYSA-N 1 1 336.439 3.962 20 10 EHCDMO CCOc1ccc(NCc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001199015033 1135871938 /nfs/dbraw/zinc/87/19/38/1135871938.db2.gz ZPBRVAXNZZAMQN-UHFFFAOYSA-N 1 1 343.446 3.588 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000809703504 1135874246 /nfs/dbraw/zinc/87/42/46/1135874246.db2.gz LDMSROCJULFMKC-QFIPXVFZSA-N 1 1 336.479 3.799 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000809703504 1135874250 /nfs/dbraw/zinc/87/42/50/1135874250.db2.gz LDMSROCJULFMKC-QFIPXVFZSA-N 1 1 336.479 3.799 20 10 EHCDMO Cc1cccc(C[N@@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1O ZINC000809702929 1135874649 /nfs/dbraw/zinc/87/46/49/1135874649.db2.gz AXIPDOPCRWEMTD-JOCHJYFZSA-N 1 1 336.479 3.799 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1O ZINC000809702929 1135874651 /nfs/dbraw/zinc/87/46/51/1135874651.db2.gz AXIPDOPCRWEMTD-JOCHJYFZSA-N 1 1 336.479 3.799 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000809715370 1135876938 /nfs/dbraw/zinc/87/69/38/1135876938.db2.gz IDNKPNKENSYQSG-DYVFJYSZSA-N 1 1 342.395 3.892 20 10 EHCDMO C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766800 1135879525 /nfs/dbraw/zinc/87/95/25/1135879525.db2.gz AYDWBIJOZOEAIV-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766800 1135879527 /nfs/dbraw/zinc/87/95/27/1135879527.db2.gz AYDWBIJOZOEAIV-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766800 1135879529 /nfs/dbraw/zinc/87/95/29/1135879529.db2.gz AYDWBIJOZOEAIV-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000809766800 1135879531 /nfs/dbraw/zinc/87/95/31/1135879531.db2.gz AYDWBIJOZOEAIV-XHDPSFHLSA-N 1 1 329.271 3.615 20 10 EHCDMO CCC[N@@H+](CCC[NH+](C)C)Cc1cc(C)cc(Br)c1[O-] ZINC000809756838 1135888087 /nfs/dbraw/zinc/88/80/87/1135888087.db2.gz PHAUYIJLIBGINP-UHFFFAOYSA-N 1 1 343.309 3.627 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](Sc3ccncc3)C2)cc1 ZINC001203933569 1135899251 /nfs/dbraw/zinc/89/92/51/1135899251.db2.gz ABLBWZPIXWGUSL-LJQANCHMSA-N 1 1 327.497 3.904 20 10 EHCDMO CCOC(=O)CC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000776003199 1135916984 /nfs/dbraw/zinc/91/69/84/1135916984.db2.gz HSWOPBVMOUXWSV-MRXNPFEDSA-N 1 1 327.424 3.909 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)[C@](C)(CNC(=O)OC(C)(C)C)C2)c1 ZINC000810164646 1135933904 /nfs/dbraw/zinc/93/39/04/1135933904.db2.gz LCBUAQBOLMFDHZ-FOIQADDNSA-N 1 1 348.487 3.683 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1O ZINC000810211080 1135943248 /nfs/dbraw/zinc/94/32/48/1135943248.db2.gz LNUYZAFSEBHCPJ-WFASDCNBSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211080 1135943250 /nfs/dbraw/zinc/94/32/50/1135943250.db2.gz LNUYZAFSEBHCPJ-WFASDCNBSA-N 1 1 330.394 3.794 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810211080 1135943251 /nfs/dbraw/zinc/94/32/51/1135943251.db2.gz LNUYZAFSEBHCPJ-WFASDCNBSA-N 1 1 330.394 3.794 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)c1O ZINC000811512942 1136102762 /nfs/dbraw/zinc/10/27/62/1136102762.db2.gz BDNFNZMASLEILH-OAHLLOKOSA-N 1 1 340.261 3.784 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812736850 1136239926 /nfs/dbraw/zinc/23/99/26/1136239926.db2.gz OQKGHEJUKDNDMY-ZIAGYGMSSA-N 1 1 332.394 3.848 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@H](C(=O)N1CCCCC1)c1ccccc1 ZINC000109771735 1136339951 /nfs/dbraw/zinc/33/99/51/1136339951.db2.gz LXNAPZIODXSYAS-FQEVSTJZSA-N 1 1 338.451 3.578 20 10 EHCDMO C[C@@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000774211118 1136364885 /nfs/dbraw/zinc/36/48/85/1136364885.db2.gz CRQCXOKKKNVOBW-BMIGLBTASA-N 1 1 349.327 3.787 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc2ccccc2n(C)c1=O)c1ccc(F)cc1O ZINC000813880866 1136371976 /nfs/dbraw/zinc/37/19/76/1136371976.db2.gz ILUBBFYRAAMANK-QGZVFWFLSA-N 1 1 340.398 3.624 20 10 EHCDMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000851716467 1136401107 /nfs/dbraw/zinc/40/11/07/1136401107.db2.gz MYNMEPZVWXFZTP-OAHLLOKOSA-N 1 1 326.431 3.636 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@@H]1CC[C@H](OC)C1 ZINC000851791741 1136407370 /nfs/dbraw/zinc/40/73/70/1136407370.db2.gz CMJQBXAYAKAPBX-KGLIPLIRSA-N 1 1 328.250 3.544 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@@H]1CC[C@@H](OC)C1 ZINC000851791743 1136407571 /nfs/dbraw/zinc/40/75/71/1136407571.db2.gz CMJQBXAYAKAPBX-ZIAGYGMSSA-N 1 1 328.250 3.544 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000774833279 1136414792 /nfs/dbraw/zinc/41/47/92/1136414792.db2.gz NMQCSBZTWGJLDR-MRXNPFEDSA-N 1 1 342.395 3.955 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@H](N3CCCC3=O)C2)c(O)c(C(C)(C)C)c1 ZINC000111170981 1136519274 /nfs/dbraw/zinc/51/92/74/1136519274.db2.gz XBUVYTOMIBHYNW-KRWDZBQOSA-N 1 1 344.499 3.585 20 10 EHCDMO C[C@@H](NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000111236035 1136524773 /nfs/dbraw/zinc/52/47/73/1136524773.db2.gz GMXQBOJXPPHOOV-ZIAGYGMSSA-N 1 1 346.858 3.743 20 10 EHCDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1N(C)C ZINC000815116262 1136551316 /nfs/dbraw/zinc/55/13/16/1136551316.db2.gz GUAOWIGRLAJEHJ-UHFFFAOYSA-N 1 1 327.428 3.644 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815554391 1136609935 /nfs/dbraw/zinc/60/99/35/1136609935.db2.gz YQDVMLZPIKLGCE-ABAIWWIYSA-N 1 1 325.330 3.795 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000815593552 1136615918 /nfs/dbraw/zinc/61/59/18/1136615918.db2.gz PXJQIYDONMFSMZ-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000815627699 1136621476 /nfs/dbraw/zinc/62/14/76/1136621476.db2.gz HDQDLHFRYJAHCW-IEBWSBKVSA-N 1 1 347.462 3.936 20 10 EHCDMO COc1ccc(CCC[N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)cc1 ZINC000748049839 1136682433 /nfs/dbraw/zinc/68/24/33/1136682433.db2.gz WEKPHJFMCKUODD-UHFFFAOYSA-N 1 1 345.414 3.807 20 10 EHCDMO COc1ccc(CCC[N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)cc1 ZINC000748049839 1136682434 /nfs/dbraw/zinc/68/24/34/1136682434.db2.gz WEKPHJFMCKUODD-UHFFFAOYSA-N 1 1 345.414 3.807 20 10 EHCDMO O=C1C[C@H](c2ccccc2)[N@@H+](Cc2ccc3ccccc3c2O)CCN1 ZINC000816493628 1136724455 /nfs/dbraw/zinc/72/44/55/1136724455.db2.gz IMNCOCYKKNOUQB-HXUWFJFHSA-N 1 1 346.430 3.609 20 10 EHCDMO Cn1cc(C[N@@H+](C)Cc2ccc3ccccc3c2O)c(C(F)(F)F)n1 ZINC000816521410 1136727057 /nfs/dbraw/zinc/72/70/57/1136727057.db2.gz OLRFMCYBWVSSEC-UHFFFAOYSA-N 1 1 349.356 3.930 20 10 EHCDMO Oc1c(CNc2ccc(C[NH+]3CCOCC3)cc2)ccc2ccccc21 ZINC000816524451 1136733850 /nfs/dbraw/zinc/73/38/50/1136733850.db2.gz GAZBZFYBTOYDLQ-UHFFFAOYSA-N 1 1 348.446 3.990 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c(C(F)(F)F)c1 ZINC000816630393 1136739145 /nfs/dbraw/zinc/73/91/45/1136739145.db2.gz CKVJDVXDQSDBPS-MRXNPFEDSA-N 1 1 342.405 3.651 20 10 EHCDMO OC[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(Cl)cc1 ZINC000816612525 1136740740 /nfs/dbraw/zinc/74/07/40/1136740740.db2.gz QZQYAGFFQZAARS-GFCCVEGCSA-N 1 1 344.213 3.704 20 10 EHCDMO c1ccc([C@H]2CCC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000816619798 1136742407 /nfs/dbraw/zinc/74/24/07/1136742407.db2.gz WAYNWMDUDFKLMG-NRFANRHFSA-N 1 1 336.479 3.903 20 10 EHCDMO CN1CCC[C@]2(CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642400 1136743435 /nfs/dbraw/zinc/74/34/35/1136743435.db2.gz YMDRXAOOFMICBZ-NRFANRHFSA-N 1 1 327.516 3.595 20 10 EHCDMO CN1CCC[C@]2(CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642400 1136743437 /nfs/dbraw/zinc/74/34/37/1136743437.db2.gz YMDRXAOOFMICBZ-NRFANRHFSA-N 1 1 327.516 3.595 20 10 EHCDMO C[N@@H+]1CCC[C@]2(CCN(Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642400 1136743440 /nfs/dbraw/zinc/74/34/40/1136743440.db2.gz YMDRXAOOFMICBZ-NRFANRHFSA-N 1 1 327.516 3.595 20 10 EHCDMO C[N@H+]1CCC[C@]2(CCN(Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642400 1136743443 /nfs/dbraw/zinc/74/34/43/1136743443.db2.gz YMDRXAOOFMICBZ-NRFANRHFSA-N 1 1 327.516 3.595 20 10 EHCDMO COC1([C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000817586720 1136826153 /nfs/dbraw/zinc/82/61/53/1136826153.db2.gz AGTZFDWWEJAHNS-NWDGAFQWSA-N 1 1 347.377 3.646 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000817938259 1136847249 /nfs/dbraw/zinc/84/72/49/1136847249.db2.gz HNWOJODDCHVWBO-XIKOKIGWSA-N 1 1 335.854 3.896 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817938727 1136847421 /nfs/dbraw/zinc/84/74/21/1136847421.db2.gz QZILMPSVNLKVNX-MOPGFXCFSA-N 1 1 329.875 3.683 20 10 EHCDMO CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817938595 1136847617 /nfs/dbraw/zinc/84/76/17/1136847617.db2.gz OABPWQKOFVCOOZ-DNVCBOLYSA-N 1 1 327.472 3.502 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1[O-] ZINC000817948448 1136850468 /nfs/dbraw/zinc/85/04/68/1136850468.db2.gz KGXCMYIXQDGODK-GFCCVEGCSA-N 1 1 349.272 3.507 20 10 EHCDMO CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817981341 1136854917 /nfs/dbraw/zinc/85/49/17/1136854917.db2.gz REMXTAFGKBCAPA-HIFRSBDPSA-N 1 1 341.293 3.728 20 10 EHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2c3ccccc3CN(C)C2=O)cc1 ZINC000857874400 1136916993 /nfs/dbraw/zinc/91/69/93/1136916993.db2.gz MAUHVKGAUVZRIQ-MGPUTAFESA-N 1 1 337.467 3.507 20 10 EHCDMO C[NH+](C)Cc1cccc(C[NH2+]Cc2c([O-])cccc2Br)c1 ZINC000858091530 1136938675 /nfs/dbraw/zinc/93/86/75/1136938675.db2.gz AHNPZCALQFMGEQ-UHFFFAOYSA-N 1 1 349.272 3.506 20 10 EHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)cc1F ZINC000858133495 1136942537 /nfs/dbraw/zinc/94/25/37/1136942537.db2.gz WLVCXYBUYVFEBM-MRXNPFEDSA-N 1 1 336.357 3.783 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@@H](n3ccnn3)C2)c(O)c(C(C)(C)C)c1 ZINC000819898210 1136965416 /nfs/dbraw/zinc/96/54/16/1136965416.db2.gz VXKXGSQIRJUMTM-QGZVFWFLSA-N 1 1 342.487 3.681 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1ccc(F)cc1O ZINC000858449955 1136969193 /nfs/dbraw/zinc/96/91/93/1136969193.db2.gz WLFAJQFLMNSHSY-JSGCOSHPSA-N 1 1 331.313 3.572 20 10 EHCDMO C[C@@H]1C[C@@H](C[N@@H+](C)Cc2ccccc2O)CCN1C(=O)OC(C)(C)C ZINC000823409136 1137098752 /nfs/dbraw/zinc/09/87/52/1137098752.db2.gz VMCZVMVFONNZHT-CVEARBPZSA-N 1 1 348.487 3.860 20 10 EHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CC2(CO)CC2)cc1 ZINC000824236748 1137127823 /nfs/dbraw/zinc/12/78/23/1137127823.db2.gz MHHXXLIJGKUBSF-UHFFFAOYSA-N 1 1 330.497 3.589 20 10 EHCDMO C[N@H+](Cc1ccnn1CC1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000824474934 1137139147 /nfs/dbraw/zinc/13/91/47/1137139147.db2.gz WZMNLZNJJAZLFW-UHFFFAOYSA-N 1 1 338.499 3.915 20 10 EHCDMO C[N@@H+](Cc1ccnn1CC1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000824474934 1137139148 /nfs/dbraw/zinc/13/91/48/1137139148.db2.gz WZMNLZNJJAZLFW-UHFFFAOYSA-N 1 1 338.499 3.915 20 10 EHCDMO C[C@]12CC[N@@H+](Cc3c(O)cccc3Br)C[C@H]1C2(F)F ZINC000862376411 1137141220 /nfs/dbraw/zinc/14/12/20/1137141220.db2.gz YLDIKBQDQDFYBP-OLZOCXBDSA-N 1 1 332.188 3.632 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473307 1137145900 /nfs/dbraw/zinc/14/59/00/1137145900.db2.gz NFCQEUAIOLXIAS-NEPJUHHUSA-N 1 1 328.275 3.625 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473307 1137145902 /nfs/dbraw/zinc/14/59/02/1137145902.db2.gz NFCQEUAIOLXIAS-NEPJUHHUSA-N 1 1 328.275 3.625 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2cc(Br)cc(C)c2O)CC1(C)C ZINC000824820820 1137153839 /nfs/dbraw/zinc/15/38/39/1137153839.db2.gz OBZQEEFZTLLYHL-AWEZNQCLSA-N 1 1 342.277 3.710 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000119307310 1137171883 /nfs/dbraw/zinc/17/18/83/1137171883.db2.gz AKZHYUKZNUKRPN-UHFFFAOYSA-N 1 1 337.511 3.849 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@]2(CCOC2)O1 ZINC000794693382 1137234212 /nfs/dbraw/zinc/23/42/12/1137234212.db2.gz IQXDPVTYOMLWBQ-FXAWDEMLSA-N 1 1 333.472 3.594 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3ccc(F)cc3[C@@H](C)C2)cc1OC ZINC000844757019 1137250207 /nfs/dbraw/zinc/25/02/07/1137250207.db2.gz DSPILJOTGVAWOY-ZDUSSCGKSA-N 1 1 345.414 3.710 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cccnc2Br)cc1 ZINC000865419022 1137282153 /nfs/dbraw/zinc/28/21/53/1137282153.db2.gz SFASUDIRLBTOJJ-UHFFFAOYSA-N 1 1 348.288 3.980 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c(F)c1 ZINC000845902877 1137319302 /nfs/dbraw/zinc/31/93/02/1137319302.db2.gz JSDCXVZGBDUJBS-SFHVURJKSA-N 1 1 345.414 3.721 20 10 EHCDMO Oc1cccc2c1C[N@H+]([C@H]1CCc3cc(F)c(F)c(F)c3C1)CC2 ZINC001171543521 1137494408 /nfs/dbraw/zinc/49/44/08/1137494408.db2.gz LCLWIGOATQMWOC-ZDUSSCGKSA-N 1 1 333.353 3.725 20 10 EHCDMO C[C@H]1C[C@@H](N(C)Cc2ccc(N(C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC001171767756 1137509495 /nfs/dbraw/zinc/50/94/95/1137509495.db2.gz PMIDPONTCDTZBP-PGRDOPGGSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767756 1137509497 /nfs/dbraw/zinc/50/94/97/1137509497.db2.gz PMIDPONTCDTZBP-PGRDOPGGSA-N 1 1 337.511 3.847 20 10 EHCDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 ZINC001171767756 1137509498 /nfs/dbraw/zinc/50/94/98/1137509498.db2.gz PMIDPONTCDTZBP-PGRDOPGGSA-N 1 1 337.511 3.847 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000876585843 1137656289 /nfs/dbraw/zinc/65/62/89/1137656289.db2.gz XREJHVRNXILPPM-HXUWFJFHSA-N 1 1 336.479 3.637 20 10 EHCDMO COc1ccccc1-c1noc([C@@H](C)[NH2+]Cc2c(C)cccc2O)n1 ZINC000877471153 1137677227 /nfs/dbraw/zinc/67/72/27/1137677227.db2.gz RNKBUQXHKUOAEU-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc(N3CCOC3=O)c2)c(O)c1 ZINC000877485588 1137678099 /nfs/dbraw/zinc/67/80/99/1137678099.db2.gz ZYIBKVKYNWRSGM-OAHLLOKOSA-N 1 1 340.423 3.850 20 10 EHCDMO CCCC[N@@H+](Cc1ccccc1O)Cc1cccn(C(F)F)c1=O ZINC000877503749 1137678824 /nfs/dbraw/zinc/67/88/24/1137678824.db2.gz VOZXBPJXASKHJA-UHFFFAOYSA-N 1 1 336.382 3.751 20 10 EHCDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3ccc(F)c(F)c3[O-])CC2)nn1 ZINC000877564899 1137681364 /nfs/dbraw/zinc/68/13/64/1137681364.db2.gz PEVLVRSEIUFEON-UHFFFAOYSA-N 1 1 348.397 3.522 20 10 EHCDMO CCC[N@@H+](Cc1csc(-c2ccn(C)n2)n1)Cc1ccccc1O ZINC000878150837 1137704547 /nfs/dbraw/zinc/70/45/47/1137704547.db2.gz JDNYEWPAZUSOIR-UHFFFAOYSA-N 1 1 342.468 3.661 20 10 EHCDMO COc1cc(-c2noc(C[NH2+][C@@H](C)c3ccccc3O)n2)ccc1C ZINC000879650521 1137753798 /nfs/dbraw/zinc/75/37/98/1137753798.db2.gz FZACNASNVVGWJV-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO C[C@H]([NH2+]Cc1nccn1Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000129430048 1137820528 /nfs/dbraw/zinc/82/05/28/1137820528.db2.gz LEWVEJUQWZEZRM-KRWDZBQOSA-N 1 1 334.467 3.848 20 10 EHCDMO CCOc1cccc(C[N@@H+](Cc2ccccc2OC)C2CC2)c1O ZINC000130168029 1137834673 /nfs/dbraw/zinc/83/46/73/1137834673.db2.gz BOHJKXSNDUJWNN-UHFFFAOYSA-N 1 1 327.424 3.964 20 10 EHCDMO CCCC(=O)Nc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882895913 1137837125 /nfs/dbraw/zinc/83/71/25/1137837125.db2.gz XJOBXXJQSPRQQQ-UHFFFAOYSA-N 1 1 334.366 3.699 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2cccc(F)c2)CCOCC1 ZINC000883025027 1137841945 /nfs/dbraw/zinc/84/19/45/1137841945.db2.gz VYJAPJYOZHJYIB-UHFFFAOYSA-N 1 1 337.341 3.605 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H](O)c1c(F)cccc1F ZINC000883025398 1137841953 /nfs/dbraw/zinc/84/19/53/1137841953.db2.gz JAZSMGCJBQGZOX-WMLDXEAASA-N 1 1 343.320 3.550 20 10 EHCDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c(C)c1OC ZINC000883120353 1137845321 /nfs/dbraw/zinc/84/53/21/1137845321.db2.gz APOARGRXQRSIPG-LLVKDONJSA-N 1 1 337.366 3.847 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000883192995 1137847952 /nfs/dbraw/zinc/84/79/52/1137847952.db2.gz MGUPIAGUHZXOEL-WBVHZDCISA-N 1 1 341.304 3.568 20 10 EHCDMO OC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(C(F)(F)F)c1 ZINC000883193337 1137848058 /nfs/dbraw/zinc/84/80/58/1137848058.db2.gz UGPCOOOBSQJQNE-CQSZACIVSA-N 1 1 347.283 3.512 20 10 EHCDMO C[C@@H](Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1)c1ccccc1O ZINC000883347827 1137856768 /nfs/dbraw/zinc/85/67/68/1137856768.db2.gz ZTLDKCZHWHKLFV-VQIMIIECSA-N 1 1 337.467 3.850 20 10 EHCDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000101904739 1137871949 /nfs/dbraw/zinc/87/19/49/1137871949.db2.gz DKLRYVOHNMWPEU-INIZCTEOSA-N 1 1 340.467 3.530 20 10 EHCDMO O=[N+]([O-])c1ncccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000886007909 1138031976 /nfs/dbraw/zinc/03/19/76/1138031976.db2.gz BTFNOZZAEDBDIT-UHFFFAOYSA-N 1 1 327.384 3.640 20 10 EHCDMO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)c3c(O)cccc3F)cn2)n1 ZINC000886506379 1138085879 /nfs/dbraw/zinc/08/58/79/1138085879.db2.gz OVDJSZZMWYMMHI-AWEZNQCLSA-N 1 1 340.402 3.580 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886545554 1138094413 /nfs/dbraw/zinc/09/44/13/1138094413.db2.gz NQRPUOMBHHSPAB-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO COCCCOc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886555092 1138095542 /nfs/dbraw/zinc/09/55/42/1138095542.db2.gz KRBSTPBDOUMBTQ-AWEZNQCLSA-N 1 1 333.403 3.797 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c1O ZINC000093684077 1138239654 /nfs/dbraw/zinc/23/96/54/1138239654.db2.gz FZERJHZELLWYFA-GOSISDBHSA-N 1 1 341.451 3.830 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(Br)n1 ZINC001205982538 1138250994 /nfs/dbraw/zinc/25/09/94/1138250994.db2.gz UMHDWLVYDCCGOE-UHFFFAOYSA-N 1 1 348.288 3.932 20 10 EHCDMO COc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000264596422 1138570879 /nfs/dbraw/zinc/57/08/79/1138570879.db2.gz IGXXQBUGEKUJLZ-GFCCVEGCSA-N 1 1 348.830 3.513 20 10 EHCDMO C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385097 1139089115 /nfs/dbraw/zinc/08/91/15/1139089115.db2.gz YEIFFRBBNYANTO-DLBZAZTESA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385097 1139089122 /nfs/dbraw/zinc/08/91/22/1139089122.db2.gz YEIFFRBBNYANTO-DLBZAZTESA-N 1 1 345.506 3.951 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385097 1139089130 /nfs/dbraw/zinc/08/91/30/1139089130.db2.gz YEIFFRBBNYANTO-DLBZAZTESA-N 1 1 345.506 3.951 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nncn2-c2ccccc2)cc1 ZINC000152636365 1139101527 /nfs/dbraw/zinc/10/15/27/1139101527.db2.gz MURGRYGEEPELIH-MRXNPFEDSA-N 1 1 335.455 3.574 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1O ZINC000179427411 1139756557 /nfs/dbraw/zinc/75/65/57/1139756557.db2.gz AXJJEHCZRWVQPJ-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1O ZINC000179427411 1139756561 /nfs/dbraw/zinc/75/65/61/1139756561.db2.gz AXJJEHCZRWVQPJ-SFHVURJKSA-N 1 1 331.387 3.504 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(F)cc1O ZINC000185048937 1140133646 /nfs/dbraw/zinc/13/36/46/1140133646.db2.gz SESSLUPXBKLLLT-KDOFPFPSSA-N 1 1 342.414 3.546 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(Cl)ccc1[O-] ZINC000185054854 1140134079 /nfs/dbraw/zinc/13/40/79/1140134079.db2.gz FNGOHJNFXRYITF-AWEZNQCLSA-N 1 1 348.874 3.837 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc(N2CCOC2=O)c1 ZINC000185157626 1140138254 /nfs/dbraw/zinc/13/82/54/1140138254.db2.gz YFAKCYMIGOYASO-OLZOCXBDSA-N 1 1 344.386 3.900 20 10 EHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cnc([C@@H]3CCCO3)s2)cc1 ZINC000270984820 1141290586 /nfs/dbraw/zinc/29/05/86/1141290586.db2.gz FOUXYESWIGJVRL-KRWDZBQOSA-N 1 1 331.485 3.693 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc([C@@H]3CCCO3)s2)cc1 ZINC000270984820 1141290594 /nfs/dbraw/zinc/29/05/94/1141290594.db2.gz FOUXYESWIGJVRL-KRWDZBQOSA-N 1 1 331.485 3.693 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1O ZINC000271277845 1141338200 /nfs/dbraw/zinc/33/82/00/1141338200.db2.gz OUPJWZVKHFJSLD-HZPDHXFCSA-N 1 1 347.480 3.941 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3OC)C2)c(O)cc1C ZINC000160276715 1016409668 /nfs/dbraw/zinc/40/96/68/1016409668.db2.gz DWXKKMJMNPAZLF-HNNXBMFYSA-N 1 1 327.424 3.707 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cccc(OC(C)C)c2)cc1OC ZINC000160497189 1019348787 /nfs/dbraw/zinc/34/87/87/1019348787.db2.gz OSQXCNIANGXQLA-UHFFFAOYSA-N 1 1 345.439 3.829 20 10 EHCDMO CN(C)c1ccc(C[NH2+][C@@H](CCO)c2ccco2)c(C(F)(F)F)c1 ZINC000280063772 1020021239 /nfs/dbraw/zinc/02/12/39/1020021239.db2.gz YPAXJTFVWQORDX-HNNXBMFYSA-N 1 1 342.361 3.578 20 10 EHCDMO OCC1([C@@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc2)CCC1 ZINC000894857720 1021473615 /nfs/dbraw/zinc/47/36/15/1021473615.db2.gz NIHVGKXPQZNSFT-SFHVURJKSA-N 1 1 333.378 3.664 20 10 EHCDMO COC1CCC(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CC1 ZINC000891468740 1021702788 /nfs/dbraw/zinc/70/27/88/1021702788.db2.gz XAAVVWIXRFNYJZ-KVZIAJEVSA-N 1 1 333.472 3.578 20 10 EHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nnc([C@H](C)CC)[nH]2)c(O)c1 ZINC000277060380 1023728899 /nfs/dbraw/zinc/72/88/99/1023728899.db2.gz BRYZESOXSVVCNS-CHWSQXEVSA-N 1 1 332.448 3.663 20 10 EHCDMO COc1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c(O)c1OC ZINC000892053701 1024499085 /nfs/dbraw/zinc/49/90/85/1024499085.db2.gz YCMSRUSEWDJGPM-QGZVFWFLSA-N 1 1 345.464 3.700 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895580350 1024638507 /nfs/dbraw/zinc/63/85/07/1024638507.db2.gz ANJYSQZGUGZLSW-NSHDSACASA-N 1 1 339.258 3.601 20 10 EHCDMO CCOc1cccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1O ZINC000895788427 1024835195 /nfs/dbraw/zinc/83/51/95/1024835195.db2.gz UQLGDWLDVVBREK-BBRMVZONSA-N 1 1 329.362 3.955 20 10 EHCDMO CC(C)(C)c1coc(C[NH2+]Cc2ccc(Br)cc2O)n1 ZINC000897942067 1033254849 /nfs/dbraw/zinc/25/48/49/1033254849.db2.gz KQQARLZWPSLRHL-UHFFFAOYSA-N 1 1 339.233 3.730 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1 ZINC000896532120 1025546470 /nfs/dbraw/zinc/54/64/70/1025546470.db2.gz SVPSILIVOOCDSU-AWEZNQCLSA-N 1 1 332.469 3.702 20 10 EHCDMO Cc1nc2scc(C3CC3)n2c1C[NH2+]Cc1c(O)cccc1F ZINC000896638018 1025791136 /nfs/dbraw/zinc/79/11/36/1025791136.db2.gz NKSGPWIHKOQZAP-UHFFFAOYSA-N 1 1 331.416 3.716 20 10 EHCDMO CCn1nc(C)c([C@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)n1 ZINC000925010333 1026000323 /nfs/dbraw/zinc/00/03/23/1026000323.db2.gz FNIBHWPYGJKMOE-INIZCTEOSA-N 1 1 341.503 3.694 20 10 EHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1nnc2n1CCCCC2 ZINC000273617288 1027521123 /nfs/dbraw/zinc/52/11/23/1027521123.db2.gz XSNRKVRQXNJJNX-DOMZBBRYSA-N 1 1 332.423 3.651 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000359879023 1027867423 /nfs/dbraw/zinc/86/74/23/1027867423.db2.gz YYVNJXBPSOXZMU-LUQKVYGDSA-N 1 1 340.467 3.744 20 10 EHCDMO COc1ccc(C(=O)C2CC[NH+](Cc3cccc(F)c3O)CC2)cc1 ZINC000272327198 1029417827 /nfs/dbraw/zinc/41/78/27/1029417827.db2.gz VMEUGUAPFAHNGQ-UHFFFAOYSA-N 1 1 343.398 3.635 20 10 EHCDMO COc1cc2c(cc1OC)C[N@H+](Cc1c(O)cccc1Cl)CC2 ZINC000321990798 1029592761 /nfs/dbraw/zinc/59/27/61/1029592761.db2.gz DVNYWDCIMWTTPE-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1cc2c(cc1OC)C[N@@H+](Cc1c(O)cccc1Cl)CC2 ZINC000321990798 1029592769 /nfs/dbraw/zinc/59/27/69/1029592769.db2.gz DVNYWDCIMWTTPE-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000278246802 1029803898 /nfs/dbraw/zinc/80/38/98/1029803898.db2.gz MBOONBWBZYSBKG-JTQLQIEISA-N 1 1 328.243 3.945 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)N(C)Cc1ccccc1 ZINC000174373245 1033911082 /nfs/dbraw/zinc/91/10/82/1033911082.db2.gz SNHQNDKWLBZWGA-KRWDZBQOSA-N 1 1 340.467 3.651 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000179429662 1034308566 /nfs/dbraw/zinc/30/85/66/1034308566.db2.gz XNOSOCYOJQMFIU-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000179429662 1034308572 /nfs/dbraw/zinc/30/85/72/1034308572.db2.gz XNOSOCYOJQMFIU-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1O ZINC000761201907 1034421449 /nfs/dbraw/zinc/42/14/49/1034421449.db2.gz IMXJOCOJTSVKFK-HIFRSBDPSA-N 1 1 327.877 3.914 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000780386119 1035021658 /nfs/dbraw/zinc/02/16/58/1035021658.db2.gz UOPYQBAPFNMPGD-JOYOIKCWSA-N 1 1 333.325 3.897 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000780386119 1035021665 /nfs/dbraw/zinc/02/16/65/1035021665.db2.gz UOPYQBAPFNMPGD-JOYOIKCWSA-N 1 1 333.325 3.897 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)N(C)C)cc1)Cc1cc(C)cc(C)c1O ZINC000164283006 1035514450 /nfs/dbraw/zinc/51/44/50/1035514450.db2.gz RYJYTYGUFCSVPJ-UHFFFAOYSA-N 1 1 340.467 3.733 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(n2cc(Cl)cn2)CC1 ZINC000373821757 1039060448 /nfs/dbraw/zinc/06/04/48/1039060448.db2.gz RLMUMJYXSRQMNP-UHFFFAOYSA-N 1 1 344.217 3.872 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](Cc1ccccc1)CN(C)C)c1ccc(F)cc1O ZINC000796703170 1042509326 /nfs/dbraw/zinc/50/93/26/1042509326.db2.gz SWCQBXFJODLAAC-PKOBYXMFSA-N 1 1 330.447 3.745 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000278882493 1042823179 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20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843125323 1128509450 /nfs/dbraw/zinc/50/94/50/1128509450.db2.gz SLYCJVXHWKRXNS-RYUDHWBXSA-N 1 1 329.271 3.521 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)c2ccccc2F)cc1 ZINC000915361073 1121358755 /nfs/dbraw/zinc/35/87/55/1121358755.db2.gz OYQOCKIQFVRQNR-HXUWFJFHSA-N 1 1 330.447 3.837 20 10 EHCDMO CC[N@@H+](CCOc1ccccc1OC)Cc1ccc(N(C)C)cc1 ZINC000917030716 1122446749 /nfs/dbraw/zinc/44/67/49/1122446749.db2.gz OIZRTMKMYFWTKY-UHFFFAOYSA-N 1 1 328.456 3.662 20 10 EHCDMO CCOc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1O ZINC000154259740 1122457044 /nfs/dbraw/zinc/45/70/44/1122457044.db2.gz NQYDTXXFHWWNBD-UHFFFAOYSA-N 1 1 342.395 3.864 20 10 EHCDMO Fc1cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)ccc1N1CCOCC1 ZINC000155064779 1123125904 /nfs/dbraw/zinc/12/59/04/1123125904.db2.gz KFUMENFMMBYVCG-LJQANCHMSA-N 1 1 340.442 3.652 20 10 EHCDMO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC000179939602 1123900370 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COC(=O)[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001172791415 1131847110 /nfs/dbraw/zinc/84/71/10/1131847110.db2.gz KDDRXKNTTPMRNZ-MOPGFXCFSA-N 1 1 344.499 3.841 20 10 EHCDMO C[C@H]1CC[C@@H]([N@H+]2CCc3cccc(O)c3C2)CN1C(=O)OC(C)(C)C ZINC001173073984 1131954982 /nfs/dbraw/zinc/95/49/82/1131954982.db2.gz FSGXZMSSUFJIFF-GOEBONIOSA-N 1 1 346.471 3.538 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]CC[C@H](C)N(C)Cc2ccccc2)c1 ZINC000379636045 1132178076 /nfs/dbraw/zinc/17/80/76/1132178076.db2.gz WXMJZNCBOXBMBP-IRXDYDNUSA-N 1 1 342.483 3.962 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)CC(F)(F)F)c1 ZINC000766479258 1132556218 /nfs/dbraw/zinc/55/62/18/1132556218.db2.gz NRCCOCQRFXDOTF-MRVPVSSYSA-N 1 1 326.156 3.894 20 10 EHCDMO COc1ccc(C[NH2+]Cc2cc(C)cc(Br)c2O)cc1 ZINC001177104170 1133031054 /nfs/dbraw/zinc/03/10/54/1133031054.db2.gz MCQLZMXQCZTBJX-UHFFFAOYSA-N 1 1 336.229 3.762 20 10 EHCDMO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001177641470 1133089353 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CCOc1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c(O)c1 ZINC000768234665 1133116361 /nfs/dbraw/zinc/11/63/61/1133116361.db2.gz MCBQFMFQQMZLQC-UHFFFAOYSA-N 1 1 349.434 3.957 20 10 EHCDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000768338490 1133126598 /nfs/dbraw/zinc/12/65/98/1133126598.db2.gz LGBXJBGKIJJAAB-QGZVFWFLSA-N 1 1 341.407 3.639 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1-n1cncn1 ZINC000768357958 1133129568 /nfs/dbraw/zinc/12/95/68/1133129568.db2.gz RVDSAIDIKMBLFX-UHFFFAOYSA-N 1 1 349.482 3.744 20 10 EHCDMO C[N@@H+](Cc1ccc(C(=O)NC2CC2)cc1)Cc1cc(Cl)ccc1O ZINC000768423851 1133137332 /nfs/dbraw/zinc/13/73/32/1133137332.db2.gz NJFVIKHLLYTMJF-UHFFFAOYSA-N 1 1 344.842 3.570 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c(O)c1 ZINC000768425845 1133137463 /nfs/dbraw/zinc/13/74/63/1133137463.db2.gz NQBVYMNBMRRVKW-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c(O)c1 ZINC000768425845 1133137464 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[O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000769314310 1133260156 /nfs/dbraw/zinc/26/01/56/1133260156.db2.gz XIGYSWNIAVHICT-ZDUSSCGKSA-N 1 1 326.227 3.733 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1F ZINC000769380568 1133272732 /nfs/dbraw/zinc/27/27/32/1133272732.db2.gz GQHHKMMCHVWSEO-CVEARBPZSA-N 1 1 348.384 3.560 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCCCC[C@@H]2C)c1O ZINC000769405258 1133278671 /nfs/dbraw/zinc/27/86/71/1133278671.db2.gz RVCOHKWPJVFQPB-NSHDSACASA-N 1 1 328.250 3.928 20 10 EHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000769486992 1133290276 /nfs/dbraw/zinc/29/02/76/1133290276.db2.gz FYSPYAQNKKUDRD-NRFANRHFSA-N 1 1 338.495 3.976 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@H](c3ccccc3C)C2)c(O)c1 ZINC000769446707 1133291767 /nfs/dbraw/zinc/29/17/67/1133291767.db2.gz RRZFDIPPHOHRRD-FQEVSTJZSA-N 1 1 327.424 3.673 20 10 EHCDMO CO[C@H](C)C[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000769475177 1133299796 /nfs/dbraw/zinc/29/97/96/1133299796.db2.gz VDWXHDIVWFGVRH-MRXNPFEDSA-N 1 1 349.475 3.830 20 10 EHCDMO C[N@H+](Cc1ccc(F)c(F)c1[O-])C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001180267445 1133353050 /nfs/dbraw/zinc/35/30/50/1133353050.db2.gz WBBBWAPXKVEMFO-INIZCTEOSA-N 1 1 346.421 3.624 20 10 EHCDMO C[NH+](Cc1ccc(F)c(F)c1[O-])C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001180267445 1133353054 /nfs/dbraw/zinc/35/30/54/1133353054.db2.gz WBBBWAPXKVEMFO-INIZCTEOSA-N 1 1 346.421 3.624 20 10 EHCDMO C[NH+](Cc1ccc(F)c(F)c1[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001180267445 1133353060 /nfs/dbraw/zinc/35/30/60/1133353060.db2.gz WBBBWAPXKVEMFO-INIZCTEOSA-N 1 1 346.421 3.624 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1OC ZINC000770255416 1133406628 /nfs/dbraw/zinc/40/66/28/1133406628.db2.gz IGUMCCZADXNOTA-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1 ZINC000770349685 1133418718 /nfs/dbraw/zinc/41/87/18/1133418718.db2.gz MQZVSWHTRNVJKK-VBKZILBWSA-N 1 1 327.424 3.615 20 10 EHCDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000770509766 1133436268 /nfs/dbraw/zinc/43/62/68/1133436268.db2.gz TUPBYFQXJQYBCS-HOCLYGCPSA-N 1 1 334.460 3.660 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)OCCn1cc[nH+]c1C ZINC000771927371 1133610850 /nfs/dbraw/zinc/61/08/50/1133610850.db2.gz RIWXWGDZFUKVCF-UHFFFAOYSA-N 1 1 329.425 3.518 20 10 EHCDMO C[C@H](Cc1cnccn1)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774154163 1133624797 /nfs/dbraw/zinc/62/47/97/1133624797.db2.gz AKWBRDSXRQCIGO-NXEZZACHSA-N 1 1 326.227 3.771 20 10 EHCDMO C[C@@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000774211121 1133635592 /nfs/dbraw/zinc/63/55/92/1133635592.db2.gz CRQCXOKKKNVOBW-MEBBXXQBSA-N 1 1 349.327 3.787 20 10 EHCDMO C[C@@H]([NH2+][C@H](CCO)C1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000774358697 1133664359 /nfs/dbraw/zinc/66/43/59/1133664359.db2.gz KZYKGFPRWWGJAV-MEBBXXQBSA-N 1 1 348.270 3.527 20 10 EHCDMO Oc1cccc(Cl)c1CN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000772601493 1133707816 /nfs/dbraw/zinc/70/78/16/1133707816.db2.gz SDEPCAXMRPVYII-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCCN(Cc2ccccc2)CC1 ZINC000772601493 1133707820 /nfs/dbraw/zinc/70/78/20/1133707820.db2.gz SDEPCAXMRPVYII-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCCN(Cc2ccccc2)CC1 ZINC000772601493 1133707826 /nfs/dbraw/zinc/70/78/26/1133707826.db2.gz SDEPCAXMRPVYII-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c1 ZINC001182910318 1133749269 /nfs/dbraw/zinc/74/92/69/1133749269.db2.gz MUOZWLIRFCWJFL-NRFANRHFSA-N 1 1 325.452 3.999 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc(Br)c1F ZINC001183918919 1133879319 /nfs/dbraw/zinc/87/93/19/1133879319.db2.gz COUYXGKWLAZLGR-UHFFFAOYSA-N 1 1 328.156 3.723 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1cc(F)cc(F)c1O ZINC000787025741 1133939378 /nfs/dbraw/zinc/93/93/78/1133939378.db2.gz LVMXLLKYUSPVIH-AYVTZFPOSA-N 1 1 345.748 3.847 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCC(F)(F)C1)C[C@@H]1CCCO1 ZINC000787731909 1134036654 /nfs/dbraw/zinc/03/66/54/1134036654.db2.gz UDSARSQPFJTDPT-ZBFHGGJFSA-N 1 1 325.399 3.809 20 10 EHCDMO COc1c(O)c(C[N@H+](CC2CC2)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774875633 1134082896 /nfs/dbraw/zinc/08/28/96/1134082896.db2.gz LSMQDQHMUXQEGZ-UHFFFAOYSA-N 1 1 334.416 3.854 20 10 EHCDMO COc1c(O)c(C[N@@H+](CC2CC2)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774875633 1134082903 /nfs/dbraw/zinc/08/29/03/1134082903.db2.gz LSMQDQHMUXQEGZ-UHFFFAOYSA-N 1 1 334.416 3.854 20 10 EHCDMO COc1c(O)c(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000774884318 1134092217 /nfs/dbraw/zinc/09/22/17/1134092217.db2.gz KJVCCHPSFONVGR-CZUORRHYSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000774884318 1134092223 /nfs/dbraw/zinc/09/22/23/1134092223.db2.gz KJVCCHPSFONVGR-CZUORRHYSA-N 1 1 342.395 3.687 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000788564682 1134144204 /nfs/dbraw/zinc/14/42/04/1134144204.db2.gz SZIQNZJGRPDSLQ-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@H]([NH2+]CCc1ccc(CO)cc1)c1cccc(C(F)(F)F)c1O ZINC000788690692 1134157890 /nfs/dbraw/zinc/15/78/90/1134157890.db2.gz KTRYTQRQJJSDOC-LBPRGKRZSA-N 1 1 339.357 3.797 20 10 EHCDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(C(C)C)c(C)cc1O ZINC000789519686 1134290100 /nfs/dbraw/zinc/29/01/00/1134290100.db2.gz MSHNJIXIIKSYPZ-KRWDZBQOSA-N 1 1 332.488 3.705 20 10 EHCDMO Oc1ccc(Cl)cc1CN1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001203656300 1134317640 /nfs/dbraw/zinc/31/76/40/1134317640.db2.gz MCYBHVQKIPYKDX-UHFFFAOYSA-N 1 1 334.891 3.886 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)cc1 ZINC000789769711 1134330279 /nfs/dbraw/zinc/33/02/79/1134330279.db2.gz PVLAAHSKBWQRSE-HXUWFJFHSA-N 1 1 325.456 3.581 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2cnccc21 ZINC000775151879 1134396129 /nfs/dbraw/zinc/39/61/29/1134396129.db2.gz JDRPWFARSAXVRX-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO COc1ccsc1C[NH2+]Cc1cccc(Br)c1O ZINC000775154241 1134403262 /nfs/dbraw/zinc/40/32/62/1134403262.db2.gz YQBUFEGHXXBORJ-UHFFFAOYSA-N 1 1 328.231 3.515 20 10 EHCDMO CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(C)cc(Br)c1O ZINC000775175162 1134475761 /nfs/dbraw/zinc/47/57/61/1134475761.db2.gz GBLIDULQXAZHRX-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(C)cc(Br)c1O ZINC000775175162 1134475765 /nfs/dbraw/zinc/47/57/65/1134475765.db2.gz GBLIDULQXAZHRX-INIZCTEOSA-N 1 1 342.277 3.590 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1ccc(F)c(F)c1F ZINC000790985726 1134496518 /nfs/dbraw/zinc/49/65/18/1134496518.db2.gz AUEONEICUSUPCF-UHFFFAOYSA-N 1 1 333.712 3.934 20 10 EHCDMO C[N@H+](Cc1ccsc1Cl)Cc1ccc(N2CCOCC2)cc1 ZINC000792156767 1134659223 /nfs/dbraw/zinc/65/92/23/1134659223.db2.gz MKHRREADPNASLS-UHFFFAOYSA-N 1 1 336.888 3.870 20 10 EHCDMO C[N@@H+](Cc1ccsc1Cl)Cc1ccc(N2CCOCC2)cc1 ZINC000792156767 1134659225 /nfs/dbraw/zinc/65/92/25/1134659225.db2.gz MKHRREADPNASLS-UHFFFAOYSA-N 1 1 336.888 3.870 20 10 EHCDMO COc1cc(C[N@@H+](Cc2ccc(N(C)C)c(F)c2)C2CC2)ccc1O ZINC000792175686 1134663615 /nfs/dbraw/zinc/66/36/15/1134663615.db2.gz WIXQUTIYELADIP-UHFFFAOYSA-N 1 1 344.430 3.771 20 10 EHCDMO CCn1ccc(C[N@H+](C)Cc2cc(C)cc(Br)c2O)c1 ZINC000792184388 1134665064 /nfs/dbraw/zinc/66/50/64/1134665064.db2.gz VOUTUJFFLUQZSX-UHFFFAOYSA-N 1 1 337.261 3.917 20 10 EHCDMO CCn1ccc(C[N@@H+](C)Cc2cc(C)cc(Br)c2O)c1 ZINC000792184388 1134665068 /nfs/dbraw/zinc/66/50/68/1134665068.db2.gz VOUTUJFFLUQZSX-UHFFFAOYSA-N 1 1 337.261 3.917 20 10 EHCDMO COC(=O)[C@@H]1CCCC[C@H]1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190446870 1134701958 /nfs/dbraw/zinc/70/19/58/1134701958.db2.gz QAWOTIXNWFZCDB-FXAWDEMLSA-N 1 1 344.499 3.696 20 10 EHCDMO Cc1nc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)cs1 ZINC000792897498 1134815788 /nfs/dbraw/zinc/81/57/88/1134815788.db2.gz HMLRZVNAJCRQGZ-UHFFFAOYSA-N 1 1 329.391 3.826 20 10 EHCDMO C[C@@H](CNCc1ccc(N(C)C)cc1C(F)(F)F)C[NH+]1CCCC1 ZINC000792919327 1134825103 /nfs/dbraw/zinc/82/51/03/1134825103.db2.gz FYHCVAQEOAYWBN-AWEZNQCLSA-N 1 1 343.437 3.593 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CC(C)(C)O)C2CC2)c(C(F)(F)F)c1 ZINC000793099817 1134854261 /nfs/dbraw/zinc/85/42/61/1134854261.db2.gz TVNVGCNNLNCKRP-UHFFFAOYSA-N 1 1 330.394 3.507 20 10 EHCDMO Oc1c(F)cc(Cl)cc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000775648057 1135397444 /nfs/dbraw/zinc/39/74/44/1135397444.db2.gz ONCBBMBOUFIHIW-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC001130895282 1135532942 /nfs/dbraw/zinc/53/29/42/1135532942.db2.gz LODSBIAGDBYULN-LJQANCHMSA-N 1 1 339.483 3.697 20 10 EHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)c1O ZINC000775739455 1135597294 /nfs/dbraw/zinc/59/72/94/1135597294.db2.gz HLOXBALACMEQIZ-GDBMZVCRSA-N 1 1 334.460 3.578 20 10 EHCDMO C[NH+](C)C[C@H]1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC000809576511 1135852759 /nfs/dbraw/zinc/85/27/59/1135852759.db2.gz BPBFYSJLDRWDGS-OAQYLSRUSA-N 1 1 349.522 3.633 20 10 EHCDMO Cc1nn(-c2ccccn2)c(Cl)c1C[N@@H+](C)Cc1ccccc1O ZINC000809549902 1135855008 /nfs/dbraw/zinc/85/50/08/1135855008.db2.gz VVCKCJXHLONJDX-UHFFFAOYSA-N 1 1 342.830 3.567 20 10 EHCDMO Cc1nn(-c2ccccn2)c(Cl)c1C[N@H+](C)Cc1ccccc1O ZINC000809549902 1135855012 /nfs/dbraw/zinc/85/50/12/1135855012.db2.gz VVCKCJXHLONJDX-UHFFFAOYSA-N 1 1 342.830 3.567 20 10 EHCDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000809765399 1135888317 /nfs/dbraw/zinc/88/83/17/1135888317.db2.gz NHERAFWQBXMSTO-GUYCJALGSA-N 1 1 343.437 3.543 20 10 EHCDMO COCc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000810253305 1135949351 /nfs/dbraw/zinc/94/93/51/1135949351.db2.gz QNMTYPFJAFAYRE-JTQLQIEISA-N 1 1 326.849 3.808 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)[C@H]1CCOC(C)(C)C1 ZINC000811511961 1136102851 /nfs/dbraw/zinc/10/28/51/1136102851.db2.gz YLLFMEGZBIIIRA-AWEZNQCLSA-N 1 1 342.277 3.934 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000811513497 1136102874 /nfs/dbraw/zinc/10/28/74/1136102874.db2.gz VXYISEVLJHBWTQ-CQSZACIVSA-N 1 1 346.833 3.822 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000811513497 1136102876 /nfs/dbraw/zinc/10/28/76/1136102876.db2.gz VXYISEVLJHBWTQ-CQSZACIVSA-N 1 1 346.833 3.822 20 10 EHCDMO CC(C)n1ccnc1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000850129755 1136212859 /nfs/dbraw/zinc/21/28/59/1136212859.db2.gz WODJYKNYBNVOIU-UHFFFAOYSA-N 1 1 326.488 3.990 20 10 EHCDMO COc1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c(O)c(C(C)(C)C)c1 ZINC000850193492 1136218968 /nfs/dbraw/zinc/21/89/68/1136218968.db2.gz UMRZKKKQEQBFFR-MRXNPFEDSA-N 1 1 329.444 3.589 20 10 EHCDMO COc1cc(C[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)c(O)c(C(C)(C)C)c1 ZINC000850228069 1136224220 /nfs/dbraw/zinc/22/42/20/1136224220.db2.gz JKEKPJXKAKRMNF-LBPRGKRZSA-N 1 1 346.475 3.791 20 10 EHCDMO CO[C@](C)(C[NH2+][C@H](C)c1cc(Br)c(F)cc1O)C1CC1 ZINC000812734891 1136239575 /nfs/dbraw/zinc/23/95/75/1136239575.db2.gz ULQHAXLGRHQHKO-RFAUZJTJSA-N 1 1 346.240 3.760 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)c1 ZINC000850371252 1136242975 /nfs/dbraw/zinc/24/29/75/1136242975.db2.gz HYTOJELEVANVLA-CVEARBPZSA-N 1 1 348.240 3.731 20 10 EHCDMO CC[C@H]([NH2+]Cc1cnc(C(F)(F)F)nc1)c1ccc(F)cc1O ZINC000850485389 1136267910 /nfs/dbraw/zinc/26/79/10/1136267910.db2.gz HEECLPJBLLDABH-LBPRGKRZSA-N 1 1 329.297 3.581 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CCOCC1 ZINC000850494680 1136270863 /nfs/dbraw/zinc/27/08/63/1136270863.db2.gz WDWUYRDJIXFDBR-NHYWBVRUSA-N 1 1 347.377 3.503 20 10 EHCDMO C[N@H+](Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccccc1O ZINC000109772785 1136339754 /nfs/dbraw/zinc/33/97/54/1136339754.db2.gz XPLSSPAYZIFGJC-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO C[N@@H+](Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccccc1O ZINC000109772785 1136339758 /nfs/dbraw/zinc/33/97/58/1136339758.db2.gz XPLSSPAYZIFGJC-UHFFFAOYSA-N 1 1 329.787 3.728 20 10 EHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@@H](CCF)C3)cc2)CC1 ZINC000852531664 1136462770 /nfs/dbraw/zinc/46/27/70/1136462770.db2.gz SUNWJMBGEWBAIL-KRWDZBQOSA-N 1 1 334.479 3.873 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743912 1136482181 /nfs/dbraw/zinc/48/21/81/1136482181.db2.gz OAQFHZGTCNNCNF-UKRRQHHQSA-N 1 1 330.394 3.603 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000852743912 1136482183 /nfs/dbraw/zinc/48/21/83/1136482183.db2.gz OAQFHZGTCNNCNF-UKRRQHHQSA-N 1 1 330.394 3.603 20 10 EHCDMO CCc1cccc(CC)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000111236081 1136524750 /nfs/dbraw/zinc/52/47/50/1136524750.db2.gz VYVLSFFJYYDDCA-HNNXBMFYSA-N 1 1 340.467 3.976 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000815019046 1136538365 /nfs/dbraw/zinc/53/83/65/1136538365.db2.gz HAODLFPBKLZVKY-NRFANRHFSA-N 1 1 344.474 3.706 20 10 EHCDMO Cc1cccc(C)c1[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OC[C@H]2O ZINC000853522005 1136540093 /nfs/dbraw/zinc/54/00/93/1136540093.db2.gz ICMCWSYPCNWIGO-PKOBYXMFSA-N 1 1 339.435 3.772 20 10 EHCDMO O=C1CCC2=C(CC[N@H+](Cc3cc4oc5ccccc5c4cc3O)C2)N1 ZINC000853519354 1136540215 /nfs/dbraw/zinc/54/02/15/1136540215.db2.gz BFMHBLFHTJHIPD-UHFFFAOYSA-N 1 1 348.402 3.661 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)OCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000853570053 1136545529 /nfs/dbraw/zinc/54/55/29/1136545529.db2.gz APPIGVABTJWRMU-BDJLRTHQSA-N 1 1 325.330 3.697 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)OCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000853570053 1136545532 /nfs/dbraw/zinc/54/55/32/1136545532.db2.gz APPIGVABTJWRMU-BDJLRTHQSA-N 1 1 325.330 3.697 20 10 EHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)ccc1N(C)C ZINC000815105790 1136556920 /nfs/dbraw/zinc/55/69/20/1136556920.db2.gz LNXZGLDUGXABHL-CEWLAPEOSA-N 1 1 330.516 3.967 20 10 EHCDMO CCc1noc(C)c1C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000815146056 1136561712 /nfs/dbraw/zinc/56/17/12/1136561712.db2.gz MFUPXRRVYCLACC-UHFFFAOYSA-N 1 1 339.233 3.612 20 10 EHCDMO CSC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CCOCC1 ZINC000815595467 1136616482 /nfs/dbraw/zinc/61/64/82/1136616482.db2.gz SDDPAQBZDPPWAZ-NSHDSACASA-N 1 1 349.418 3.974 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000815648687 1136626138 /nfs/dbraw/zinc/62/61/38/1136626138.db2.gz UGOWHZCZIKCPJY-SKDZVZGDSA-N 1 1 325.408 3.633 20 10 EHCDMO COc1ccccc1OCC[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816491912 1136724683 /nfs/dbraw/zinc/72/46/83/1136724683.db2.gz CQJSZVKYLHJZDV-UHFFFAOYSA-N 1 1 339.794 3.704 20 10 EHCDMO COc1ccccc1OCC[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816491912 1136724686 /nfs/dbraw/zinc/72/46/86/1136724686.db2.gz CQJSZVKYLHJZDV-UHFFFAOYSA-N 1 1 339.794 3.704 20 10 EHCDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816499499 1136727874 /nfs/dbraw/zinc/72/78/74/1136727874.db2.gz RXOQIEYSJWLQGB-INIZCTEOSA-N 1 1 340.467 3.530 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000816535343 1136730706 /nfs/dbraw/zinc/73/07/06/1136730706.db2.gz MLHDSXYZSJAKRA-CYBMUJFWSA-N 1 1 334.822 3.801 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1 ZINC000816593919 1136735662 /nfs/dbraw/zinc/73/56/62/1136735662.db2.gz JDQOCEGFARFSFK-OAHLLOKOSA-N 1 1 348.176 3.800 20 10 EHCDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816565396 1136737299 /nfs/dbraw/zinc/73/72/99/1136737299.db2.gz NVSGRCCPHMOOGA-KRWDZBQOSA-N 1 1 341.451 3.957 20 10 EHCDMO Cc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(N2CCCC2)n1 ZINC000816566163 1136737833 /nfs/dbraw/zinc/73/78/33/1136737833.db2.gz MQBFVBUZIMVFQO-UHFFFAOYSA-N 1 1 349.837 3.778 20 10 EHCDMO C[C@@](O)(C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1Cl ZINC000816570464 1136738443 /nfs/dbraw/zinc/73/84/43/1136738443.db2.gz VBQMYNSRPIPWJQ-MRXNPFEDSA-N 1 1 344.213 3.835 20 10 EHCDMO CCC1(CC)C[N@@H+](Cc2ccc3ccccc3c2O)CC[S@]1=O ZINC000816570899 1136738831 /nfs/dbraw/zinc/73/88/31/1136738831.db2.gz KPPREWREFIJKIF-HSZRJFAPSA-N 1 1 331.481 3.669 20 10 EHCDMO CN(CCC[N@H+](C)Cc1cc(Cl)c(F)cc1O)Cc1ccco1 ZINC000816610103 1136740912 /nfs/dbraw/zinc/74/09/12/1136740912.db2.gz XXDSDTWAFYNAAW-UHFFFAOYSA-N 1 1 340.826 3.732 20 10 EHCDMO CN(CCC[N@@H+](C)Cc1cc(Cl)c(F)cc1O)Cc1ccco1 ZINC000816610103 1136740915 /nfs/dbraw/zinc/74/09/15/1136740915.db2.gz XXDSDTWAFYNAAW-UHFFFAOYSA-N 1 1 340.826 3.732 20 10 EHCDMO CC[C@H]1C[C@H]([NH2+]Cc2cc(C)cc(Br)c2O)CCO1 ZINC000817415807 1136806804 /nfs/dbraw/zinc/80/68/04/1136806804.db2.gz ZNQZIRWAKRIBNG-OLZOCXBDSA-N 1 1 328.250 3.510 20 10 EHCDMO COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000817938477 1136847510 /nfs/dbraw/zinc/84/75/10/1136847510.db2.gz LDVGIIVWNIGIFU-ACJLOTCBSA-N 1 1 347.890 3.765 20 10 EHCDMO CCCOc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938276 1136847668 /nfs/dbraw/zinc/84/76/68/1136847668.db2.gz IFACHUFTOWMLIW-IERDGZPVSA-N 1 1 341.499 3.892 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817987763 1136855369 /nfs/dbraw/zinc/85/53/69/1136855369.db2.gz WTCSEUWAUPKMLY-FIRUKDTASA-N 1 1 342.405 3.840 20 10 EHCDMO COc1ccc(N2CC[C@@H](C[NH2+][C@@H](C)c3ccc(F)cc3O)C2)cc1 ZINC000818342206 1136872176 /nfs/dbraw/zinc/87/21/76/1136872176.db2.gz NHXWNRNOEZLHNB-GJZGRUSLSA-N 1 1 344.430 3.717 20 10 EHCDMO COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)c3ccc(F)cc3O)C2)cc1 ZINC000818342205 1136872314 /nfs/dbraw/zinc/87/23/14/1136872314.db2.gz NHXWNRNOEZLHNB-CABCVRRESA-N 1 1 344.430 3.717 20 10 EHCDMO CCOC(=O)C1=CC[C@@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000858506100 1136974472 /nfs/dbraw/zinc/97/44/72/1136974472.db2.gz CUZGKLLKQMNHGK-ZYHUDNBSSA-N 1 1 343.345 3.714 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1ncc(Br)cn1)c1ccc(N(C)C)cc1 ZINC000805749852 1136995832 /nfs/dbraw/zinc/99/58/32/1136995832.db2.gz AYNXDDDSSXTZCF-RYUDHWBXSA-N 1 1 349.276 3.717 20 10 EHCDMO Cc1ccn2c(C[N@H+](C)Cc3ccc(N4CCCC4)cc3)cnc2c1 ZINC001136889396 1137140785 /nfs/dbraw/zinc/14/07/85/1137140785.db2.gz WFKFDHBNBFXFGL-UHFFFAOYSA-N 1 1 334.467 3.875 20 10 EHCDMO C[C@H](C[N@@H+](C)Cc1ccc(Br)cc1O)c1nccs1 ZINC000825501163 1137179875 /nfs/dbraw/zinc/17/98/75/1137179875.db2.gz LRAKXJGAWKPCGZ-SNVBAGLBSA-N 1 1 341.274 3.847 20 10 EHCDMO CCc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794702891 1137236065 /nfs/dbraw/zinc/23/60/65/1137236065.db2.gz KPCMZYXFKOSXTP-BTYIYWSLSA-N 1 1 347.499 3.632 20 10 EHCDMO COc1cc(C[N@@H+]2CCc3cccc(O)c3C2)ccc1Br ZINC001144233041 1137257833 /nfs/dbraw/zinc/25/78/33/1137257833.db2.gz ANFRESWENACGCK-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1cc(C[N@H+]2CCc3cccc(O)c3C2)ccc1Br ZINC001144233041 1137257834 /nfs/dbraw/zinc/25/78/34/1137257834.db2.gz ANFRESWENACGCK-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)c(O)c1 ZINC001144514400 1137304160 /nfs/dbraw/zinc/30/41/60/1137304160.db2.gz BMULNPKYIXXDNK-LLVKDONJSA-N 1 1 325.817 3.855 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc2cnccc2o1)C[C@H]1CCCO1 ZINC000845903666 1137319085 /nfs/dbraw/zinc/31/90/85/1137319085.db2.gz RIIWQGAWKCBUGY-QGZVFWFLSA-N 1 1 338.407 3.715 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(Br)cn1)c1ccc(F)cc1O ZINC000866569585 1137365779 /nfs/dbraw/zinc/36/57/79/1137365779.db2.gz YHANIIWFNMMKMD-AWEZNQCLSA-N 1 1 339.208 3.930 20 10 EHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H](O)C(F)(F)F ZINC000121859946 1137387359 /nfs/dbraw/zinc/38/73/59/1137387359.db2.gz RCTUMABQTHHLJP-GUYCJALGSA-N 1 1 339.357 3.879 20 10 EHCDMO COc1ccc2[nH+]ccc(NCc3cc4ccccc4cc3O)c2n1 ZINC001171405321 1137472735 /nfs/dbraw/zinc/47/27/35/1137472735.db2.gz USAKPNXMRPCOSI-UHFFFAOYSA-N 1 1 331.375 3.531 20 10 EHCDMO CC1(C)C[C@@H]([NH2+]Cc2ccc(O)cc2O)CCN1Cc1ccccc1 ZINC001171984678 1137527513 /nfs/dbraw/zinc/52/75/13/1137527513.db2.gz XLJLMLXXTNZKPN-SFHVURJKSA-N 1 1 340.467 3.631 20 10 EHCDMO Oc1cc2c(cc1O)C[N@H+]([C@@H]1CSc3ccccc3C1)CCC2 ZINC001172209185 1137541301 /nfs/dbraw/zinc/54/13/01/1137541301.db2.gz OYLWINOCUWCOBA-INIZCTEOSA-N 1 1 327.449 3.563 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027466 1137566066 /nfs/dbraw/zinc/56/60/66/1137566066.db2.gz DRKALZCHTGHBIY-NSHDSACASA-N 1 1 335.354 3.790 20 10 EHCDMO CC(C)Oc1cccc(C[N@@H+](C)Cc2cc3c(cc2O)OCO3)c1 ZINC000124374536 1137589314 /nfs/dbraw/zinc/58/93/14/1137589314.db2.gz FQOATBSXAJGJLJ-UHFFFAOYSA-N 1 1 329.396 3.540 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C(=O)Cn2cc[nH+]c2C(C)C)cc1 ZINC000873862607 1137607431 /nfs/dbraw/zinc/60/74/31/1137607431.db2.gz UPNIIKRIHUMUQB-UHFFFAOYSA-N 1 1 342.487 3.511 20 10 EHCDMO Cc1nnc([C@@H]2Cc3ccccc3C[N@@H+]2Cc2c(C)cccc2O)o1 ZINC000876629844 1137657631 /nfs/dbraw/zinc/65/76/31/1137657631.db2.gz WNJQDYVDVCGSKE-SFHVURJKSA-N 1 1 335.407 3.692 20 10 EHCDMO Cc1nnc([C@@H]2Cc3ccccc3C[N@H+]2Cc2c(C)cccc2O)o1 ZINC000876629844 1137657632 /nfs/dbraw/zinc/65/76/32/1137657632.db2.gz WNJQDYVDVCGSKE-SFHVURJKSA-N 1 1 335.407 3.692 20 10 EHCDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876721019 1137659696 /nfs/dbraw/zinc/65/96/96/1137659696.db2.gz OUTBBVWWZWNWQS-MRXNPFEDSA-N 1 1 340.467 3.546 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)[C@H]1c1ccccc1 ZINC000876793977 1137661530 /nfs/dbraw/zinc/66/15/30/1137661530.db2.gz JZBVRHFILUPKHK-VGOFRKELSA-N 1 1 336.479 3.841 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000825903786 1137661780 /nfs/dbraw/zinc/66/17/80/1137661780.db2.gz RPSUXEREEWDYJM-HNNXBMFYSA-N 1 1 333.229 3.887 20 10 EHCDMO CC1(C)C[N@H+](Cc2ccc(Br)cc2O)[C@H]1[C@H]1CCCO1 ZINC000825943723 1137671847 /nfs/dbraw/zinc/67/18/47/1137671847.db2.gz JAIFXSHDWUAWGQ-CABCVRRESA-N 1 1 340.261 3.544 20 10 EHCDMO CC1(C)C[N@@H+](Cc2ccc(Br)cc2O)[C@H]1[C@H]1CCCO1 ZINC000825943723 1137671848 /nfs/dbraw/zinc/67/18/48/1137671848.db2.gz JAIFXSHDWUAWGQ-CABCVRRESA-N 1 1 340.261 3.544 20 10 EHCDMO COc1cccc(-c2noc([C@@H](C)[NH2+]Cc3ccc(C)cc3O)n2)c1 ZINC000877471229 1137677258 /nfs/dbraw/zinc/67/72/58/1137677258.db2.gz SLZOMDBGUOKVEH-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO COC(=O)c1nc([C@H]2CCC[N@H+]2Cc2c(C)cccc2O)sc1C ZINC000877490419 1137678215 /nfs/dbraw/zinc/67/82/15/1137678215.db2.gz ZRZRQAIKJJMCOI-CQSZACIVSA-N 1 1 346.452 3.589 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1 ZINC000877672414 1137685250 /nfs/dbraw/zinc/68/52/50/1137685250.db2.gz DUSMBFFXLRJNDC-SUFHBLLTSA-N 1 1 336.479 3.964 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCC2(CCOCC2)CO1 ZINC000878151371 1137704699 /nfs/dbraw/zinc/70/46/99/1137704699.db2.gz PQZNRYKJQXJUON-SFHVURJKSA-N 1 1 333.472 3.580 20 10 EHCDMO Cc1nc(CC[N@@H+](Cc2ccco2)Cc2ccccc2O)cs1 ZINC000128379040 1137776713 /nfs/dbraw/zinc/77/67/13/1137776713.db2.gz LWSPNFKYNXEKTB-UHFFFAOYSA-N 1 1 328.437 3.995 20 10 EHCDMO C[C@@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(F)c1F ZINC000883290346 1137853002 /nfs/dbraw/zinc/85/30/02/1137853002.db2.gz RPIUBQOOSHIDGO-OAHLLOKOSA-N 1 1 345.437 3.567 20 10 EHCDMO CCc1cccc(CC)c1NC(=O)C[N@H+](C)Cc1ccccc1O ZINC000109768972 1137897391 /nfs/dbraw/zinc/89/73/91/1137897391.db2.gz SRCQWCJZDXQRFZ-UHFFFAOYSA-N 1 1 326.440 3.588 20 10 EHCDMO CCc1cccc(CC)c1NC(=O)C[N@@H+](C)Cc1ccccc1O ZINC000109768972 1137897392 /nfs/dbraw/zinc/89/73/92/1137897392.db2.gz SRCQWCJZDXQRFZ-UHFFFAOYSA-N 1 1 326.440 3.588 20 10 EHCDMO [O-]c1cccc(Cl)c1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000113315485 1137912623 /nfs/dbraw/zinc/91/26/23/1137912623.db2.gz DFNOTIARZLNVIV-UHFFFAOYSA-N 1 1 330.859 3.931 20 10 EHCDMO C[C@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1c(O)cccc1F ZINC000886502691 1138084724 /nfs/dbraw/zinc/08/47/24/1138084724.db2.gz KOVFHZMFHIDQAX-HNNXBMFYSA-N 1 1 329.415 3.930 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1c(O)cccc1F ZINC000886501693 1138084862 /nfs/dbraw/zinc/08/48/62/1138084862.db2.gz USCRKJOQXJDSMO-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1c(O)cccc1F ZINC000886506282 1138085703 /nfs/dbraw/zinc/08/57/03/1138085703.db2.gz KMYCZXIFBSXWAI-CQSZACIVSA-N 1 1 329.419 3.767 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(N(C)C)nc2ccccc12)c1c(O)cccc1F ZINC000886535014 1138092243 /nfs/dbraw/zinc/09/22/43/1138092243.db2.gz SXYFFPHXTHZIIB-ZDUSSCGKSA-N 1 1 339.414 3.996 20 10 EHCDMO C[C@@H]([NH2+]CCCC(=O)N1Cc2ccccc2C1)c1c(O)cccc1F ZINC000886548095 1138094793 /nfs/dbraw/zinc/09/47/93/1138094793.db2.gz XDBOGXXPVIKTCI-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1c(O)cccc1F ZINC000886549518 1138094844 /nfs/dbraw/zinc/09/48/44/1138094844.db2.gz JDIABBKVLMDIRC-XPTSAGLGSA-N 1 1 327.758 3.708 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1c(O)cccc1F ZINC000886558663 1138096778 /nfs/dbraw/zinc/09/67/78/1138096778.db2.gz PDZOLEWLGGGZFY-RFAUZJTJSA-N 1 1 327.758 3.708 20 10 EHCDMO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000076900828 1138135376 /nfs/dbraw/zinc/13/53/76/1138135376.db2.gz WXTWNDXGFNFQCY-HNNXBMFYSA-N 1 1 345.512 3.954 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462686 1139091646 /nfs/dbraw/zinc/09/16/46/1139091646.db2.gz KERLKKFVTIQCGY-QZTJIDSGSA-N 1 1 327.516 3.812 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462588 1139092629 /nfs/dbraw/zinc/09/26/29/1139092629.db2.gz KERLKKFVTIQCGY-ZWKOTPCHSA-N 1 1 327.516 3.812 20 10 EHCDMO CC[N@H+](CC(=O)Nc1c(C)cccc1C)Cc1cc(F)ccc1O ZINC000180198818 1139817614 /nfs/dbraw/zinc/81/76/14/1139817614.db2.gz KBKWOXDKMKLWKW-UHFFFAOYSA-N 1 1 330.403 3.609 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1C)Cc1cc(F)ccc1O ZINC000180198818 1139817621 /nfs/dbraw/zinc/81/76/21/1139817621.db2.gz KBKWOXDKMKLWKW-UHFFFAOYSA-N 1 1 330.403 3.609 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000180285712 1139824655 /nfs/dbraw/zinc/82/46/55/1139824655.db2.gz YWFCTQMUHCCBSM-BSEYFRJRSA-N 1 1 347.480 3.721 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1O ZINC000186196434 1140191635 /nfs/dbraw/zinc/19/16/35/1140191635.db2.gz GRTRWGGRPDDBSV-ABKXIKBNSA-N 1 1 327.758 3.708 20 10 EHCDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777467567 1140415421 /nfs/dbraw/zinc/41/54/21/1140415421.db2.gz NOXSJQCZNAXCMC-IBGZPJMESA-N 1 1 338.495 3.895 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCCC1CCOCC1)C[C@@H]1CCCO1 ZINC000274212473 1141485791 /nfs/dbraw/zinc/48/57/91/1141485791.db2.gz ODBUYKSHUNGRSK-IBGZPJMESA-N 1 1 333.472 3.580 20 10 EHCDMO COc1cccc(CNC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1O ZINC000377618636 1018072956 /nfs/dbraw/zinc/07/29/56/1018072956.db2.gz BWUHMKCGCKOJFC-MAUKXSAKSA-N 1 1 332.488 3.534 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)c1O ZINC000780370169 1020317959 /nfs/dbraw/zinc/31/79/59/1020317959.db2.gz MMOJGTSPGJDMAI-OAHLLOKOSA-N 1 1 343.398 3.635 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N2CCCC2)nc1 ZINC000156841486 1020485870 /nfs/dbraw/zinc/48/58/70/1020485870.db2.gz LXCMBMDLBJDHCR-UHFFFAOYSA-N 1 1 338.499 3.770 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCC[C@]1(O)C(F)(F)F ZINC001140338009 1020519686 /nfs/dbraw/zinc/51/96/86/1020519686.db2.gz QSGPCLZQYCAMDT-QMTHXVAHSA-N 1 1 337.769 3.571 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000760407216 1032939182 /nfs/dbraw/zinc/93/91/82/1032939182.db2.gz HEIOBCSEJGINAT-KRWDZBQOSA-N 1 1 326.421 3.575 20 10 EHCDMO CCn1cc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C)n1 ZINC000891400555 1020917256 /nfs/dbraw/zinc/91/72/56/1020917256.db2.gz WLDRRWMWESJUJS-UHFFFAOYSA-N 1 1 326.488 3.834 20 10 EHCDMO CCc1[nH]nc(Cl)c1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000891467296 1021699714 /nfs/dbraw/zinc/69/97/14/1021699714.db2.gz FYQRORQIJAGFGO-CQSZACIVSA-N 1 1 349.862 3.512 20 10 EHCDMO CCc1[nH]nc(Cl)c1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000891467296 1021699719 /nfs/dbraw/zinc/69/97/19/1021699719.db2.gz FYQRORQIJAGFGO-CQSZACIVSA-N 1 1 349.862 3.512 20 10 EHCDMO Cc1cnc(Cl)c(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000891468689 1021701957 /nfs/dbraw/zinc/70/19/57/1021701957.db2.gz VUBLLSQBKUYAHH-KRWDZBQOSA-N 1 1 346.858 3.930 20 10 EHCDMO Cc1cnc(Cl)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000891468689 1021701959 /nfs/dbraw/zinc/70/19/59/1021701959.db2.gz VUBLLSQBKUYAHH-KRWDZBQOSA-N 1 1 346.858 3.930 20 10 EHCDMO CCOCc1cc(C[NH2+][C@@H](C)c2nnc([C@H](C)CC)[nH]2)ccc1OC ZINC000276759694 1022645877 /nfs/dbraw/zinc/64/58/77/1022645877.db2.gz ADZMYPJVGXXBRK-KGLIPLIRSA-N 1 1 346.475 3.714 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000157919190 1033162671 /nfs/dbraw/zinc/16/26/71/1033162671.db2.gz PDMATAAOMUJRTK-UTKZUKDTSA-N 1 1 336.479 3.994 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000157919190 1033162683 /nfs/dbraw/zinc/16/26/83/1033162683.db2.gz PDMATAAOMUJRTK-UTKZUKDTSA-N 1 1 336.479 3.994 20 10 EHCDMO OCC1([C@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc2)CC=CC1 ZINC000895083353 1024122724 /nfs/dbraw/zinc/12/27/24/1024122724.db2.gz DOAVXQOVXDFQOA-LJQANCHMSA-N 1 1 345.389 3.830 20 10 EHCDMO C[C@H]1COCC[N@H+]1Cc1c(O)ccc2cc(Br)ccc21 ZINC000025480320 1025076779 /nfs/dbraw/zinc/07/67/79/1025076779.db2.gz ORMRLCIZWDBZPD-NSHDSACASA-N 1 1 336.229 3.529 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)COc1ccc(C)cc1C ZINC000727830751 1025221663 /nfs/dbraw/zinc/22/16/63/1025221663.db2.gz LXPNKJKZTFFFQJ-IBGZPJMESA-N 1 1 343.467 3.661 20 10 EHCDMO C[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1ccc(F)cc1O ZINC000281597075 1025253502 /nfs/dbraw/zinc/25/35/02/1025253502.db2.gz LYGPXFUYMBANCN-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc(OCC(F)(F)F)c1 ZINC000896639146 1025792864 /nfs/dbraw/zinc/79/28/64/1025792864.db2.gz AUAUMBMEKUIPTR-UHFFFAOYSA-N 1 1 329.293 3.762 20 10 EHCDMO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000475194371 1026360582 /nfs/dbraw/zinc/36/05/82/1026360582.db2.gz VLJCEUYDRMEKAS-UHFFFAOYSA-N 1 1 330.435 3.962 20 10 EHCDMO COc1ccccc1C[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000158879318 1026376521 /nfs/dbraw/zinc/37/65/21/1026376521.db2.gz CGIMXXFKLBFAPM-UHFFFAOYSA-N 1 1 343.423 3.583 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1 ZINC000273355826 1027393651 /nfs/dbraw/zinc/39/36/51/1027393651.db2.gz CRHNFDHJFNSOGS-QWRGUYRKSA-N 1 1 335.350 3.869 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](Cc3nc(C)cs3)C2)c1O ZINC000897299352 1027403324 /nfs/dbraw/zinc/40/33/24/1027403324.db2.gz ZOWSJMFRZVJIIH-AWEZNQCLSA-N 1 1 332.469 3.620 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000273437287 1027424914 /nfs/dbraw/zinc/42/49/14/1027424914.db2.gz MFXWBSKPSJTHEW-ILXRZTDVSA-N 1 1 347.459 3.604 20 10 EHCDMO COCC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@H](C)c1ccccc1 ZINC000271738631 1029148556 /nfs/dbraw/zinc/14/85/56/1029148556.db2.gz PUFKIWJSFQRLTJ-OAHLLOKOSA-N 1 1 345.439 3.619 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000278242739 1029780830 /nfs/dbraw/zinc/78/08/30/1029780830.db2.gz NZLLVCOTEBSFAH-LBPRGKRZSA-N 1 1 334.397 3.708 20 10 EHCDMO C[N@@H+](CCC(=O)NC1CCCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000052440192 1030172203 /nfs/dbraw/zinc/17/22/03/1030172203.db2.gz ZAXSXNOWUTYYFF-UHFFFAOYSA-N 1 1 343.515 3.558 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)c1O ZINC000160143618 1030557411 /nfs/dbraw/zinc/55/74/11/1030557411.db2.gz BQMZBCSXOFHRGR-SFHVURJKSA-N 1 1 328.387 3.774 20 10 EHCDMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000093845412 1030685025 /nfs/dbraw/zinc/68/50/25/1030685025.db2.gz IMQLOKCKMOLWTL-NRFANRHFSA-N 1 1 339.483 3.589 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(C)cc2SC)ccc1[N+](=O)[O-] ZINC000278553175 1031344028 /nfs/dbraw/zinc/34/40/28/1031344028.db2.gz ZMLLDRWIBWMZAX-UHFFFAOYSA-N 1 1 348.424 3.629 20 10 EHCDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000708617313 1033578153 /nfs/dbraw/zinc/57/81/53/1033578153.db2.gz GFMXIXBHHYXAOL-LBPRGKRZSA-N 1 1 338.167 3.929 20 10 EHCDMO CC[C@@H]([NH2+]C[C@H](c1cccc(OC)c1)N(C)C)c1ccc(F)cc1O ZINC000796663775 1033884181 /nfs/dbraw/zinc/88/41/81/1033884181.db2.gz PTAIOAXWSZTKDB-RTBURBONSA-N 1 1 346.446 3.884 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCCN(c2ccccn2)CC1 ZINC000185692381 1035510635 /nfs/dbraw/zinc/51/06/35/1035510635.db2.gz VAPKBUVSKDFQHW-UHFFFAOYSA-N 1 1 333.435 3.653 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](CCO)C2CCCCC2)c1O ZINC000760864053 1037535664 /nfs/dbraw/zinc/53/56/64/1037535664.db2.gz PZDMFHREEWTBLT-QGZVFWFLSA-N 1 1 339.863 3.669 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1O ZINC000246586266 1038916485 /nfs/dbraw/zinc/91/64/85/1038916485.db2.gz MIJOBXRKWGHJQS-QAPCUYQASA-N 1 1 327.424 3.671 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1O ZINC000246586266 1038916494 /nfs/dbraw/zinc/91/64/94/1038916494.db2.gz MIJOBXRKWGHJQS-QAPCUYQASA-N 1 1 327.424 3.671 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1O)[C@@H](C)Cc1ccsc1 ZINC000893719241 1039318826 /nfs/dbraw/zinc/31/88/26/1039318826.db2.gz JUIVMXSXFHIDKH-ZDUSSCGKSA-N 1 1 335.469 3.924 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cc3ccc(N)cc3)cc2)C1 ZINC000237478660 1039372527 /nfs/dbraw/zinc/37/25/27/1039372527.db2.gz JPFIPCWFRCLGAG-MRXNPFEDSA-N 1 1 337.467 3.682 20 10 EHCDMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)n1 ZINC000162421096 1039884172 /nfs/dbraw/zinc/88/41/72/1039884172.db2.gz ARUXBEJQRJBWTD-KGLIPLIRSA-N 1 1 349.475 3.839 20 10 EHCDMO CCN(CC(=O)Nc1c(C)cccc1C)Cc1cc(F)cc(F)c1O ZINC000894055366 1040017920 /nfs/dbraw/zinc/01/79/20/1040017920.db2.gz ZQCDYKSOIGRMBX-UHFFFAOYSA-N 1 1 348.393 3.748 20 10 EHCDMO COc1cccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1O ZINC000092435808 1040209327 /nfs/dbraw/zinc/20/93/27/1040209327.db2.gz BJJNESPDGSGSNQ-GOSISDBHSA-N 1 1 327.424 3.582 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1O ZINC000164276208 1041233510 /nfs/dbraw/zinc/23/35/10/1041233510.db2.gz GEHRPKNCQDSJKY-SFHVURJKSA-N 1 1 349.377 3.561 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1O ZINC000164276208 1041233525 /nfs/dbraw/zinc/23/35/25/1041233525.db2.gz GEHRPKNCQDSJKY-SFHVURJKSA-N 1 1 349.377 3.561 20 10 EHCDMO CCc1nc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)cs1 ZINC000156477232 1041240748 /nfs/dbraw/zinc/24/07/48/1041240748.db2.gz JURFHDWXBROINK-ZDUSSCGKSA-N 1 1 349.475 3.532 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc2ncccc2c1 ZINC000194990584 1041363406 /nfs/dbraw/zinc/36/34/06/1041363406.db2.gz XSUFOTPKTALGAC-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000278838020 1041595828 /nfs/dbraw/zinc/59/58/28/1041595828.db2.gz JNIHVQSWKQJXHY-SNVBAGLBSA-N 1 1 336.775 3.813 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCc3cc(Cl)ccc32)ccc1[N+](=O)[O-] ZINC000278884651 1042830920 /nfs/dbraw/zinc/83/09/20/1042830920.db2.gz OPVYYCBIYHIWPZ-AWEZNQCLSA-N 1 1 348.786 3.740 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2ccc(C)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000278928089 1042975099 /nfs/dbraw/zinc/97/50/99/1042975099.db2.gz VTAGFLOCYXSKFT-QGZVFWFLSA-N 1 1 342.395 3.858 20 10 EHCDMO C[C@@H]([NH2+]C[C@@](O)(c1ccccc1)C(F)(F)F)c1ccc(F)cc1O ZINC000185326221 1126870124 /nfs/dbraw/zinc/87/01/24/1126870124.db2.gz KVWYRMLKDKYZMF-BDJLRTHQSA-N 1 1 343.320 3.632 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(F)cc1O ZINC000185399991 1126885867 /nfs/dbraw/zinc/88/58/67/1126885867.db2.gz OBCDBHBLHZZRLH-GXTWGEPZSA-N 1 1 338.423 3.581 20 10 EHCDMO Cc1c[nH]c2nc(NCc3cc(Cl)c4cccnc4c3O)[nH+]cc12 ZINC001168528581 1126922730 /nfs/dbraw/zinc/92/27/30/1126922730.db2.gz VLBDQAHZEAEZHO-UHFFFAOYSA-N 1 1 339.786 3.737 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+](C)CC(=O)Nc2ccccc2Cl)c1 ZINC000915813826 1121639758 /nfs/dbraw/zinc/63/97/58/1121639758.db2.gz RUUPMXTZTMBKOF-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)c1 ZINC000915813826 1121639759 /nfs/dbraw/zinc/63/97/59/1121639759.db2.gz RUUPMXTZTMBKOF-UHFFFAOYSA-N 1 1 332.831 3.733 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H](C)C1 ZINC000282127335 1121865459 /nfs/dbraw/zinc/86/54/59/1121865459.db2.gz BFCVKGOJXZXKAU-VQIMIIECSA-N 1 1 341.451 3.971 20 10 EHCDMO C[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1Cc2ccccc2C1 ZINC000919950323 1123243107 /nfs/dbraw/zinc/24/31/07/1123243107.db2.gz XDCUIUMQCULAFT-UHFFFAOYSA-N 1 1 325.452 3.995 20 10 EHCDMO COC(=O)CC[N@@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C(C)C ZINC000733182941 1125021517 /nfs/dbraw/zinc/02/15/17/1125021517.db2.gz CSPPMLOYBZJPQQ-UHFFFAOYSA-N 1 1 345.439 3.791 20 10 EHCDMO C[N@H+](Cc1ccccc1O)C[C@@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000732203620 1130900261 /nfs/dbraw/zinc/90/02/61/1130900261.db2.gz YYQIXEZZUBYRLG-GOSISDBHSA-N 1 1 343.467 3.561 20 10 EHCDMO CC(C)(C)CCNC(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000732205072 1130900655 /nfs/dbraw/zinc/90/06/55/1130900655.db2.gz ZIJUIROZBIEBGT-UHFFFAOYSA-N 1 1 332.488 3.689 20 10 EHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000738284895 1131465760 /nfs/dbraw/zinc/46/57/60/1131465760.db2.gz IZYIQCMPBBTVJC-INIZCTEOSA-N 1 1 334.419 3.939 20 10 EHCDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000741724488 1131637049 /nfs/dbraw/zinc/63/70/49/1131637049.db2.gz MJFUJMGJLCVBOA-YJBOKZPZSA-N 1 1 339.483 3.615 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](N3CC=CC3)C1)oc1ccccc12 ZINC000742163141 1131691635 /nfs/dbraw/zinc/69/16/35/1131691635.db2.gz QIWZRTYGDIYUKA-MRXNPFEDSA-N 1 1 334.419 3.738 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000743869850 1131996151 /nfs/dbraw/zinc/99/61/51/1131996151.db2.gz CIGOJPKKYSKZKC-LJQANCHMSA-N 1 1 338.451 3.800 20 10 EHCDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000773428451 1132521017 /nfs/dbraw/zinc/52/10/17/1132521017.db2.gz POSTUJQAAFDTRA-LLVKDONJSA-N 1 1 335.245 3.963 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](CO)[C@H](C)c2ccccc2)c1O ZINC000766970060 1132924886 /nfs/dbraw/zinc/92/48/86/1132924886.db2.gz NGIRMXQHMCXKRZ-XIKOKIGWSA-N 1 1 347.842 3.502 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](CO)[C@@H](C)c2ccccc2)c1O ZINC000766970059 1132925058 /nfs/dbraw/zinc/92/50/58/1132925058.db2.gz NGIRMXQHMCXKRZ-SGTLLEGYSA-N 1 1 347.842 3.502 20 10 EHCDMO COc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc1C ZINC000768162571 1133103521 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COc1cccc(O)c1C[N@@H+](C)Cc1ccc(OC(F)(F)F)cc1 ZINC000768263807 1133119409 /nfs/dbraw/zinc/11/94/09/1133119409.db2.gz VYYCYUFTCFGNMY-UHFFFAOYSA-N 1 1 341.329 3.931 20 10 EHCDMO CCC1CCC([N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C2CC2)CC1 ZINC000768439127 1133138180 /nfs/dbraw/zinc/13/81/80/1133138180.db2.gz HXCRNPKGKBDURC-TYJKZOGGSA-N 1 1 331.456 3.751 20 10 EHCDMO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1cc(OC)c(C)cc1O ZINC000768445641 1133140372 /nfs/dbraw/zinc/14/03/72/1133140372.db2.gz SAMAUOHMJNPHGO-GOSISDBHSA-N 1 1 341.451 3.925 20 10 EHCDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768463481 1133144371 /nfs/dbraw/zinc/14/43/71/1133144371.db2.gz UQBIPOIAGRJARU-PZJWPPBQSA-N 1 1 339.435 3.573 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1c1cccc(F)c1 ZINC000768466432 1133145445 /nfs/dbraw/zinc/14/54/45/1133145445.db2.gz QHRUOYPULAPVCJ-LIUKBUMOSA-N 1 1 343.398 3.540 20 10 EHCDMO COC[C@H]1CCCC[N@H+](Cc2cc(C)cc(Br)c2O)C1 ZINC000768541558 1133153590 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CCOc1ccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c(O)c1 ZINC000769036471 1133217608 /nfs/dbraw/zinc/21/76/08/1133217608.db2.gz WUDDSUQTVKSVET-FQEVSTJZSA-N 1 1 341.451 3.972 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)c1O ZINC000769221878 1133245877 /nfs/dbraw/zinc/24/58/77/1133245877.db2.gz FZPVPJCSNYVICQ-MNOVXSKESA-N 1 1 328.250 3.784 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1c(OC)cc(OC)cc1OC ZINC000769201772 1133242813 /nfs/dbraw/zinc/24/28/13/1133242813.db2.gz YOHDDTILSNRUKL-UHFFFAOYSA-N 1 1 345.439 3.830 20 10 EHCDMO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310146 1133258613 /nfs/dbraw/zinc/25/86/13/1133258613.db2.gz WZYPOFQBMAELLP-FOIQADDNSA-N 1 1 328.431 3.854 20 10 EHCDMO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000769310146 1133258617 /nfs/dbraw/zinc/25/86/17/1133258617.db2.gz WZYPOFQBMAELLP-FOIQADDNSA-N 1 1 328.431 3.854 20 10 EHCDMO CCOc1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(O)c1 ZINC000769317603 1133260493 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1 330.384 3.591 20 10 EHCDMO COC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC001203645870 1134258217 /nfs/dbraw/zinc/25/82/17/1134258217.db2.gz UXVCCNZZMGXBAU-CQSZACIVSA-N 1 1 328.250 3.544 20 10 EHCDMO C[C@H](c1cccc(N2CCOC2=O)c1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000789767234 1134328772 /nfs/dbraw/zinc/32/87/72/1134328772.db2.gz GFMGXWPZKVVCMZ-CYBMUJFWSA-N 1 1 344.386 3.681 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000775147544 1134388945 /nfs/dbraw/zinc/38/89/45/1134388945.db2.gz VOYPUBFQJPSOEK-UHFFFAOYSA-N 1 1 331.213 3.926 20 10 EHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc([S@](C)=O)cc1 ZINC000790982879 1134496512 /nfs/dbraw/zinc/49/65/12/1134496512.db2.gz LFVFKKIFBIEJDT-STFLBKPXSA-N 1 1 341.835 3.773 20 10 EHCDMO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cccc(Br)c1O ZINC000775368987 1134668670 /nfs/dbraw/zinc/66/86/70/1134668670.db2.gz IJTIHPXGACFUIT-CABCVRRESA-N 1 1 342.277 3.838 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C(=O)OCC)c1ccccc1 ZINC000772798829 1134703078 /nfs/dbraw/zinc/70/30/78/1134703078.db2.gz SPBBRGUMBUAUPR-LJQANCHMSA-N 1 1 327.424 3.909 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)OCC)c1ccccc1 ZINC000772798829 1134703079 /nfs/dbraw/zinc/70/30/79/1134703079.db2.gz SPBBRGUMBUAUPR-LJQANCHMSA-N 1 1 327.424 3.909 20 10 EHCDMO CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792831093 1134798213 /nfs/dbraw/zinc/79/82/13/1134798213.db2.gz HRBPWXQRYGNHDG-CQSZACIVSA-N 1 1 343.437 3.545 20 10 EHCDMO COCCC1([NH2+]Cc2cc(C)cc(Br)c2O)CCC1 ZINC000793328855 1134905453 /nfs/dbraw/zinc/90/54/53/1134905453.db2.gz GPULMALQGHIDOQ-UHFFFAOYSA-N 1 1 328.250 3.512 20 10 EHCDMO COC(=O)C1([N@@H+](C)Cc2ccc(N3CCCCC3)c(C)c2)CCCC1 ZINC001191753132 1134917463 /nfs/dbraw/zinc/91/74/63/1134917463.db2.gz FOBNLTVNFDFTSW-UHFFFAOYSA-N 1 1 344.499 3.903 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c(C(F)(F)F)c1 ZINC000793620877 1134974126 /nfs/dbraw/zinc/97/41/26/1134974126.db2.gz RTYWJFHBJMEFNL-KRWDZBQOSA-N 1 1 342.405 3.774 20 10 EHCDMO COc1cc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000793740991 1134988035 /nfs/dbraw/zinc/98/80/35/1134988035.db2.gz IAISMYROMXYMFS-KRWDZBQOSA-N 1 1 347.499 3.947 20 10 EHCDMO CC[C@H]([NH2+]CCc1c[nH+]cn1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806159914 1135404133 /nfs/dbraw/zinc/40/41/33/1135404133.db2.gz NMQUAEVSQCEVMW-AWEZNQCLSA-N 1 1 328.243 3.716 20 10 EHCDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000775650008 1135416973 /nfs/dbraw/zinc/41/69/73/1135416973.db2.gz WOHQWYSRXPEYFI-LJQANCHMSA-N 1 1 337.511 3.940 20 10 EHCDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000775650008 1135416976 /nfs/dbraw/zinc/41/69/76/1135416976.db2.gz WOHQWYSRXPEYFI-LJQANCHMSA-N 1 1 337.511 3.940 20 10 EHCDMO C[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000807840273 1135576630 /nfs/dbraw/zinc/57/66/30/1135576630.db2.gz WHYWXZXKJGZWLV-OUAUKWLOSA-N 1 1 345.270 3.577 20 10 EHCDMO C[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000807840273 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348.450 3.865 20 10 EHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000809766311 1135888713 /nfs/dbraw/zinc/88/87/13/1135888713.db2.gz XDKXTVQNPZMDQG-HXUWFJFHSA-N 1 1 325.456 3.501 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(O)c1 ZINC000776015854 1135921248 /nfs/dbraw/zinc/92/12/48/1135921248.db2.gz YAOUIWHCPNNHBG-NRFANRHFSA-N 1 1 339.435 3.812 20 10 EHCDMO Cc1cc(Br)cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1O ZINC000811512500 1136102779 /nfs/dbraw/zinc/10/27/79/1136102779.db2.gz MQTUFYAHJRYQGF-SNVBAGLBSA-N 1 1 334.204 3.940 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H]2C[C@H](C)n3ncnc32)cc1 ZINC000850351707 1136239662 /nfs/dbraw/zinc/23/96/62/1136239662.db2.gz GVEGKLYBWHTZRV-YJBOKZPZSA-N 1 1 327.476 3.700 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812736816 1136239975 /nfs/dbraw/zinc/23/99/75/1136239975.db2.gz OQKGHEJUKDNDMY-KBPBESRZSA-N 1 1 332.394 3.848 20 10 EHCDMO COCc1csc(C[NH2+]Cc2cccc(Br)c2O)c1 ZINC000850377620 1136245513 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Cc1cc(O)c(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)cc1Cl ZINC000825885556 1137654604 /nfs/dbraw/zinc/65/46/04/1137654604.db2.gz HXVYWXMDVWZIMA-AWEZNQCLSA-N 1 1 337.769 3.633 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCc2ccccc21 ZINC000876561644 1137655559 /nfs/dbraw/zinc/65/55/59/1137655559.db2.gz QFRLHWLPSSWNDK-QFIPXVFZSA-N 1 1 336.479 3.767 20 10 EHCDMO COCCc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000876570429 1137655929 /nfs/dbraw/zinc/65/59/29/1137655929.db2.gz CDDJSBYCERAERQ-UHFFFAOYSA-N 1 1 345.512 3.563 20 10 EHCDMO Cc1cccc2c1CC[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC000876695169 1137659303 /nfs/dbraw/zinc/65/93/03/1137659303.db2.gz SWJJSXWOFUHWNQ-UHFFFAOYSA-N 1 1 336.479 3.514 20 10 EHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC12CCC2 ZINC000877175856 1137672304 /nfs/dbraw/zinc/67/23/04/1137672304.db2.gz LOHNLRVHXJUQEO-QGZVFWFLSA-N 1 1 328.500 3.660 20 10 EHCDMO Cc1ccc(C[N@H+]2CCC23CCN(C(=O)OC(C)(C)C)CC3)c(O)c1 ZINC000877540929 1137680420 /nfs/dbraw/zinc/68/04/20/1137680420.db2.gz BSDKIHLIXWCVNU-UHFFFAOYSA-N 1 1 346.471 3.676 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc(C(F)F)nc2)cc1 ZINC000877611166 1137682849 /nfs/dbraw/zinc/68/28/49/1137682849.db2.gz XMKCGFQBOXREIE-UHFFFAOYSA-N 1 1 335.398 3.596 20 10 EHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1 ZINC000877672413 1137685156 /nfs/dbraw/zinc/68/51/56/1137685156.db2.gz DUSMBFFXLRJNDC-HWEXMVQRSA-N 1 1 336.479 3.964 20 10 EHCDMO C[N@@H+](CC[C@@H]1CCCC1(F)F)Cc1ccc(N2CCOCC2)cc1 ZINC000877923229 1137695856 /nfs/dbraw/zinc/69/58/56/1137695856.db2.gz LWDORZPIJHBCDN-KRWDZBQOSA-N 1 1 338.442 3.781 20 10 EHCDMO CCOc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccccc3O)n2)cc1 ZINC000879653348 1137754012 /nfs/dbraw/zinc/75/40/12/1137754012.db2.gz OLEXVECBJQNLHQ-ZDUSSCGKSA-N 1 1 339.395 3.692 20 10 EHCDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000129722550 1137829423 /nfs/dbraw/zinc/82/94/23/1137829423.db2.gz OUTCMKUOQBMHMB-HNNXBMFYSA-N 1 1 346.421 3.994 20 10 EHCDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c(C)s1 ZINC000883289477 1137852779 /nfs/dbraw/zinc/85/27/79/1137852779.db2.gz PUUDOBMREZABPK-MRXNPFEDSA-N 1 1 343.540 3.968 20 10 EHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c2ccccc21 ZINC000883290956 1137852989 /nfs/dbraw/zinc/85/29/89/1137852989.db2.gz NYPCEWWVLVVAHQ-VGSWGCGISA-N 1 1 335.495 3.777 20 10 EHCDMO COc1cccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1O ZINC000120540757 1137950761 /nfs/dbraw/zinc/95/07/61/1137950761.db2.gz ANJAJSDKSYYTRO-OAHLLOKOSA-N 1 1 333.453 3.644 20 10 EHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(C3CC3)no2)c(C(F)(F)F)c1 ZINC000886270548 1138063364 /nfs/dbraw/zinc/06/33/64/1138063364.db2.gz GSTMQTHBPVWEEV-UHFFFAOYSA-N 1 1 339.361 3.927 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(N2CCOC2=O)cc1 ZINC000886512536 1138087264 /nfs/dbraw/zinc/08/72/64/1138087264.db2.gz INWAGZAIJTYFKY-OLZOCXBDSA-N 1 1 344.386 3.900 20 10 EHCDMO COc1cccc(N2CC[C@H](C[NH2+][C@@H](C)c3c(O)cccc3F)C2)c1 ZINC000886520861 1138089038 /nfs/dbraw/zinc/08/90/38/1138089038.db2.gz OSYSSYRITFVADX-LSDHHAIUSA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1c(O)cccc1F ZINC000886553685 1138095433 /nfs/dbraw/zinc/09/54/33/1138095433.db2.gz SWXMCCGDUHNVNO-GDBMZVCRSA-N 1 1 331.431 3.984 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1c(O)cccc1F ZINC000886645045 1138105569 /nfs/dbraw/zinc/10/55/69/1138105569.db2.gz QKNXLWNQXMHPCF-CYBMUJFWSA-N 1 1 331.387 3.602 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H]1CCCOC1 ZINC000886788483 1138140627 /nfs/dbraw/zinc/14/06/27/1138140627.db2.gz CLAMHLMNLUYLSE-HFAKWTLXSA-N 1 1 348.270 3.791 20 10 EHCDMO COC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)[C@H]1CCCOC1 ZINC000886789534 1138140767 /nfs/dbraw/zinc/14/07/67/1138140767.db2.gz XEDYUGVCIWMLKL-XUJVJEKNSA-N 1 1 347.377 3.503 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000091974728 1138223370 /nfs/dbraw/zinc/22/33/70/1138223370.db2.gz CMARSTNBIMGVEP-UHFFFAOYSA-N 1 1 338.310 3.534 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1O ZINC000093594374 1138238843 /nfs/dbraw/zinc/23/88/43/1138238843.db2.gz WKLFKNKACUHYQW-OAHLLOKOSA-N 1 1 343.398 3.635 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@@H]2c2nncn2C)cc1 ZINC000093810294 1138241315 /nfs/dbraw/zinc/24/13/15/1138241315.db2.gz BHOZRADRUOKUNA-LJQANCHMSA-N 1 1 341.503 3.779 20 10 EHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@@H]2c2nncn2C)cc1 ZINC000093810294 1138241317 /nfs/dbraw/zinc/24/13/17/1138241317.db2.gz BHOZRADRUOKUNA-LJQANCHMSA-N 1 1 341.503 3.779 20 10 EHCDMO CC(C)[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)NC(=O)OC(C)(C)C ZINC000301809245 1138650325 /nfs/dbraw/zinc/65/03/25/1138650325.db2.gz FSTQPOCPEINSMU-DOMZBBRYSA-N 1 1 340.439 3.731 20 10 EHCDMO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2cccc(C)c2O)c(C)c1 ZINC000179716173 1139776878 /nfs/dbraw/zinc/77/68/78/1139776878.db2.gz AIUYUINISOBZEW-UHFFFAOYSA-N 1 1 326.440 3.696 20 10 EHCDMO CC(C)Oc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185478819 1140152088 /nfs/dbraw/zinc/15/20/88/1140152088.db2.gz HXFONSZKOUXFDS-BFUOFWGJSA-N 1 1 333.403 3.703 20 10 EHCDMO CC(=O)N1CCC(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000192837022 1140552625 /nfs/dbraw/zinc/55/26/25/1140552625.db2.gz BDVMLUBBRZICET-SNVBAGLBSA-N 1 1 345.270 3.608 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1O ZINC000271135357 1141312739 /nfs/dbraw/zinc/31/27/39/1141312739.db2.gz SLZYCKGCHDHZNR-QGZVFWFLSA-N 1 1 337.423 3.625 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)c1c[nH]c2ncccc12 ZINC000271200881 1141323573 /nfs/dbraw/zinc/32/35/73/1141323573.db2.gz FNRJPHUNAFALEZ-AWEZNQCLSA-N 1 1 337.423 3.752 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)c1O ZINC000183211998 1125470491 /nfs/dbraw/zinc/47/04/91/1125470491.db2.gz GDPHGWYXZWSVGT-KRWDZBQOSA-N 1 1 331.387 3.583 20 10 EHCDMO COc1ccc(-n2ccc(C[NH2+][C@H](C)c3ccc(F)cc3O)n2)cc1 ZINC000185347869 1032381350 /nfs/dbraw/zinc/38/13/50/1032381350.db2.gz DPEOIQYERLKLSD-CYBMUJFWSA-N 1 1 341.386 3.576 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H](O)C(F)F ZINC000834875871 1020988083 /nfs/dbraw/zinc/98/80/83/1020988083.db2.gz UXWZKSTUNMKYET-IAOBUDJDSA-N 1 1 328.186 3.754 20 10 EHCDMO C[N@@H+](C/C=C\c1ccc(F)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000255325824 1021111166 /nfs/dbraw/zinc/11/11/66/1021111166.db2.gz MCLITDIKYKOMIR-IHWYPQMZSA-N 1 1 340.442 3.808 20 10 EHCDMO CC[C@H]1C[NH+](Cc2cc(Br)cc(C)c2O)C[C@H](CC)O1 ZINC000398744121 1021150212 /nfs/dbraw/zinc/15/02/12/1021150212.db2.gz SJPCLEJGBQLZTB-GJZGRUSLSA-N 1 1 342.277 3.853 20 10 EHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c1O ZINC000894882985 1021628851 /nfs/dbraw/zinc/62/88/51/1021628851.db2.gz HFAZUIMTQUUIPN-INIZCTEOSA-N 1 1 335.831 3.528 20 10 EHCDMO Cc1cc(O)c(C[NH+]2CCN(C(=O)C(C)(C)C)CC2)cc1C(C)C ZINC000129799911 1033033853 /nfs/dbraw/zinc/03/38/53/1033033853.db2.gz CZOUCPPQGQBPEF-UHFFFAOYSA-N 1 1 332.488 3.514 20 10 EHCDMO COc1cc(C)cc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000894543861 1022517228 /nfs/dbraw/zinc/51/72/28/1022517228.db2.gz XBJUFRUIYMCSLO-CYBMUJFWSA-N 1 1 345.443 3.991 20 10 EHCDMO COc1ccccc1-c1noc([C@@H](C)[NH2+]Cc2cccc(C)c2O)n1 ZINC000276757853 1022613809 /nfs/dbraw/zinc/61/38/09/1022613809.db2.gz MJZOWOBEHXFNAR-CYBMUJFWSA-N 1 1 339.395 3.610 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)cc1OC ZINC000295131228 1023169754 /nfs/dbraw/zinc/16/97/54/1023169754.db2.gz ONQXQDLNHNKKCO-TUAOUCFPSA-N 1 1 347.377 3.961 20 10 EHCDMO CC[N@H+](Cc1ccc(OC)c(OC)c1O)Cc1c(F)cccc1F ZINC000891901901 1023365151 /nfs/dbraw/zinc/36/51/51/1023365151.db2.gz IKXONPBECMHJKF-UHFFFAOYSA-N 1 1 337.366 3.710 20 10 EHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1O)Cc1c(F)cccc1F ZINC000891901901 1023365154 /nfs/dbraw/zinc/36/51/54/1023365154.db2.gz IKXONPBECMHJKF-UHFFFAOYSA-N 1 1 337.366 3.710 20 10 EHCDMO Cc1cccc(CNc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c1O ZINC000895645686 1024688900 /nfs/dbraw/zinc/68/89/00/1024688900.db2.gz AEJRESNQEVWQRR-FQEVSTJZSA-N 1 1 337.467 3.597 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](Cc3nc(C)cs3)C2)c1 ZINC000895823406 1024876321 /nfs/dbraw/zinc/87/63/21/1024876321.db2.gz QHUGGTFRXDKQBU-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO Cn1ccc([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)n1 ZINC000896494355 1025497605 /nfs/dbraw/zinc/49/76/05/1025497605.db2.gz IFKRWEZACVWTJT-LJQANCHMSA-N 1 1 338.499 3.790 20 10 EHCDMO Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]Cc1c(O)cccc1F ZINC000896642500 1025775383 /nfs/dbraw/zinc/77/53/83/1025775383.db2.gz YGJGSESMVJUNHG-UHFFFAOYSA-N 1 1 339.414 3.683 20 10 EHCDMO CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Br)ccc1[O-] ZINC000020129062 1025775551 /nfs/dbraw/zinc/77/55/51/1025775551.db2.gz CXBOXAMCDFLSQF-OAHLLOKOSA-N 1 1 341.293 3.681 20 10 EHCDMO CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896636257 1025788788 /nfs/dbraw/zinc/78/87/88/1025788788.db2.gz BTPGDAHZNUWTDY-CYBMUJFWSA-N 1 1 330.403 3.601 20 10 EHCDMO CCN(CC)C(=O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176677080 1026427587 /nfs/dbraw/zinc/42/75/87/1026427587.db2.gz OCYWETZKKCVUCN-QGZVFWFLSA-N 1 1 340.467 3.824 20 10 EHCDMO CC(C)CNC(=O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176677829 1026451767 /nfs/dbraw/zinc/45/17/67/1026451767.db2.gz XLHSXCQTLGEGMP-KRWDZBQOSA-N 1 1 340.467 3.728 20 10 EHCDMO Fc1cc(CNc2cc[nH+]c3ccsc32)ccc1N1CCOCC1 ZINC000301366855 1026779286 /nfs/dbraw/zinc/77/92/86/1026779286.db2.gz NYUHELMSAHYAMA-UHFFFAOYSA-N 1 1 343.427 3.884 20 10 EHCDMO COC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000273350663 1027391207 /nfs/dbraw/zinc/39/12/07/1027391207.db2.gz BQAVHVAITJAXHW-LBPRGKRZSA-N 1 1 332.375 3.603 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](Cc3nc(C)cs3)C2)c1 ZINC000897299074 1027399620 /nfs/dbraw/zinc/39/96/20/1027399620.db2.gz UBQFGHMGVMOVPE-CQSZACIVSA-N 1 1 332.469 3.620 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(F)cccc1F)Cc1cc(C)c(C)cc1O ZINC000192464392 1029678777 /nfs/dbraw/zinc/67/87/77/1029678777.db2.gz VFVAOSXTSHTHRZ-UHFFFAOYSA-N 1 1 348.393 3.748 20 10 EHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c1 ZINC000160197814 1030596589 /nfs/dbraw/zinc/59/65/89/1030596589.db2.gz MOWPYCVMCSHHGO-SFHVURJKSA-N 1 1 327.424 3.587 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000180724095 1031903927 /nfs/dbraw/zinc/90/39/27/1031903927.db2.gz VKZUDOVWSMKTGT-PXNSSMCTSA-N 1 1 345.414 3.628 20 10 EHCDMO COc1cc(O)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1OC ZINC000181030487 1031938335 /nfs/dbraw/zinc/93/83/35/1031938335.db2.gz DCDTYFJAJBBSJG-HXUWFJFHSA-N 1 1 339.391 3.882 20 10 EHCDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000708617310 1033577422 /nfs/dbraw/zinc/57/74/22/1033577422.db2.gz GFMXIXBHHYXAOL-GFCCVEGCSA-N 1 1 338.167 3.929 20 10 EHCDMO Cc1ccc([C@@H](C)[NH2+]CC(F)(F)CNC(=O)OC(C)(C)C)c(O)c1 ZINC000310052952 1034206128 /nfs/dbraw/zinc/20/61/28/1034206128.db2.gz UDVUONFGEVUUHM-GFCCVEGCSA-N 1 1 344.402 3.511 20 10 EHCDMO COc1cc(Cl)cc(CN2CC[N@@H+](C)CC23CCCCC3)c1O ZINC000761203912 1034414625 /nfs/dbraw/zinc/41/46/25/1034414625.db2.gz NEKPNZVCSJIXEU-UHFFFAOYSA-N 1 1 338.879 3.505 20 10 EHCDMO C[C@H]1CCC[N@@H+](Cc2ccc(I)cc2O)[C@H]1C ZINC001232979129 1035637354 /nfs/dbraw/zinc/63/73/54/1035637354.db2.gz SKTGMPFCSLYLRH-QWRGUYRKSA-N 1 1 345.224 3.617 20 10 EHCDMO CCC[N@@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccccc1O ZINC000728927534 1039489799 /nfs/dbraw/zinc/48/97/99/1039489799.db2.gz SMMALYXUHMTOSJ-UHFFFAOYSA-N 1 1 330.403 3.772 20 10 EHCDMO Cc1c2ccccc2n(C)c1CNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000473263986 1039668595 /nfs/dbraw/zinc/66/85/95/1039668595.db2.gz QTBOYLMIFCWBFN-IBGZPJMESA-N 1 1 339.483 3.510 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC([C@H](O)c2ccccc2)CC1 ZINC000893918189 1039823494 /nfs/dbraw/zinc/82/34/94/1039823494.db2.gz IEYNXJMYEHVQOU-GOSISDBHSA-N 1 1 333.378 3.616 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000894088643 1040064316 /nfs/dbraw/zinc/06/43/16/1040064316.db2.gz NCSYWJMPPHIIHG-ZFWWWQNUSA-N 1 1 339.407 3.820 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000894088643 1040064334 /nfs/dbraw/zinc/06/43/34/1040064334.db2.gz NCSYWJMPPHIIHG-ZFWWWQNUSA-N 1 1 339.407 3.820 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000894088643 1040064347 /nfs/dbraw/zinc/06/43/47/1040064347.db2.gz NCSYWJMPPHIIHG-ZFWWWQNUSA-N 1 1 339.407 3.820 20 10 EHCDMO CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000044515711 1040964331 /nfs/dbraw/zinc/96/43/31/1040964331.db2.gz NKWDVDGYSWYUEW-HNNXBMFYSA-N 1 1 341.293 3.537 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)c(O)c1OC ZINC000893530822 1042392600 /nfs/dbraw/zinc/39/26/00/1042392600.db2.gz COOXGUWDMAQCEC-MRXNPFEDSA-N 1 1 327.424 3.707 20 10 EHCDMO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)c1 ZINC000278887894 1042840163 /nfs/dbraw/zinc/84/01/63/1042840163.db2.gz PBFKTUDBMZEZLV-GFCCVEGCSA-N 1 1 346.383 3.559 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000279855540 1044754956 /nfs/dbraw/zinc/75/49/56/1044754956.db2.gz SDGIJPUIARFTTJ-OAHLLOKOSA-N 1 1 346.358 3.615 20 10 EHCDMO Nc1cc(Cl)cc(NCc2cc(Cl)c3cccnc3c2O)[nH+]1 ZINC001168528311 1126909864 /nfs/dbraw/zinc/90/98/64/1126909864.db2.gz SRHGKCGRBKPHIF-UHFFFAOYSA-N 1 1 335.194 3.837 20 10 EHCDMO [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843125321 1128509699 /nfs/dbraw/zinc/50/96/99/1128509699.db2.gz SLYCJVXHWKRXNS-NEPJUHHUSA-N 1 1 329.271 3.521 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@@H](C)C1 ZINC000282127331 1121866060 /nfs/dbraw/zinc/86/60/60/1121866060.db2.gz BFCVKGOJXZXKAU-LPHOPBHVSA-N 1 1 341.451 3.971 20 10 EHCDMO COC(=O)c1oc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1C ZINC000917074918 1122471906 /nfs/dbraw/zinc/47/19/06/1122471906.db2.gz LSPIVRRGUPZPMO-UHFFFAOYSA-N 1 1 344.455 3.851 20 10 EHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1O ZINC001143104228 1129064747 /nfs/dbraw/zinc/06/47/47/1129064747.db2.gz RFKCYSPJJXOCLE-KRWDZBQOSA-N 1 1 345.405 3.969 20 10 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/nfs/dbraw/zinc/61/57/58/1133615758.db2.gz DRYMENPMMSUWIP-UHFFFAOYSA-N 1 1 328.847 3.686 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CCO)C1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000774358687 1133664248 /nfs/dbraw/zinc/66/42/48/1133664248.db2.gz KZYKGFPRWWGJAV-BMIGLBTASA-N 1 1 348.270 3.527 20 10 EHCDMO CCO[C@@H](C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O)c1ccccc1 ZINC000774495526 1133689667 /nfs/dbraw/zinc/68/96/67/1133689667.db2.gz JGRZROODFZKWTH-KUHUBIRLSA-N 1 1 343.423 3.607 20 10 EHCDMO CC(C)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C1(CO)CC=CC1 ZINC001182532496 1133697802 /nfs/dbraw/zinc/69/78/02/1133697802.db2.gz DCTBLEGGFKQQKV-INIZCTEOSA-N 1 1 327.827 3.628 20 10 EHCDMO C[N@H+](Cc1ccc(Cl)cc1O)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC001183632168 1133838741 /nfs/dbraw/zinc/83/87/41/1133838741.db2.gz YUPNEJNVUAREDT-MRXNPFEDSA-N 1 1 346.814 3.503 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c(O)cc1C ZINC000774702622 1133884349 /nfs/dbraw/zinc/88/43/49/1133884349.db2.gz MQYZPQIKDGTOGL-OAQYLSRUSA-N 1 1 339.435 3.731 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3cncn3C(C)(C)C)C2)c1 ZINC001184373669 1133932820 /nfs/dbraw/zinc/93/28/20/1133932820.db2.gz CVKWDIRYPRETMO-OAHLLOKOSA-N 1 1 343.471 3.732 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774828319 1134027268 /nfs/dbraw/zinc/02/72/68/1134027268.db2.gz WOXRZPNCVITZHJ-INIZCTEOSA-N 1 1 342.395 3.955 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000774828382 1134027542 /nfs/dbraw/zinc/02/75/42/1134027542.db2.gz ZMRZDTNMISFCEI-MRXNPFEDSA-N 1 1 342.395 3.516 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000774828382 1134027548 /nfs/dbraw/zinc/02/75/48/1134027548.db2.gz ZMRZDTNMISFCEI-MRXNPFEDSA-N 1 1 342.395 3.516 20 10 EHCDMO COc1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)ccc1C ZINC000774820417 1134030995 /nfs/dbraw/zinc/03/09/95/1134030995.db2.gz KDHWGSYPDZNPMR-LJQANCHMSA-N 1 1 341.451 3.890 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@@H](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774904639 1134113853 /nfs/dbraw/zinc/11/38/53/1134113853.db2.gz IETFOIKRCLEARS-AWEZNQCLSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@@H](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000774904639 1134113855 /nfs/dbraw/zinc/11/38/55/1134113855.db2.gz IETFOIKRCLEARS-AWEZNQCLSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774951219 1134145937 /nfs/dbraw/zinc/14/59/37/1134145937.db2.gz FBTCFCLNWFMIJA-INIZCTEOSA-N 1 1 348.374 3.935 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cccc(C(F)(F)F)c1O ZINC000788694045 1134158478 /nfs/dbraw/zinc/15/84/78/1134158478.db2.gz UJUKWQNOPGYIGH-NWDGAFQWSA-N 1 1 345.361 3.747 20 10 EHCDMO CC(C)[C@H](O)C1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000788694996 1134163935 /nfs/dbraw/zinc/16/39/35/1134163935.db2.gz YODXJPNFUIHMRY-ABAIWWIYSA-N 1 1 331.378 3.859 20 10 EHCDMO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000788798680 1134170315 /nfs/dbraw/zinc/17/03/15/1134170315.db2.gz AONYHRUMAGNYJM-TUAOUCFPSA-N 1 1 345.361 3.793 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000775005774 1134197727 /nfs/dbraw/zinc/19/77/27/1134197727.db2.gz VIQLHLYBIWKVPQ-CYBMUJFWSA-N 1 1 344.411 3.765 20 10 EHCDMO Oc1ccc(Cl)cc1C[NH+]1CCN(Cc2ccccc2F)CC1 ZINC001203657135 1134318374 /nfs/dbraw/zinc/31/83/74/1134318374.db2.gz FWKXHKSHYZQISP-UHFFFAOYSA-N 1 1 334.822 3.503 20 10 EHCDMO CC[C@@H](C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000790788454 1134465354 /nfs/dbraw/zinc/46/53/54/1134465354.db2.gz XRXCSTYSUZQQSM-CZUORRHYSA-N 1 1 338.879 3.562 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCOc1ccc(F)cc1F ZINC000790958746 1134485685 /nfs/dbraw/zinc/48/56/85/1134485685.db2.gz AWPWHHUWSZNUQH-UHFFFAOYSA-N 1 1 331.721 3.632 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000790980186 1134495569 /nfs/dbraw/zinc/49/55/69/1134495569.db2.gz JQXXJMPSJADCLC-SCDSUCTJSA-N 1 1 333.881 3.654 20 10 EHCDMO C[N@@H+](CCC(=O)NCc1ccc(N2CCCC2)cc1)C1CCCCC1 ZINC000791127356 1134507173 /nfs/dbraw/zinc/50/71/73/1134507173.db2.gz DAMXFJWOAQVRGU-UHFFFAOYSA-N 1 1 343.515 3.558 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@@H](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000775203255 1134516508 /nfs/dbraw/zinc/51/65/08/1134516508.db2.gz BRTKNQJCIZYGFG-AWEZNQCLSA-N 1 1 344.411 3.680 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@@H](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000775203255 1134516513 /nfs/dbraw/zinc/51/65/13/1134516513.db2.gz BRTKNQJCIZYGFG-AWEZNQCLSA-N 1 1 344.411 3.680 20 10 EHCDMO OCC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCc2ccccc21 ZINC000792167077 1134662167 /nfs/dbraw/zinc/66/21/67/1134662167.db2.gz YZWYJBWHWDUZLO-INIZCTEOSA-N 1 1 335.806 3.667 20 10 EHCDMO OCC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCc2ccccc21 ZINC000792167077 1134662171 /nfs/dbraw/zinc/66/21/71/1134662171.db2.gz YZWYJBWHWDUZLO-INIZCTEOSA-N 1 1 335.806 3.667 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)Nc1cccnc1Cl ZINC000772797598 1134686486 /nfs/dbraw/zinc/68/64/86/1134686486.db2.gz GQGUZFIOSCVTKE-ZDUSSCGKSA-N 1 1 347.846 3.680 20 10 EHCDMO CCC[N@@H+](CCCn1c(=O)[nH]c2ccccc21)Cc1ccccc1O ZINC000772797536 1134690227 /nfs/dbraw/zinc/69/02/27/1134690227.db2.gz FPEBHBQADKJRQD-UHFFFAOYSA-N 1 1 339.439 3.750 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1ccc(OC)cc1 ZINC000772798225 1134695483 /nfs/dbraw/zinc/69/54/83/1134695483.db2.gz QNJFJIUESJGRAX-OAHLLOKOSA-N 1 1 342.439 3.640 20 10 EHCDMO c1ccc2c(c1)CCC[N@H+](Cc1ccc(N3CCOCC3)cc1)CC2 ZINC001170341722 1134758522 /nfs/dbraw/zinc/75/85/22/1134758522.db2.gz CORTVSAPPOUPEE-UHFFFAOYSA-N 1 1 336.479 3.514 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)CCOCC2CC2)c(C(F)(F)F)c1 ZINC000792838113 1134804187 /nfs/dbraw/zinc/80/41/87/1134804187.db2.gz IFCCDOVJCDIOOS-UHFFFAOYSA-N 1 1 330.394 3.630 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H]1CCN(c2ccc(F)cc2)C1=O ZINC001191278334 1134840221 /nfs/dbraw/zinc/84/02/21/1134840221.db2.gz RAKWWHHCOXNWGS-SFHVURJKSA-N 1 1 342.414 3.549 20 10 EHCDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793166415 1134858484 /nfs/dbraw/zinc/85/84/84/1134858484.db2.gz CBIKYCWMOVZIDX-MRXNPFEDSA-N 1 1 330.394 3.508 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1 ZINC000793604015 1134968031 /nfs/dbraw/zinc/96/80/31/1134968031.db2.gz HPDFHCQVODYERR-HXUWFJFHSA-N 1 1 346.471 3.534 20 10 EHCDMO CC[N@H+](Cc1cccs1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775644326 1135384848 /nfs/dbraw/zinc/38/48/48/1135384848.db2.gz HFNFZPBGCPVKNY-UHFFFAOYSA-N 1 1 329.513 3.522 20 10 EHCDMO CC[N@@H+](Cc1cccs1)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775644326 1135384854 /nfs/dbraw/zinc/38/48/54/1135384854.db2.gz HFNFZPBGCPVKNY-UHFFFAOYSA-N 1 1 329.513 3.522 20 10 EHCDMO CC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc(Cl)c1[O-] ZINC000806138097 1135390060 /nfs/dbraw/zinc/39/00/60/1135390060.db2.gz VQZFAAPFCPIHEB-QGZVFWFLSA-N 1 1 340.895 3.587 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2nc3c(s2)CCC3)C2CC2)cc1 ZINC000775649298 1135410308 /nfs/dbraw/zinc/41/03/08/1135410308.db2.gz NUTGQYZEGAYMSE-UHFFFAOYSA-N 1 1 327.497 3.862 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2nc3c(s2)CCC3)C2CC2)cc1 ZINC000775649298 1135410311 /nfs/dbraw/zinc/41/03/11/1135410311.db2.gz NUTGQYZEGAYMSE-UHFFFAOYSA-N 1 1 327.497 3.862 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1O ZINC000775740350 1135599045 /nfs/dbraw/zinc/59/90/45/1135599045.db2.gz VGXGBWKSPJOHQP-KDOFPFPSSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1O ZINC000775740350 1135599048 /nfs/dbraw/zinc/59/90/48/1135599048.db2.gz VGXGBWKSPJOHQP-KDOFPFPSSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1O ZINC000775740350 1135599052 /nfs/dbraw/zinc/59/90/52/1135599052.db2.gz VGXGBWKSPJOHQP-KDOFPFPSSA-N 1 1 334.891 3.803 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1O ZINC000775740350 1135599056 /nfs/dbraw/zinc/59/90/56/1135599056.db2.gz VGXGBWKSPJOHQP-KDOFPFPSSA-N 1 1 334.891 3.803 20 10 EHCDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000809644130 1135864803 /nfs/dbraw/zinc/86/48/03/1135864803.db2.gz WJZQEMJEWZRQLB-KRWDZBQOSA-N 1 1 349.858 3.827 20 10 EHCDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)Cc1cc(Cl)ccc1O ZINC000809714761 1135877031 /nfs/dbraw/zinc/87/70/31/1135877031.db2.gz QZSOPZVNBSAQLA-UHFFFAOYSA-N 1 1 338.879 3.659 20 10 EHCDMO CC(C)(C)OC(=O)NCC[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000809723461 1135878972 /nfs/dbraw/zinc/87/89/72/1135878972.db2.gz HTRAYQRPFAXMCR-INIZCTEOSA-N 1 1 334.460 3.662 20 10 EHCDMO CC[C@H]([NH2+]C[C@]1(CO)C[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000810246131 1135947836 /nfs/dbraw/zinc/94/78/36/1135947836.db2.gz LLDQLMJLFGABMG-BJLQDIEVSA-N 1 1 329.415 3.738 20 10 EHCDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc(N2CCCC2)n1 ZINC000810251371 1135948711 /nfs/dbraw/zinc/94/87/11/1135948711.db2.gz RAQDYEYYDSXQCQ-AWEZNQCLSA-N 1 1 329.419 3.686 20 10 EHCDMO COCc1nc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000810253306 1135949207 /nfs/dbraw/zinc/94/92/07/1135949207.db2.gz QNMTYPFJAFAYRE-SNVBAGLBSA-N 1 1 326.849 3.808 20 10 EHCDMO COc1ccc(C[NH2+]Cc2cccc(Br)c2O)c(C)c1 ZINC000776253049 1136101919 /nfs/dbraw/zinc/10/19/19/1136101919.db2.gz LTCKPYHQUKIYFD-UHFFFAOYSA-N 1 1 336.229 3.762 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000812295156 1136195760 /nfs/dbraw/zinc/19/57/60/1136195760.db2.gz XBYVLTDOCYGWDX-QGZVFWFLSA-N 1 1 327.472 3.896 20 10 EHCDMO CC(C)[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@@H]1CCOC1 ZINC000812775294 1136245349 /nfs/dbraw/zinc/24/53/49/1136245349.db2.gz BCNWNSDOBHLQST-LJQANCHMSA-N 1 1 341.451 3.971 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1cnn(C)c1)c1ccc(Cl)cc1O ZINC000850540231 1136282297 /nfs/dbraw/zinc/28/22/97/1136282297.db2.gz KDHWJPJZUDDBSJ-DXCKQFNASA-N 1 1 333.863 3.841 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1 ZINC000853240467 1136521391 /nfs/dbraw/zinc/52/13/91/1136521391.db2.gz JCAUYSSJDLYROV-SNVBAGLBSA-N 1 1 333.350 3.808 20 10 EHCDMO Cc1cc(C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)ccc1N(C)C ZINC000815076635 1136547966 /nfs/dbraw/zinc/54/79/66/1136547966.db2.gz VGIFBWVQIYAYRW-QFIPXVFZSA-N 1 1 336.479 3.735 20 10 EHCDMO Cc1ccc(O)c([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c1 ZINC000854222299 1136599301 /nfs/dbraw/zinc/59/93/01/1136599301.db2.gz DZWVLHPLNRVEJZ-POZUXBRTSA-N 1 1 328.431 3.636 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000854315405 1136606797 /nfs/dbraw/zinc/60/67/97/1136606797.db2.gz USKTVVFXTHYJRV-QGZVFWFLSA-N 1 1 347.503 3.577 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](C)N1CCCCC1)c1cccc(C(F)(F)F)c1O ZINC000815562482 1136610920 /nfs/dbraw/zinc/61/09/20/1136610920.db2.gz GPCYWSYENROBII-QWHCGFSZSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@H]([NH2+]C[C@H](O)c1ccccc1F)c1cccc(C(F)(F)F)c1O ZINC000815563290 1136611349 /nfs/dbraw/zinc/61/13/49/1136611349.db2.gz YIJUUTOWLDPHJZ-BONVTDFDSA-N 1 1 343.320 3.934 20 10 EHCDMO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000815627698 1136621536 /nfs/dbraw/zinc/62/15/36/1136621536.db2.gz HDQDLHFRYJAHCW-HKUYNNGSSA-N 1 1 347.462 3.936 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCN1CC(F)(F)F ZINC000816522214 1136732804 /nfs/dbraw/zinc/73/28/04/1136732804.db2.gz OZNKBYMGFBWURN-CYBMUJFWSA-N 1 1 338.373 3.614 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(Cn2cccn2)cc1 ZINC000816528197 1136734311 /nfs/dbraw/zinc/73/43/11/1136734311.db2.gz QOTYBYUKIZBUHG-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000816565908 1136737500 /nfs/dbraw/zinc/73/75/00/1136737500.db2.gz FXWDFJCGVQQKTB-QWHCGFSZSA-N 1 1 340.870 3.927 20 10 EHCDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(Cl)c(F)cc1O ZINC000816600821 1136739830 /nfs/dbraw/zinc/73/98/30/1136739830.db2.gz IQXNUVHCCOUADO-QXMXGUDHSA-N 1 1 349.837 3.829 20 10 EHCDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(Cl)c(F)cc1O ZINC000816600821 1136739832 /nfs/dbraw/zinc/73/98/32/1136739832.db2.gz IQXNUVHCCOUADO-QXMXGUDHSA-N 1 1 349.837 3.829 20 10 EHCDMO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCc1ccc(N2CCSCC2)cc1 ZINC000817887625 1136841514 /nfs/dbraw/zinc/84/15/14/1136841514.db2.gz AVMIKPKROQRPRF-HKUYNNGSSA-N 1 1 347.572 3.640 20 10 EHCDMO CC(C)C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817941430 1136848315 /nfs/dbraw/zinc/84/83/15/1136848315.db2.gz JSFUBQRLUPXXIC-UYAOXDASSA-N 1 1 326.488 3.524 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000818356702 1136875589 /nfs/dbraw/zinc/87/55/89/1136875589.db2.gz PVBFUAMMNGDZJK-IUCAKERBSA-N 1 1 340.832 3.701 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cc3n(n2)CCC3)c(C)n1-c1cccc(C)c1 ZINC000858293298 1136955305 /nfs/dbraw/zinc/95/53/05/1136955305.db2.gz LKFYWOXLDNRSFT-UHFFFAOYSA-N 1 1 334.467 3.835 20 10 EHCDMO CC[C@H]([NH2+]Cc1ccc(N(C)C(C)=O)cc1)c1ccc(F)cc1O ZINC000858499436 1136974004 /nfs/dbraw/zinc/97/40/04/1136974004.db2.gz ZQRZDCUCVWYMNB-SFHVURJKSA-N 1 1 330.403 3.755 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c1 ZINC000822529996 1137062544 /nfs/dbraw/zinc/06/25/44/1137062544.db2.gz MZVIUUWAKDMIJB-IBGZPJMESA-N 1 1 331.456 3.572 20 10 EHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1c(O)cccc1Br)C2 ZINC000862365376 1137140371 /nfs/dbraw/zinc/14/03/71/1137140371.db2.gz QIKVBBSYCZEAQB-UHFFFAOYSA-N 1 1 340.261 3.546 20 10 EHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Br)[C@@H]1[C@@H]1CCCO1 ZINC000862371906 1137140876 /nfs/dbraw/zinc/14/08/76/1137140876.db2.gz NSHMPTKDVDKKNU-LSDHHAIUSA-N 1 1 340.261 3.544 20 10 EHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1F ZINC000862384318 1137141584 /nfs/dbraw/zinc/14/15/84/1137141584.db2.gz VAUFDWHJMDCHQV-YJLNNSPDSA-N 1 1 338.442 3.546 20 10 EHCDMO CC(C)[C@H]1[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC12CCOCC2 ZINC000862395222 1137142155 /nfs/dbraw/zinc/14/21/55/1137142155.db2.gz QCKCYBVRBHDMEM-GOSISDBHSA-N 1 1 338.442 3.668 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000862398376 1137142449 /nfs/dbraw/zinc/14/24/49/1137142449.db2.gz GUGHOWKUZQUBHV-ZDUSSCGKSA-N 1 1 333.229 3.539 20 10 EHCDMO Cc1ccc(O)c(C[NH2+]C2CCN([C@H](C)Cc3ccccc3)CC2)c1 ZINC000862478540 1137145837 /nfs/dbraw/zinc/14/58/37/1137145837.db2.gz JEXRLWVTHVFSFY-GOSISDBHSA-N 1 1 338.495 3.886 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCc3ccc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000862539832 1137149017 /nfs/dbraw/zinc/14/90/17/1137149017.db2.gz WPDIUBKWHVVRCT-AWEZNQCLSA-N 1 1 348.786 3.740 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@]3(CCOC3)OC(C)(C)C2)cc1C(C)C ZINC000794694072 1137234751 /nfs/dbraw/zinc/23/47/51/1137234751.db2.gz JYCQCBXKEOXUSX-FQEVSTJZSA-N 1 1 333.472 3.594 20 10 EHCDMO [O-]c1cc(F)c(Br)cc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001144306938 1137270662 /nfs/dbraw/zinc/27/06/62/1137270662.db2.gz XDROFDTWKRVWRX-QMMMGPOBSA-N 1 1 338.167 3.771 20 10 EHCDMO Cc1cc(C[N@@H+]2C[C@H](C)O[C@]3(CCCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000794902170 1137332451 /nfs/dbraw/zinc/33/24/51/1137332451.db2.gz POHBAGQEIJPVFJ-HRAATJIYSA-N 1 1 347.499 3.768 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000846167576 1137337388 /nfs/dbraw/zinc/33/73/88/1137337388.db2.gz KXYXHUFTZHJKAM-AEFFLSMTSA-N 1 1 340.467 3.574 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC000866482222 1137358327 /nfs/dbraw/zinc/35/83/27/1137358327.db2.gz VSLHDSRHXSQFQC-KBXCAEBGSA-N 1 1 347.455 3.569 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c1 ZINC000866610564 1137369049 /nfs/dbraw/zinc/36/90/49/1137369049.db2.gz VDWWDSGUHRJLQH-ZLKJLUDKSA-N 1 1 343.345 3.727 20 10 EHCDMO COc1ccc(Cl)c2c1C[C@H]([N@H+]1CCc3cccc(O)c3C1)CC2 ZINC001171326163 1137420485 /nfs/dbraw/zinc/42/04/85/1137420485.db2.gz KHJUDNSAXBMAOD-CQSZACIVSA-N 1 1 343.854 3.970 20 10 EHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(Br)cc1O ZINC000825738592 1137613913 /nfs/dbraw/zinc/61/39/13/1137613913.db2.gz PVKFOXVJDPCBGP-LDYMZIIASA-N 1 1 338.167 3.927 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1-n1cccn1 ZINC001137102454 1137646758 /nfs/dbraw/zinc/64/67/58/1137646758.db2.gz WHKICHCXQGKUDL-UHFFFAOYSA-N 1 1 334.467 3.960 20 10 EHCDMO Cc1ccc(C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C2CC2)o1 ZINC000876569626 1137655894 /nfs/dbraw/zinc/65/58/94/1137655894.db2.gz JJBNQFNCQYWGLJ-UHFFFAOYSA-N 1 1 340.467 3.714 20 10 EHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)s1 ZINC000876686107 1137659119 /nfs/dbraw/zinc/65/91/19/1137659119.db2.gz PPIMJWUBTSSTST-UHFFFAOYSA-N 1 1 330.497 3.650 20 10 EHCDMO Clc1csc(C[NH2+]Cc2ccc(N3CCSCC3)cc2)n1 ZINC000876943020 1137665924 /nfs/dbraw/zinc/66/59/24/1137665924.db2.gz MQADDKWREBKPBB-UHFFFAOYSA-N 1 1 339.917 3.640 20 10 EHCDMO CC[N@H+](Cc1ccc(Br)cc1O)[C@H]1CCOC(C)(C)C1 ZINC000825943289 1137671833 /nfs/dbraw/zinc/67/18/33/1137671833.db2.gz BMQNQUQTOBUIPG-AWEZNQCLSA-N 1 1 342.277 3.934 20 10 EHCDMO CC[N@@H+](Cc1ccc(Br)cc1O)[C@H]1CCOC(C)(C)C1 ZINC000825943289 1137671834 /nfs/dbraw/zinc/67/18/34/1137671834.db2.gz BMQNQUQTOBUIPG-AWEZNQCLSA-N 1 1 342.277 3.934 20 10 EHCDMO Cc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)CC2 ZINC000877622597 1137683343 /nfs/dbraw/zinc/68/33/43/1137683343.db2.gz ADADDIHMTIVEJQ-UHFFFAOYSA-N 1 1 336.479 3.514 20 10 EHCDMO [O-]c1cc(Br)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000826016031 1137701145 /nfs/dbraw/zinc/70/11/45/1137701145.db2.gz FMHKNOAZBOIRMW-UHFFFAOYSA-N 1 1 341.293 3.510 20 10 EHCDMO Cc1cccc(Cl)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000878242180 1137708340 /nfs/dbraw/zinc/70/83/40/1137708340.db2.gz NXOXLSSLCXOLBL-ZDUSSCGKSA-N 1 1 332.831 3.813 20 10 EHCDMO Fc1cccc(C[N@@H+](Cc2ccc(N3CCOCC3)cc2)C2CC2)c1 ZINC000130147316 1137834470 /nfs/dbraw/zinc/83/44/70/1137834470.db2.gz FSNVUIIXENRSIB-UHFFFAOYSA-N 1 1 340.442 3.827 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1c(F)cccc1Cl ZINC000883025951 1137841847 /nfs/dbraw/zinc/84/18/47/1137841847.db2.gz CRYCKRPOZWHNQT-AYVTZFPOSA-N 1 1 345.748 3.675 20 10 EHCDMO Oc1cccc2c1[C@@H](Nc1ccc(N3CC[N@H+]4CCC[C@H]4C3)cc1)CC2 ZINC000883347513 1137856502 /nfs/dbraw/zinc/85/65/02/1137856502.db2.gz UEHXKNRJGSDZTK-PMACEKPBSA-N 1 1 349.478 3.776 20 10 EHCDMO CCOC(=O)CCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000132401600 1137865964 /nfs/dbraw/zinc/86/59/64/1137865964.db2.gz KSXHUWUYODIVHD-UHFFFAOYSA-N 1 1 332.488 3.842 20 10 EHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000282870111 1137891641 /nfs/dbraw/zinc/89/16/41/1137891641.db2.gz XWIBJQMFMJTPNC-MRXNPFEDSA-N 1 1 325.456 3.613 20 10 EHCDMO C[C@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1c(O)cccc1F ZINC000886501692 1138084767 /nfs/dbraw/zinc/08/47/67/1138084767.db2.gz USCRKJOQXJDSMO-JTQLQIEISA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1c(O)cccc1F ZINC000886502606 1138084857 /nfs/dbraw/zinc/08/48/57/1138084857.db2.gz GIIWVGDEHDDIKM-ZDUSSCGKSA-N 1 1 328.387 3.509 20 10 EHCDMO C[C@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1c(O)cccc1F ZINC000886506281 1138085582 /nfs/dbraw/zinc/08/55/82/1138085582.db2.gz KMYCZXIFBSXWAI-AWEZNQCLSA-N 1 1 329.419 3.767 20 10 EHCDMO COC(=O)CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886545127 1138093831 /nfs/dbraw/zinc/09/38/31/1138093831.db2.gz HJJAOCMTZHZQLO-CJNGLKHVSA-N 1 1 331.387 3.876 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886644843 1138105784 /nfs/dbraw/zinc/10/57/84/1138105784.db2.gz LXPCUEAMNWKEGO-IINYFYTJSA-N 1 1 343.320 3.934 20 10 EHCDMO CC[N@@H+](Cc1ccc(C(=O)N(C)C)cc1)Cc1cc(C)c(C)cc1O ZINC000077356501 1138139227 /nfs/dbraw/zinc/13/92/27/1138139227.db2.gz DLWRIHAKHSCXQT-UHFFFAOYSA-N 1 1 340.467 3.733 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCCOC1 ZINC000886788484 1138140692 /nfs/dbraw/zinc/14/06/92/1138140692.db2.gz CLAMHLMNLUYLSE-PGUXBMHVSA-N 1 1 348.270 3.791 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)[C@@H]1CCCOC1 ZINC000886789535 1138140857 /nfs/dbraw/zinc/14/08/57/1138140857.db2.gz XEDYUGVCIWMLKL-ZOWXZIJZSA-N 1 1 347.377 3.503 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2nncn2CC)cc1 ZINC000263891053 1138387358 /nfs/dbraw/zinc/38/73/58/1138387358.db2.gz MRIHIAYGWIPJRI-UHFFFAOYSA-N 1 1 349.482 3.614 20 10 EHCDMO CCN(C[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2O)C1)CC(F)(F)F ZINC000177637659 1139630639 /nfs/dbraw/zinc/63/06/39/1139630639.db2.gz AGCXJMYGJPQEHM-OAHLLOKOSA-N 1 1 344.421 3.715 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3ccsc3)cc2F)CC1 ZINC000177972236 1139659688 /nfs/dbraw/zinc/65/96/88/1139659688.db2.gz MTOZOSOCBIEJMG-OAHLLOKOSA-N 1 1 347.503 3.880 20 10 EHCDMO C[C@@H]([NH2+]C1CCN([C@H](C)c2ccncc2)CC1)c1ccc(F)cc1O ZINC000186152400 1140189119 /nfs/dbraw/zinc/18/91/19/1140189119.db2.gz PGBYNFYZGGCTOK-HUUCEWRRSA-N 1 1 343.446 3.803 20 10 EHCDMO COc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)ccn1 ZINC000192646475 1140541395 /nfs/dbraw/zinc/54/13/95/1140541395.db2.gz QKFUNMRBBJUTQP-SECBINFHSA-N 1 1 327.211 3.953 20 10 EHCDMO C[C@@H]([NH2+]CCCO[C@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000192951941 1140556260 /nfs/dbraw/zinc/55/62/60/1140556260.db2.gz NEVAKFYQEGKKMF-MNOVXSKESA-N 1 1 334.243 3.545 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2c[nH]nc2-c2cccnc2)C2CC2)cc1 ZINC000271052610 1141301704 /nfs/dbraw/zinc/30/17/04/1141301704.db2.gz QRUAZQZBKVAVMI-UHFFFAOYSA-N 1 1 347.466 3.702 20 10 EHCDMO Oc1ccccc1C[N@@H+](CCCC1CCOCC1)C[C@H]1CCCO1 ZINC000274212477 1141485860 /nfs/dbraw/zinc/48/58/60/1141485860.db2.gz ODBUYKSHUNGRSK-LJQANCHMSA-N 1 1 333.472 3.580 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c(O)cc1C ZINC000160300274 1017204757 /nfs/dbraw/zinc/20/47/57/1017204757.db2.gz IYNUCPIRJQANRN-GOSISDBHSA-N 1 1 341.451 3.748 20 10 EHCDMO OC[C@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC000293971869 1017803647 /nfs/dbraw/zinc/80/36/47/1017803647.db2.gz KDICFKHFCTUSGD-KRWDZBQOSA-N 1 1 341.451 3.566 20 10 EHCDMO CC[N@H+]1CCCC[C@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 ZINC000729282379 1019262438 /nfs/dbraw/zinc/26/24/38/1019262438.db2.gz URQBFOBSCXYCKB-FQEVSTJZSA-N 1 1 343.515 3.510 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000178887302 1019496167 /nfs/dbraw/zinc/49/61/67/1019496167.db2.gz WQSHMDVMHZKNAI-INIZCTEOSA-N 1 1 348.487 3.698 20 10 EHCDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000050901246 1020665101 /nfs/dbraw/zinc/66/51/01/1020665101.db2.gz GZZQRPJJUPRGQL-SJORKVTESA-N 1 1 332.488 3.526 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000172772860 1032936846 /nfs/dbraw/zinc/93/68/46/1032936846.db2.gz XPFLVCCSJXUADJ-MRXNPFEDSA-N 1 1 348.487 3.861 20 10 EHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000172772827 1032937461 /nfs/dbraw/zinc/93/74/61/1032937461.db2.gz XHODJHGLQVDQIR-GOSISDBHSA-N 1 1 340.423 3.630 20 10 EHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c(OC)c2O)cc1 ZINC000891398356 1020909864 /nfs/dbraw/zinc/90/98/64/1020909864.db2.gz VICHAWDZHWAGHU-QGZVFWFLSA-N 1 1 343.423 3.755 20 10 EHCDMO COc1ccccc1C[N@@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC000891598362 1022071962 /nfs/dbraw/zinc/07/19/62/1022071962.db2.gz QZHARKZXVQKIBN-UHFFFAOYSA-N 1 1 343.423 3.583 20 10 EHCDMO CC[C@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000796680244 1024115044 /nfs/dbraw/zinc/11/50/44/1024115044.db2.gz BVHPOQDGDBWSLH-SFHVURJKSA-N 1 1 325.387 3.958 20 10 EHCDMO Cc1noc(C[C@H]([NH2+][C@@H](C)c2ccc(F)cc2O)c2ccccc2)n1 ZINC000277213620 1024225913 /nfs/dbraw/zinc/22/59/13/1024225913.db2.gz WXZXAXFJDYAIBO-SJCJKPOMSA-N 1 1 341.386 3.857 20 10 EHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@H]2c2ccnn2C)c(O)c1 ZINC000281232424 1024794926 /nfs/dbraw/zinc/79/49/26/1024794926.db2.gz LCPFYWXRDSZOOV-SFHVURJKSA-N 1 1 329.444 3.642 20 10 EHCDMO CCOc1ccc(O)c(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000281659095 1025339922 /nfs/dbraw/zinc/33/99/22/1025339922.db2.gz NJUUSZMPXNOHBI-UHFFFAOYSA-N 1 1 329.293 3.637 20 10 EHCDMO COc1cc(C[NH2+]Cc2c(O)cccc2F)c(SC)cc1OC ZINC000896641318 1025794403 /nfs/dbraw/zinc/79/44/03/1025794403.db2.gz PZNVDORPRIDKMX-UHFFFAOYSA-N 1 1 337.416 3.560 20 10 EHCDMO CCOCCOCc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000273426634 1027422176 /nfs/dbraw/zinc/42/21/76/1027422176.db2.gz UISWQEURXORGPY-HNNXBMFYSA-N 1 1 347.430 3.935 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2)c1 ZINC000273462145 1027438371 /nfs/dbraw/zinc/43/83/71/1027438371.db2.gz CWAKOJOPRAYUJI-QWHCGFSZSA-N 1 1 329.396 3.599 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Br)ccc1O ZINC000273458039 1027438879 /nfs/dbraw/zinc/43/88/79/1027438879.db2.gz HMYUJXRIYXXUDO-TVQRCGJNSA-N 1 1 336.233 3.606 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](CCCO)c2ccccc2)c1O ZINC000271761803 1029156854 /nfs/dbraw/zinc/15/68/54/1029156854.db2.gz HUUWHHRQIVUUFO-SFHVURJKSA-N 1 1 347.842 3.852 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](c3noc(C4CC4)n3)C2)c1O ZINC000271813596 1029184451 /nfs/dbraw/zinc/18/44/51/1029184451.db2.gz MKSGUPCQBYLERH-ZDUSSCGKSA-N 1 1 347.846 3.994 20 10 EHCDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000128842182 1031356924 /nfs/dbraw/zinc/35/69/24/1031356924.db2.gz IYFCIRHAAYUKGO-OAHLLOKOSA-N 1 1 346.421 3.994 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000898326324 1033436722 /nfs/dbraw/zinc/43/67/22/1033436722.db2.gz VNCKDQPESOAODY-OAHLLOKOSA-N 1 1 333.229 3.791 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N(C)Cc1ccccc1 ZINC000174373262 1033911499 /nfs/dbraw/zinc/91/14/99/1033911499.db2.gz SNHQNDKWLBZWGA-QGZVFWFLSA-N 1 1 340.467 3.651 20 10 EHCDMO Cc1noc([C@@H]2CCC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)n1 ZINC000060126764 1034240633 /nfs/dbraw/zinc/24/06/33/1034240633.db2.gz POGDYCAMJVDDLY-OAHLLOKOSA-N 1 1 329.444 3.895 20 10 EHCDMO COCC[N@@H+](Cc1cccs1)Cc1cc(Cl)cc(OC)c1O ZINC000761183601 1034272193 /nfs/dbraw/zinc/27/21/93/1034272193.db2.gz OCCOUJKXQQUEJJ-UHFFFAOYSA-N 1 1 341.860 3.764 20 10 EHCDMO COc1cc(CN2CC[C@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000164398997 1035536638 /nfs/dbraw/zinc/53/66/38/1035536638.db2.gz AKTFABXXFGWVKE-MRXNPFEDSA-N 1 1 346.515 3.616 20 10 EHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)cc1 ZINC000783742746 1035895522 /nfs/dbraw/zinc/89/55/22/1035895522.db2.gz OXCUSSQYHARSPL-IRLDBZIGSA-N 1 1 336.479 3.527 20 10 EHCDMO CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000157499129 1037625684 /nfs/dbraw/zinc/62/56/84/1037625684.db2.gz MLWNWWSFNMOLCF-NQIIRXRSSA-N 1 1 329.532 3.743 20 10 EHCDMO CCN1CC[C@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000157499129 1037625691 /nfs/dbraw/zinc/62/56/91/1037625691.db2.gz MLWNWWSFNMOLCF-NQIIRXRSSA-N 1 1 329.532 3.743 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2CC(=O)c2ccccc2)c1 ZINC000180460770 1038181621 /nfs/dbraw/zinc/18/16/21/1038181621.db2.gz YOKODRWSWYNGSW-QGZVFWFLSA-N 1 1 325.408 3.638 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c1O ZINC000323758669 1038921030 /nfs/dbraw/zinc/92/10/30/1038921030.db2.gz UWNKHEVQMRLVAJ-LRDDRELGSA-N 1 1 339.863 3.764 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)c1O ZINC000323758669 1038921041 /nfs/dbraw/zinc/92/10/41/1038921041.db2.gz UWNKHEVQMRLVAJ-LRDDRELGSA-N 1 1 339.863 3.764 20 10 EHCDMO CCOC(=O)c1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001142602739 1039716642 /nfs/dbraw/zinc/71/66/42/1039716642.db2.gz APIKUVMDUKKISP-UHFFFAOYSA-N 1 1 326.440 3.561 20 10 EHCDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cccc(OC)c1O ZINC000188582415 1040008901 /nfs/dbraw/zinc/00/89/01/1040008901.db2.gz ZVVNLTXTSULSOK-FQEVSTJZSA-N 1 1 329.440 3.564 20 10 EHCDMO CC(=O)NC1CCC([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000278875628 1042802792 /nfs/dbraw/zinc/80/27/92/1042802792.db2.gz XLICLIGDKKEINQ-GCVQQVDUSA-N 1 1 345.270 3.797 20 10 EHCDMO CCOc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)c1 ZINC000278887897 1042841891 /nfs/dbraw/zinc/84/18/91/1042841891.db2.gz PBFKTUDBMZEZLV-LBPRGKRZSA-N 1 1 346.383 3.559 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000278949231 1043076629 /nfs/dbraw/zinc/07/66/29/1043076629.db2.gz ZGEWCNWERQJSLL-AWEZNQCLSA-N 1 1 348.786 3.740 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000278965327 1043097269 /nfs/dbraw/zinc/09/72/69/1043097269.db2.gz MWPFLANELYDNOX-QWRGUYRKSA-N 1 1 340.254 3.809 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c(O)c1OC ZINC000893652532 1043684289 /nfs/dbraw/zinc/68/42/89/1043684289.db2.gz VAYYADKFQYBJMJ-LBPRGKRZSA-N 1 1 349.377 3.677 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1ccc(F)cc1O ZINC000279506948 1044149878 /nfs/dbraw/zinc/14/98/78/1044149878.db2.gz NEFNIJBUOOKICR-ABKXIKBNSA-N 1 1 327.758 3.708 20 10 EHCDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(CCc3ccccc3)C2)c1 ZINC000185337334 1126868430 /nfs/dbraw/zinc/86/84/30/1126868430.db2.gz QIZNJOYUBUFALP-ICSRJNTNSA-N 1 1 338.495 3.916 20 10 EHCDMO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cc1OC ZINC000185390776 1126883652 /nfs/dbraw/zinc/88/36/52/1126883652.db2.gz WWYDZKXJUNKZDN-QWHCGFSZSA-N 1 1 333.403 3.830 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(Cl)c1 ZINC000072953287 1126949250 /nfs/dbraw/zinc/94/92/50/1126949250.db2.gz QUDWUQXUDORAKJ-UHFFFAOYSA-N 1 1 330.859 3.809 20 10 EHCDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000072953286 1126949380 /nfs/dbraw/zinc/94/93/80/1126949380.db2.gz GYFSJMCHPIIRPD-UHFFFAOYSA-N 1 1 330.859 3.809 20 10 EHCDMO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000764811463 1127537305 /nfs/dbraw/zinc/53/73/05/1127537305.db2.gz ZNULRHSFFDCQOH-UZLBHIALSA-N 1 1 334.467 3.926 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1c1ccccc1)[C@H](O)CO2 ZINC000762468932 1121314029 /nfs/dbraw/zinc/31/40/29/1121314029.db2.gz XUCCYGLFTPTCEY-PKOBYXMFSA-N 1 1 325.408 3.545 20 10 EHCDMO CN(C)C(=O)C[N@@H+](C)Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000916568212 1122203772 /nfs/dbraw/zinc/20/37/72/1122203772.db2.gz TZRRAXBDHSVMRS-UHFFFAOYSA-N 1 1 334.504 3.507 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCO[C@H]3CCCC[C@H]3C)CC2)cc1 ZINC000917088188 1122485334 /nfs/dbraw/zinc/48/53/34/1122485334.db2.gz RORKHKDQUNTYLY-NQIIRXRSSA-N 1 1 346.515 3.803 20 10 EHCDMO CCOc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1O ZINC000154309407 1122552024 /nfs/dbraw/zinc/55/20/24/1122552024.db2.gz GRKKUFDFHVCUCW-UHFFFAOYSA-N 1 1 342.395 3.864 20 10 EHCDMO Oc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000179562934 1123797240 /nfs/dbraw/zinc/79/72/40/1123797240.db2.gz AHDAMKKUSZPZNY-QGZVFWFLSA-N 1 1 348.240 3.728 20 10 EHCDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000179764106 1123851234 /nfs/dbraw/zinc/85/12/34/1123851234.db2.gz LXXUIHIBHHIZQY-OXJNMPFZSA-N 1 1 340.467 3.872 20 10 EHCDMO CCC[N@@H+](CC(=O)N(C(C)C)C1CCCC1)Cc1ccccc1O ZINC000727830652 1130597418 /nfs/dbraw/zinc/59/74/18/1130597418.db2.gz FRPOHYYIIYTNKN-UHFFFAOYSA-N 1 1 332.488 3.784 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2CCc3cc(OC)c(OC)cc3C2)cc1 ZINC000741752609 1131644138 /nfs/dbraw/zinc/64/41/38/1131644138.db2.gz CEKPXHWMUKWBRK-UHFFFAOYSA-N 1 1 340.467 3.718 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)C[C@@H](c2ccc(F)cc2)O1 ZINC000742160490 1131694992 /nfs/dbraw/zinc/69/49/92/1131694992.db2.gz CYPDTHZVSLYZJW-SZNDQCEHSA-N 1 1 341.426 3.982 20 10 EHCDMO CCO[C@@H](C)c1noc(C[N@H+](C)Cc2c(O)ccc3ccccc32)n1 ZINC000743369792 1131904853 /nfs/dbraw/zinc/90/48/53/1131904853.db2.gz AWNNDHFZTGPPOB-ZDUSSCGKSA-N 1 1 341.411 3.658 20 10 EHCDMO CCO[C@@H](C)c1noc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)n1 ZINC000743369792 1131904858 /nfs/dbraw/zinc/90/48/58/1131904858.db2.gz AWNNDHFZTGPPOB-ZDUSSCGKSA-N 1 1 341.411 3.658 20 10 EHCDMO C[C@H]1C[C@H](N(C)C(=O)C2=CC(=O)CS2)CC[N@H+]1Cc1ccccc1 ZINC000743477185 1131930218 /nfs/dbraw/zinc/93/02/18/1131930218.db2.gz GRDXCXPBCNFCFR-GOEBONIOSA-N 1 1 344.480 3.579 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H]1CCN(c2ccccc2F)C1=O ZINC000743869845 1131996350 /nfs/dbraw/zinc/99/63/50/1131996350.db2.gz CEKKJTILARXYMO-SFHVURJKSA-N 1 1 342.414 3.549 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1C[C@H](C)N(C(=O)OC(C)(C)C)C1 ZINC001168872188 1132593596 /nfs/dbraw/zinc/59/35/96/1132593596.db2.gz LJNSFYSMQSQRED-GOEBONIOSA-N 1 1 334.460 3.612 20 10 EHCDMO CCOc1ccc(C[N@@H+](CC)Cc2ccc3c(c2)OCO3)c(O)c1 ZINC000768196315 1133112819 /nfs/dbraw/zinc/11/28/19/1133112819.db2.gz BTCDRXKPPNSDBG-UHFFFAOYSA-N 1 1 329.396 3.542 20 10 EHCDMO Cc1ccc2ncc(C[N@H+](Cc3ccc(N(C)C)cc3)C3CC3)n2c1 ZINC000768258778 1133118433 /nfs/dbraw/zinc/11/84/33/1133118433.db2.gz XABSZQAIQOOXBH-UHFFFAOYSA-N 1 1 334.467 3.873 20 10 EHCDMO CO[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1Cl ZINC001177999192 1133123165 /nfs/dbraw/zinc/12/31/65/1133123165.db2.gz ACVRRDXKBWCKFS-OAHLLOKOSA-N 1 1 327.758 3.801 20 10 EHCDMO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768439269 1133139276 /nfs/dbraw/zinc/13/92/76/1133139276.db2.gz JHYGFARUWCCFDA-XOBRGWDASA-N 1 1 339.435 3.619 20 10 EHCDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768448703 1133140086 /nfs/dbraw/zinc/14/00/86/1133140086.db2.gz WOPQYXXGQHTCTE-KRWDZBQOSA-N 1 1 327.424 3.919 20 10 EHCDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000768463002 1133144576 /nfs/dbraw/zinc/14/45/76/1133144576.db2.gz DLKDRJASGMSDQS-LJQANCHMSA-N 1 1 325.456 3.650 20 10 EHCDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2c(O)cccc2OC)c1 ZINC000768935461 1133205615 /nfs/dbraw/zinc/20/56/15/1133205615.db2.gz ANYJTUUGPIXOIR-INIZCTEOSA-N 1 1 327.424 3.617 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3ccnn3C)C2)cc1 ZINC000768940101 1133207089 /nfs/dbraw/zinc/20/70/89/1133207089.db2.gz GYKINPXUMUHURP-SFHVURJKSA-N 1 1 326.488 3.646 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c(O)c1 ZINC000769020529 1133214886 /nfs/dbraw/zinc/21/48/86/1133214886.db2.gz DPJDPZMSJDDLQM-FQEVSTJZSA-N 1 1 327.424 3.537 20 10 EHCDMO CCOc1ccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)c(O)c1 ZINC000769108035 1133227402 /nfs/dbraw/zinc/22/74/02/1133227402.db2.gz XFFFAPGMGODFRG-MGPUTAFESA-N 1 1 327.424 3.753 20 10 EHCDMO CCOc1cccc(CN2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000769149212 1133234975 /nfs/dbraw/zinc/23/49/75/1133234975.db2.gz YYUZDEZTAPJPTL-SFHVURJKSA-N 1 1 346.515 3.735 20 10 EHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769351954 1133269064 /nfs/dbraw/zinc/26/90/64/1133269064.db2.gz OBAOWBCBNCRQQX-MRXNPFEDSA-N 1 1 340.442 3.782 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)[C@@H]1CCCN(c2ccccc2)C1 ZINC000769451726 1133293788 /nfs/dbraw/zinc/29/37/88/1133293788.db2.gz MKAQCEGVXIWDOJ-QGZVFWFLSA-N 1 1 326.440 3.502 20 10 EHCDMO CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297867 /nfs/dbraw/zinc/29/78/67/1133297867.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 1 1 329.532 3.982 20 10 EHCDMO CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297870 /nfs/dbraw/zinc/29/78/70/1133297870.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 1 1 329.532 3.982 20 10 EHCDMO CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297873 /nfs/dbraw/zinc/29/78/73/1133297873.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 1 1 329.532 3.982 20 10 EHCDMO CCN1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297877 /nfs/dbraw/zinc/29/78/77/1133297877.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 1 1 329.532 3.982 20 10 EHCDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297880 /nfs/dbraw/zinc/29/78/80/1133297880.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 1 1 329.532 3.982 20 10 EHCDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 ZINC000769497786 1133301596 /nfs/dbraw/zinc/30/15/96/1133301596.db2.gz AVTWJWQDSJGLLO-MRXNPFEDSA-N 1 1 330.859 3.752 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000769504606 1133304337 /nfs/dbraw/zinc/30/43/37/1133304337.db2.gz WBTIWIHSDWGKJG-SFHVURJKSA-N 1 1 326.440 3.867 20 10 EHCDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1c(O)cccc1OC)CCC2 ZINC000769514813 1133307083 /nfs/dbraw/zinc/30/70/83/1133307083.db2.gz OPVOLVVBFHYUGT-AWEZNQCLSA-N 1 1 332.469 3.929 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001180048361 1133315647 /nfs/dbraw/zinc/31/56/47/1133315647.db2.gz UBXDVVNAOSZIIM-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001180048361 1133315649 /nfs/dbraw/zinc/31/56/49/1133315649.db2.gz UBXDVVNAOSZIIM-HXUWFJFHSA-N 1 1 328.431 3.774 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](C)Cc2ccc(Cl)cc2O)c1C ZINC001180086773 1133328369 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CN(C)c1ccc(/C=C/C[N@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC001180557330 1133391008 /nfs/dbraw/zinc/39/10/08/1133391008.db2.gz BYMHXYDPXXFFCV-KXOMFBTKSA-N 1 1 349.522 3.972 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC001180557330 1133391012 /nfs/dbraw/zinc/39/10/12/1133391012.db2.gz BYMHXYDPXXFFCV-KXOMFBTKSA-N 1 1 349.522 3.972 20 10 EHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c1 ZINC000770382671 1133416999 /nfs/dbraw/zinc/41/69/99/1133416999.db2.gz UWHAJLOWYWIUGM-ZBFHGGJFSA-N 1 1 334.460 3.578 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](CCCO)Cc2cccc(Cl)c2)c1 ZINC000770353328 1133420488 /nfs/dbraw/zinc/42/04/88/1133420488.db2.gz ZUITUIFRCHXILS-UHFFFAOYSA-N 1 1 349.858 3.829 20 10 EHCDMO C[C@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000771844328 1133598452 /nfs/dbraw/zinc/59/84/52/1133598452.db2.gz SKCKBEYICGGVOI-HNNXBMFYSA-N 1 1 345.437 3.567 20 10 EHCDMO Cc1cc(C(=O)OCCn2cc[nH+]c2C)c(C)n1-c1ccc(F)cc1 ZINC000771858706 1133608255 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COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000787333848 1133990797 /nfs/dbraw/zinc/99/07/97/1133990797.db2.gz YJEFXSBVMOWWEL-OAHLLOKOSA-N 1 1 349.814 3.594 20 10 EHCDMO CCOC(=O)[C@H](C)[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000787442015 1134004717 /nfs/dbraw/zinc/00/47/17/1134004717.db2.gz RXYCDAQDLZKGPH-INIZCTEOSA-N 1 1 330.472 3.593 20 10 EHCDMO CCOC(=O)[C@H](C)[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000787442015 1134004724 /nfs/dbraw/zinc/00/47/24/1134004724.db2.gz RXYCDAQDLZKGPH-INIZCTEOSA-N 1 1 330.472 3.593 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000774818032 1134030261 /nfs/dbraw/zinc/03/02/61/1134030261.db2.gz BKLMEFBFQFQKOZ-INIZCTEOSA-N 1 1 342.395 3.818 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000774818032 1134030266 /nfs/dbraw/zinc/03/02/66/1134030266.db2.gz BKLMEFBFQFQKOZ-INIZCTEOSA-N 1 1 342.395 3.818 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2ccco2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000774834115 1134035862 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SZIQNZJGRPDSLQ-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)o1 ZINC000788603503 1134150166 /nfs/dbraw/zinc/15/01/66/1134150166.db2.gz QUXAATCERNSFNR-GXFFZTMASA-N 1 1 329.318 3.697 20 10 EHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3cc(OC)c(C)cc3O)CCO2)cc1 ZINC000790462723 1134417827 /nfs/dbraw/zinc/41/78/27/1134417827.db2.gz ZFQBDMALKFZMOB-NRFANRHFSA-N 1 1 341.451 3.845 20 10 EHCDMO CC[C@H](C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000790788455 1134465243 /nfs/dbraw/zinc/46/52/43/1134465243.db2.gz XRXCSTYSUZQQSM-XJKSGUPXSA-N 1 1 338.879 3.562 20 10 EHCDMO OCC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCc2ccccc21 ZINC000792167080 1134662331 /nfs/dbraw/zinc/66/23/31/1134662331.db2.gz YZWYJBWHWDUZLO-MRXNPFEDSA-N 1 1 335.806 3.667 20 10 EHCDMO OCC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCc2ccccc21 ZINC000792167080 1134662334 /nfs/dbraw/zinc/66/23/34/1134662334.db2.gz YZWYJBWHWDUZLO-MRXNPFEDSA-N 1 1 335.806 3.667 20 10 EHCDMO CN(C)c1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001190827882 1134756061 /nfs/dbraw/zinc/75/60/61/1134756061.db2.gz QHGPMIJZFGMHTH-FQEVSTJZSA-N 1 1 329.532 3.841 20 10 EHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2C(F)(F)F)CCN1C ZINC000792829685 1134797647 /nfs/dbraw/zinc/79/76/47/1134797647.db2.gz RAQLGFODZQMNKP-XJKSGUPXSA-N 1 1 343.437 3.686 20 10 EHCDMO C[C@H]1C[C@H](N(C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC[N@@H+]1C ZINC000792829685 1134797651 /nfs/dbraw/zinc/79/76/51/1134797651.db2.gz RAQLGFODZQMNKP-XJKSGUPXSA-N 1 1 343.437 3.686 20 10 EHCDMO C[C@H]1C[C@H](N(C)Cc2ccc(N(C)C)cc2C(F)(F)F)CC[N@H+]1C ZINC000792829685 1134797655 /nfs/dbraw/zinc/79/76/55/1134797655.db2.gz RAQLGFODZQMNKP-XJKSGUPXSA-N 1 1 343.437 3.686 20 10 EHCDMO CC(C)[N@@H+](C)CCCNCc1ccc(N(C)C)cc1C(F)(F)F ZINC000792899903 1134816605 /nfs/dbraw/zinc/81/66/05/1134816605.db2.gz OFXLNCJTMCHXJL-UHFFFAOYSA-N 1 1 331.426 3.591 20 10 EHCDMO CO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000793073582 1134846834 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Cc1cc(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)ccc1N(C)C ZINC001170508292 1135446251 /nfs/dbraw/zinc/44/62/51/1135446251.db2.gz SWTFBIHQHXYCEC-LJQANCHMSA-N 1 1 332.875 3.880 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1O ZINC000775713558 1135558545 /nfs/dbraw/zinc/55/85/45/1135558545.db2.gz JPSPGBZYHMATQY-QGZVFWFLSA-N 1 1 327.399 3.935 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735224 1135590651 /nfs/dbraw/zinc/59/06/51/1135590651.db2.gz NZURKSNTGMFTOJ-XMSQKQJNSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735224 1135590657 /nfs/dbraw/zinc/59/06/57/1135590657.db2.gz NZURKSNTGMFTOJ-XMSQKQJNSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@H]1c1ccccc1 ZINC000775735224 1135590660 /nfs/dbraw/zinc/59/06/60/1135590660.db2.gz NZURKSNTGMFTOJ-XMSQKQJNSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]([NH2+]Cc1nnc(-c2cccc(F)c2)o1)c1ccc(N(C)C)cc1 ZINC000775835198 1135794570 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/nfs/dbraw/zinc/11/48/34/1140114834.db2.gz PREGGCSQUBZEKX-UHFFFAOYSA-N 1 1 327.211 3.735 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1ccc(F)cc1O ZINC000185111787 1140136370 /nfs/dbraw/zinc/13/63/70/1140136370.db2.gz UNYCBBHWTWRKNM-CQSZACIVSA-N 1 1 342.414 3.899 20 10 EHCDMO CCCCNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185176778 1140138918 /nfs/dbraw/zinc/13/89/18/1140138918.db2.gz GNADSRLECUUVGJ-AWEZNQCLSA-N 1 1 344.430 3.912 20 10 EHCDMO CC[N@@H+](Cc1nccs1)Cc1cc(Br)ccc1O ZINC000269677416 1141134446 /nfs/dbraw/zinc/13/44/46/1141134446.db2.gz CUBBGHYKFQEQJM-UHFFFAOYSA-N 1 1 327.247 3.633 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1F ZINC000271224771 1141327538 /nfs/dbraw/zinc/32/75/38/1141327538.db2.gz ACKRIICHIPLTGF-CRAIPNDOSA-N 1 1 332.419 3.573 20 10 EHCDMO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)[nH]1 ZINC000271599160 1141404643 /nfs/dbraw/zinc/40/46/43/1141404643.db2.gz ZLHABCWOHBAKLH-LSDHHAIUSA-N 1 1 327.476 3.769 20 10 EHCDMO Cc1cc(O)c(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc1C ZINC000160180515 1014202899 /nfs/dbraw/zinc/20/28/99/1014202899.db2.gz HUJJXUCHFBYSEW-IBGZPJMESA-N 1 1 341.451 3.896 20 10 EHCDMO CC(=O)c1cc(F)cc(C[NH2+]C2(c3nc(C)cs3)CCC2)c1O ZINC000275033886 1015799651 /nfs/dbraw/zinc/79/96/51/1015799651.db2.gz ATGIDQQXLSLSKK-UHFFFAOYSA-N 1 1 334.416 3.668 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000183113474 1032134253 /nfs/dbraw/zinc/13/42/53/1032134253.db2.gz RZCZXOVMNVNULR-OAQYLSRUSA-N 1 1 339.435 3.584 20 10 EHCDMO CC1CCN(c2ccc(CN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000166545699 1016650090 /nfs/dbraw/zinc/65/00/90/1016650090.db2.gz HRBWYJKZMZFNAM-TZIWHRDSSA-N 1 1 327.516 3.639 20 10 EHCDMO CC1CCN(c2ccc(CN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000166545699 1016650095 /nfs/dbraw/zinc/65/00/95/1016650095.db2.gz HRBWYJKZMZFNAM-TZIWHRDSSA-N 1 1 327.516 3.639 20 10 EHCDMO OCc1ccc(F)c(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000528380440 1032191848 /nfs/dbraw/zinc/19/18/48/1032191848.db2.gz JVQXNIFSVVISTR-UHFFFAOYSA-N 1 1 329.415 3.968 20 10 EHCDMO C[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@H]1CC[C@H](O)CC1 ZINC000275876511 1019268204 /nfs/dbraw/zinc/26/82/04/1019268204.db2.gz APRHTXQBLLFBJM-WGSAOQKQSA-N 1 1 341.451 3.707 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2nccn2CC)c1 ZINC000280748502 1020612473 /nfs/dbraw/zinc/61/24/73/1020612473.db2.gz BJKDXYLTMHLJCB-KRWDZBQOSA-N 1 1 329.444 3.735 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@H]2c2nccn2CC)c1 ZINC000280748502 1020612475 /nfs/dbraw/zinc/61/24/75/1020612475.db2.gz BJKDXYLTMHLJCB-KRWDZBQOSA-N 1 1 329.444 3.735 20 10 EHCDMO CCOc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)o1 ZINC000891466968 1021708332 /nfs/dbraw/zinc/70/83/32/1021708332.db2.gz AARLFZLHTQXWBH-MRXNPFEDSA-N 1 1 331.412 3.565 20 10 EHCDMO COc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)c(O)c1OC ZINC000891494275 1021755763 /nfs/dbraw/zinc/75/57/63/1021755763.db2.gz BVJAUKCHKIBIQQ-UHFFFAOYSA-N 1 1 343.379 3.798 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000894501880 1022429891 /nfs/dbraw/zinc/42/98/91/1022429891.db2.gz IWCVBTAUFVYDBQ-QMMMGPOBSA-N 1 1 332.347 3.727 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000894777464 1022890345 /nfs/dbraw/zinc/89/03/45/1022890345.db2.gz PKAYWEYZCLQHDX-UHFFFAOYSA-N 1 1 335.398 3.559 20 10 EHCDMO Cc1[nH+]c2ccc(NCCc3cc(O)c(O)cc3O)cc2n1C(C)C ZINC001168006458 1024415816 /nfs/dbraw/zinc/41/58/16/1024415816.db2.gz WSLSKLWASGLLGX-UHFFFAOYSA-N 1 1 341.411 3.697 20 10 EHCDMO C[C@@H]([NH2+]CC1([S@](C)=O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000281145907 1024673285 /nfs/dbraw/zinc/67/32/85/1024673285.db2.gz UWSMPKKDAJJGLR-YBYGRFCBSA-N 1 1 336.284 3.651 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(SC)cc2)ccc1[N+](=O)[O-] ZINC000281173294 1024702149 /nfs/dbraw/zinc/70/21/49/1024702149.db2.gz GZPWVDHMIGFAQW-LLVKDONJSA-N 1 1 348.424 3.882 20 10 EHCDMO CC[C@H](C)N(C)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435607188 1025032005 /nfs/dbraw/zinc/03/20/05/1025032005.db2.gz LHFNCANBWAMZEC-INIZCTEOSA-N 1 1 341.499 3.665 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1 ZINC000273355825 1027393237 /nfs/dbraw/zinc/39/32/37/1027393237.db2.gz CRHNFDHJFNSOGS-MNOVXSKESA-N 1 1 335.350 3.869 20 10 EHCDMO C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000273478291 1027449170 /nfs/dbraw/zinc/44/91/70/1027449170.db2.gz TYOAVWPPIRXOET-LBPRGKRZSA-N 1 1 341.293 3.537 20 10 EHCDMO C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Br)ccc1[O-] ZINC000273478289 1027449708 /nfs/dbraw/zinc/44/97/08/1027449708.db2.gz TYOAVWPPIRXOET-GFCCVEGCSA-N 1 1 341.293 3.537 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000273511676 1027467947 /nfs/dbraw/zinc/46/79/47/1027467947.db2.gz RVJNOYFPYNAVKS-GOEBONIOSA-N 1 1 347.455 3.711 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1nnc2n1CCCCC2 ZINC000273617294 1027521248 /nfs/dbraw/zinc/52/12/48/1027521248.db2.gz XSNRKVRQXNJJNX-SWLSCSKDSA-N 1 1 332.423 3.651 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2ccsc2)ccc1[N+](=O)[O-] ZINC000278212214 1029676213 /nfs/dbraw/zinc/67/62/13/1029676213.db2.gz KGNQASREABHUAL-CYBMUJFWSA-N 1 1 334.397 3.708 20 10 EHCDMO COc1c(O)c(C[NH2+]C(C)(C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000278302559 1030062509 /nfs/dbraw/zinc/06/25/09/1030062509.db2.gz DAXHZXQRVONZKO-UHFFFAOYSA-N 1 1 330.384 3.642 20 10 EHCDMO CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc[nH+]c3C)c2C)cc1 ZINC000760179420 1031880204 /nfs/dbraw/zinc/88/02/04/1031880204.db2.gz OUDUWMQXFMHMRB-UHFFFAOYSA-N 1 1 337.423 3.881 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000180724078 1031903444 /nfs/dbraw/zinc/90/34/44/1031903444.db2.gz VKZUDOVWSMKTGT-XLIONFOSSA-N 1 1 345.414 3.628 20 10 EHCDMO Cc1noc([C@H]2CCC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)n1 ZINC000060126761 1034240523 /nfs/dbraw/zinc/24/05/23/1034240523.db2.gz POGDYCAMJVDDLY-HNNXBMFYSA-N 1 1 329.444 3.895 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(F)cc2F)c1O ZINC000761191404 1034384056 /nfs/dbraw/zinc/38/40/56/1034384056.db2.gz SOMHWLOCYMBRRN-UHFFFAOYSA-N 1 1 327.758 3.964 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(F)cc2F)c1O ZINC000761191404 1034384065 /nfs/dbraw/zinc/38/40/65/1034384065.db2.gz SOMHWLOCYMBRRN-UHFFFAOYSA-N 1 1 327.758 3.964 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000529665829 1034390814 /nfs/dbraw/zinc/39/08/14/1034390814.db2.gz NYTADPBZBZYJKS-UHFFFAOYSA-N 1 1 331.419 3.771 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1O ZINC000761202078 1034413303 /nfs/dbraw/zinc/41/33/03/1034413303.db2.gz KNIGIWDTDZWXJP-INIZCTEOSA-N 1 1 339.863 3.978 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+]2CCO[C@@](C)(c3ccccc3)C2)c1O ZINC000761200398 1034419320 /nfs/dbraw/zinc/41/93/20/1034419320.db2.gz SABBQAYNBGPCFI-LJQANCHMSA-N 1 1 347.842 3.802 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCO[C@@](C)(c3ccccc3)C2)c1O ZINC000761200398 1034419322 /nfs/dbraw/zinc/41/93/22/1034419322.db2.gz SABBQAYNBGPCFI-LJQANCHMSA-N 1 1 347.842 3.802 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cncc(Br)c1 ZINC000172188811 1034854702 /nfs/dbraw/zinc/85/47/02/1034854702.db2.gz ADFOJCBVKPJBCC-UHFFFAOYSA-N 1 1 348.288 3.932 20 10 EHCDMO CCN(C[C@@H]1CC[N@@H+](Cc2cc(C)cc(C)c2O)C1)CC(F)(F)F ZINC000164449481 1035612483 /nfs/dbraw/zinc/61/24/83/1035612483.db2.gz XVBDUSXCXLRINY-HNNXBMFYSA-N 1 1 344.421 3.715 20 10 EHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(I)cc1O ZINC001232979135 1035637396 /nfs/dbraw/zinc/63/73/96/1035637396.db2.gz SKTGMPFCSLYLRH-WDEREUQCSA-N 1 1 345.224 3.617 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(I)cc2O)[C@H]1C ZINC001232979124 1035638713 /nfs/dbraw/zinc/63/87/13/1035638713.db2.gz SKTGMPFCSLYLRH-MNOVXSKESA-N 1 1 345.224 3.617 20 10 EHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)s1 ZINC000165188226 1036310499 /nfs/dbraw/zinc/31/04/99/1036310499.db2.gz VVTVDAPSMLGZKK-UHFFFAOYSA-N 1 1 334.485 3.835 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(=O)oc2cc(O)ccc12 ZINC000157065610 1036460025 /nfs/dbraw/zinc/46/00/25/1036460025.db2.gz KPFAKOXFNAZPJW-UHFFFAOYSA-N 1 1 339.391 3.616 20 10 EHCDMO CN(Cc1ccc(N2CCCC2)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168393136 1036584532 /nfs/dbraw/zinc/58/45/32/1036584532.db2.gz XARMATVENTUYRS-UHFFFAOYSA-N 1 1 327.516 3.593 20 10 EHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)C1CCN(CC2CC2)CC1 ZINC001168393136 1036584547 /nfs/dbraw/zinc/58/45/47/1036584547.db2.gz XARMATVENTUYRS-UHFFFAOYSA-N 1 1 327.516 3.593 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)C1CCN(CC2CC2)CC1 ZINC001168393136 1036584562 /nfs/dbraw/zinc/58/45/62/1036584562.db2.gz XARMATVENTUYRS-UHFFFAOYSA-N 1 1 327.516 3.593 20 10 EHCDMO CCN(C)C(=O)CC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179644940 1037876125 /nfs/dbraw/zinc/87/61/25/1037876125.db2.gz BZRGVXMSRXJUCI-KRWDZBQOSA-N 1 1 340.467 3.824 20 10 EHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000363854546 1038689270 /nfs/dbraw/zinc/68/92/70/1038689270.db2.gz MDVNIRIVFTZXAP-SRVKXCTJSA-N 1 1 329.271 3.976 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000192657892 1040872519 /nfs/dbraw/zinc/87/25/19/1040872519.db2.gz NPXQGWNRBWELKJ-WDEREUQCSA-N 1 1 329.271 3.834 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCCn3ccnc3C)c2c1 ZINC000162830469 1042589735 /nfs/dbraw/zinc/58/97/35/1042589735.db2.gz OPVXMMKFPTUNCX-UHFFFAOYSA-N 1 1 339.439 3.581 20 10 EHCDMO CN(C)c1ccccc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000072629249 1126813084 /nfs/dbraw/zinc/81/30/84/1126813084.db2.gz PBXCDYBQQVBPIH-IBGZPJMESA-N 1 1 340.467 3.639 20 10 EHCDMO C[C@@H]([NH2+]CCc1nc(-c2ccccn2)cs1)c1ccc(F)cc1O ZINC000186061604 1127247020 /nfs/dbraw/zinc/24/70/20/1127247020.db2.gz VBWMNXPCCVFPCW-GFCCVEGCSA-N 1 1 343.427 3.943 20 10 EHCDMO Cn1cc(C[N@@H+](Cc2c(O)ccc3ccccc32)C2CCCC2)nn1 ZINC000761681750 1120791464 /nfs/dbraw/zinc/79/14/64/1120791464.db2.gz WGEUPZMZAPONSJ-UHFFFAOYSA-N 1 1 336.439 3.619 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cn(-c3ccccc3)nn2)cc1 ZINC000154107310 1122236997 /nfs/dbraw/zinc/23/69/97/1122236997.db2.gz UELVVVMCVCXZQP-QGZVFWFLSA-N 1 1 349.482 3.964 20 10 EHCDMO CN(C)c1ccc(C[N@H+](Cc2nc(-c3ccccc3)no2)C2CC2)cc1 ZINC000917074237 1122470331 /nfs/dbraw/zinc/47/03/31/1122470331.db2.gz VHMGGQODQILAQU-UHFFFAOYSA-N 1 1 348.450 3.967 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2nc(-c3ccccc3)no2)C2CC2)cc1 ZINC000917074237 1122470335 /nfs/dbraw/zinc/47/03/35/1122470335.db2.gz VHMGGQODQILAQU-UHFFFAOYSA-N 1 1 348.450 3.967 20 10 EHCDMO CC(C)(C)c1cccc(C[N@H+]2CCc3cc(CO)ccc3C2)c1O ZINC001143104354 1129062965 /nfs/dbraw/zinc/06/29/65/1129062965.db2.gz SCIRRYFGULFPTL-UHFFFAOYSA-N 1 1 325.452 3.740 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000920257400 1123344790 /nfs/dbraw/zinc/34/47/90/1123344790.db2.gz SWYNUNRFCJUNRG-IBGZPJMESA-N 1 1 338.451 3.861 20 10 EHCDMO CCN(C)C(=O)CC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179644954 1123811828 /nfs/dbraw/zinc/81/18/28/1123811828.db2.gz BZRGVXMSRXJUCI-QGZVFWFLSA-N 1 1 340.467 3.824 20 10 EHCDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cccc(Br)c1[O-] ZINC000179707544 1123828764 /nfs/dbraw/zinc/82/87/64/1123828764.db2.gz HXAOKFBDFUBTBX-HNNXBMFYSA-N 1 1 335.245 3.830 20 10 EHCDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cccc(Br)c1O ZINC000179707544 1123828780 /nfs/dbraw/zinc/82/87/80/1123828780.db2.gz HXAOKFBDFUBTBX-HNNXBMFYSA-N 1 1 335.245 3.830 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2Cc2ccccc2OC)c1 ZINC000179906013 1123894594 /nfs/dbraw/zinc/89/45/94/1123894594.db2.gz HSMDSLJBIJBPSF-KRWDZBQOSA-N 1 1 327.424 3.617 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@@H+](Cc2ccccc2)CC(C)(C)O)c1O ZINC000180200864 1123960733 /nfs/dbraw/zinc/96/07/33/1123960733.db2.gz ZTWWWKMJZCQOFP-UHFFFAOYSA-N 1 1 345.414 3.507 20 10 EHCDMO COc1cc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)c(O)cc1C ZINC000182660879 1125351630 /nfs/dbraw/zinc/35/16/30/1125351630.db2.gz KHGAVMWUMMOHDV-UHFFFAOYSA-N 1 1 325.330 3.759 20 10 EHCDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000766029753 1129836510 /nfs/dbraw/zinc/83/65/10/1129836510.db2.gz LRPPEGDLHWVFTP-INIZCTEOSA-N 1 1 345.483 3.825 20 10 EHCDMO C[C@@H]1C[C@H](C)CN(C(=O)C[N@@H+](Cc2ccccc2O)C2CCCC2)C1 ZINC000732204917 1130899688 /nfs/dbraw/zinc/89/96/88/1130899688.db2.gz GHZKRPVOEVGNJN-CALCHBBNSA-N 1 1 344.499 3.641 20 10 EHCDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000736592866 1131427461 /nfs/dbraw/zinc/42/74/61/1131427461.db2.gz DNPKNUXMVJBUKB-JSGCOSHPSA-N 1 1 329.371 3.638 20 10 EHCDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(Cl)c1 ZINC000742198060 1131696907 /nfs/dbraw/zinc/69/69/07/1131696907.db2.gz DXNKWUXQRDUJKL-AWEZNQCLSA-N 1 1 345.874 3.524 20 10 EHCDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(Cl)c1 ZINC000742198060 1131696911 /nfs/dbraw/zinc/69/69/11/1131696911.db2.gz DXNKWUXQRDUJKL-AWEZNQCLSA-N 1 1 345.874 3.524 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](COCc3ccccc3)C1)CCC2 ZINC000742177547 1131697402 /nfs/dbraw/zinc/69/74/02/1131697402.db2.gz WASHAYUDCKTXMW-GOSISDBHSA-N 1 1 337.463 3.920 20 10 EHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2)CCN1Cc1ccccc1 ZINC000379657803 1132242067 /nfs/dbraw/zinc/24/20/67/1132242067.db2.gz UMRBKAGKMSZGNO-WIYYLYMNSA-N 1 1 337.511 3.895 20 10 EHCDMO Cc1noc(C)c1CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000798182060 1133092427 /nfs/dbraw/zinc/09/24/27/1133092427.db2.gz DPPHZVAXMXTCDL-SECBINFHSA-N 1 1 328.334 3.909 20 10 EHCDMO CC[N@@H+](Cc1ccc(OCCOC)cc1)Cc1ccc(N(C)C)cc1 ZINC000768131902 1133099759 /nfs/dbraw/zinc/09/97/59/1133099759.db2.gz AYTKVWDTRFJHSZ-UHFFFAOYSA-N 1 1 342.483 3.800 20 10 EHCDMO CCc1nn(C)c(CC)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768257523 1133118117 /nfs/dbraw/zinc/11/81/17/1133118117.db2.gz KNHXHKCLMBUFIK-UHFFFAOYSA-N 1 1 340.515 3.776 20 10 EHCDMO CN(Cc1c(O)cccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768243064 1133120276 /nfs/dbraw/zinc/12/02/76/1133120276.db2.gz GUCXGGWMWMBPBX-MRXNPFEDSA-N 1 1 330.859 3.752 20 10 EHCDMO Cn1c[nH+]c2cc(NCc3ccc(OC[C@H]4CCCO4)cc3)ccc21 ZINC001178037694 1133130996 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/nfs/dbraw/zinc/87/42/69/1135874269.db2.gz AXIPDOPCRWEMTD-QFIPXVFZSA-N 1 1 336.479 3.799 20 10 EHCDMO CC(C)[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)N1CCCCCC1 ZINC001199162708 1135884851 /nfs/dbraw/zinc/88/48/51/1135884851.db2.gz YAEDGAWPZWCDIG-FQEVSTJZSA-N 1 1 335.511 3.882 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](N(C)c3ccc(C)cc3)C2)c1O ZINC000809755767 1135887013 /nfs/dbraw/zinc/88/70/13/1135887013.db2.gz KPDFJMVFCHYHEH-LJQANCHMSA-N 1 1 340.467 3.810 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2cccc(C(F)(F)F)n2)cc1 ZINC001203930508 1135891684 /nfs/dbraw/zinc/89/16/84/1135891684.db2.gz WOBIQEDGPZLCRF-UHFFFAOYSA-N 1 1 337.389 3.841 20 10 EHCDMO COc1ccc(Br)cc1CNc1ccc2c(c1)[nH+]cn2C ZINC001201114798 1135984735 /nfs/dbraw/zinc/98/47/35/1135984735.db2.gz LZTQMIPLJJLNRA-UHFFFAOYSA-N 1 1 346.228 3.957 20 10 EHCDMO CC[C@@H](C)C[N@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001201504492 1136029621 /nfs/dbraw/zinc/02/96/21/1136029621.db2.gz WCMWZOXRSNYXBC-NQIIRXRSSA-N 1 1 346.515 3.660 20 10 EHCDMO CC[C@H](C)C[N@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001201504493 1136029815 /nfs/dbraw/zinc/02/98/15/1136029815.db2.gz WCMWZOXRSNYXBC-RXVVDRJESA-N 1 1 346.515 3.660 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1O ZINC000811781463 1136134635 /nfs/dbraw/zinc/13/46/35/1136134635.db2.gz BLHQCRZTFRNSEZ-NRFANRHFSA-N 1 1 339.435 3.679 20 10 EHCDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000107323650 1136165583 /nfs/dbraw/zinc/16/55/83/1136165583.db2.gz URBGALBFTSRZPB-INIZCTEOSA-N 1 1 328.431 3.855 20 10 EHCDMO COC[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1CCOCC1 ZINC000850492412 1136271156 /nfs/dbraw/zinc/27/11/56/1136271156.db2.gz BETIMSULYVODSH-ZUZCIYMTSA-N 1 1 348.270 3.791 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)c1nccn1C ZINC000850572911 1136289600 /nfs/dbraw/zinc/28/96/00/1136289600.db2.gz QOCZXMHEDBLHID-HUUCEWRRSA-N 1 1 330.451 3.961 20 10 EHCDMO Cc1cc(C[N@H+]2CCC[C@@H](OCC(F)(F)F)C2)ccc1N(C)C ZINC000815050778 1136539676 /nfs/dbraw/zinc/53/96/76/1136539676.db2.gz HNSDWLQWASBCNL-OAHLLOKOSA-N 1 1 330.394 3.604 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](CC(F)(F)F)C2)cc1C(C)C ZINC000853611717 1136549769 /nfs/dbraw/zinc/54/97/69/1136549769.db2.gz UHIVYXGZOMFVFU-CQSZACIVSA-N 1 1 331.378 3.977 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](CC(F)(F)F)C2)cc1C(C)C ZINC000853611717 1136549771 /nfs/dbraw/zinc/54/97/71/1136549771.db2.gz UHIVYXGZOMFVFU-CQSZACIVSA-N 1 1 331.378 3.977 20 10 EHCDMO C[C@@H]([NH2+]CCN1CCCC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815559861 1136610749 /nfs/dbraw/zinc/61/07/49/1136610749.db2.gz RPOBBEXVISLMEU-QWHCGFSZSA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CSCCS1)c1cccc(C(F)(F)F)c1O ZINC000815587741 1136615558 /nfs/dbraw/zinc/61/55/58/1136615558.db2.gz SDFXSFKUSUDSEW-ZJUUUORDSA-N 1 1 337.432 3.910 20 10 EHCDMO C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O ZINC000815593555 1136616040 /nfs/dbraw/zinc/61/60/40/1136616040.db2.gz PXJQIYDONMFSMZ-ZUZCIYMTSA-N 1 1 343.320 3.934 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000815632048 1136621807 /nfs/dbraw/zinc/62/18/07/1136621807.db2.gz BOXKUSQUEPPAIS-SRCQZFHVSA-N 1 1 343.398 3.915 20 10 EHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCO[C@H](C2CC2)C1)CCCC3 ZINC000776767433 1136656308 /nfs/dbraw/zinc/65/63/08/1136656308.db2.gz HPGZJTMWLKOMCT-IBGZPJMESA-N 1 1 327.424 3.628 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816491356 1136724099 /nfs/dbraw/zinc/72/40/99/1136724099.db2.gz JHNGFBQYPYATFV-UHFFFAOYSA-N 1 1 337.778 3.603 20 10 EHCDMO COC(=O)c1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816491356 1136724105 /nfs/dbraw/zinc/72/41/05/1136724105.db2.gz JHNGFBQYPYATFV-UHFFFAOYSA-N 1 1 337.778 3.603 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000816499235 1136727855 /nfs/dbraw/zinc/72/78/55/1136727855.db2.gz JMRCDHCOGNOMCB-CQSZACIVSA-N 1 1 326.843 3.635 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC(C2CCOCC2)CC1 ZINC000816516055 1136730287 /nfs/dbraw/zinc/73/02/87/1136730287.db2.gz TXASWHBVDJPAIZ-UHFFFAOYSA-N 1 1 327.827 3.823 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1ccc(F)c(F)c1F ZINC000816567627 1136737933 /nfs/dbraw/zinc/73/79/33/1136737933.db2.gz HTNMWNBHLGFLHX-UHFFFAOYSA-N 1 1 333.712 3.934 20 10 EHCDMO Oc1ccc(Br)cc1C[N@@H+]1CCOC[C@@H]1CC1CCC1 ZINC000816667550 1136747093 /nfs/dbraw/zinc/74/70/93/1136747093.db2.gz POQZTBCOFHQOEF-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCOC[C@@H]1CC1CCC1 ZINC000816667550 1136747096 /nfs/dbraw/zinc/74/70/96/1136747096.db2.gz POQZTBCOFHQOEF-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO CN(C)c1ccc([C@@H](N)C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000817938914 1136847445 /nfs/dbraw/zinc/84/74/45/1136847445.db2.gz VJYBFJWAEVOYQV-ZWKOTPCHSA-N 1 1 345.487 3.718 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@H]2CCc3c2cccc3Cl)cc1 ZINC000817939132 1136847680 /nfs/dbraw/zinc/84/76/80/1136847680.db2.gz ZJJZFUMHENEDBA-MOPGFXCFSA-N 1 1 329.875 3.683 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817938728 1136847922 /nfs/dbraw/zinc/84/79/22/1136847922.db2.gz QZILMPSVNLKVNX-OALUTQOASA-N 1 1 329.875 3.683 20 10 EHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000817940676 1136848501 /nfs/dbraw/zinc/84/85/01/1136848501.db2.gz GOOGTQZDUQOXMF-SGTLLEGYSA-N 1 1 335.854 3.896 20 10 EHCDMO Cc1ccc2c(c1)[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)CCCO2 ZINC000817940707 1136848628 /nfs/dbraw/zinc/84/86/28/1136848628.db2.gz HACAFBGSTLPGJW-UXHICEINSA-N 1 1 339.483 3.564 20 10 EHCDMO C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964396 1136852233 /nfs/dbraw/zinc/85/22/33/1136852233.db2.gz BEWQNWDTYHUBHN-OXJNMPFZSA-N 1 1 333.495 3.856 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Br)ccc1[O-] ZINC000817976816 1136854267 /nfs/dbraw/zinc/85/42/67/1136854267.db2.gz UYMUZNPYXPPWTH-SMDDNHRTSA-N 1 1 329.282 3.713 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Br)ccc1[O-] ZINC000817976814 1136854378 /nfs/dbraw/zinc/85/43/78/1136854378.db2.gz UYMUZNPYXPPWTH-FZMZJTMJSA-N 1 1 329.282 3.713 20 10 EHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2nn(CC)nc2C)cc1 ZINC000818221506 1136867553 /nfs/dbraw/zinc/86/75/53/1136867553.db2.gz NLJRSFPZXLOEAR-UHFFFAOYSA-N 1 1 329.492 3.523 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000818358294 1136875875 /nfs/dbraw/zinc/87/58/75/1136875875.db2.gz SXOQBPUUFOLNGH-RYUDHWBXSA-N 1 1 334.441 3.664 20 10 EHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2c3ccccc3CN(C)C2=O)cc1 ZINC000857874399 1136916999 /nfs/dbraw/zinc/91/69/99/1136916999.db2.gz MAUHVKGAUVZRIQ-FOIQADDNSA-N 1 1 337.467 3.507 20 10 EHCDMO CCCOc1ncccc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858109598 1136940829 /nfs/dbraw/zinc/94/08/29/1136940829.db2.gz UNHJHXPDAHIPIC-UHFFFAOYSA-N 1 1 335.398 3.504 20 10 EHCDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858117599 1136941511 /nfs/dbraw/zinc/94/15/11/1136941511.db2.gz UDNSLYNSRSLVDE-QGZVFWFLSA-N 1 1 332.394 3.953 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1ccc(N2CCOCC2)cc1 ZINC000858355948 1136960933 /nfs/dbraw/zinc/96/09/33/1136960933.db2.gz SNJZQFZKQVSVFR-RHSMWYFYSA-N 1 1 343.496 3.708 20 10 EHCDMO C[C@H]([NH2+][C@H]1CO[C@H](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000858548250 1136977760 /nfs/dbraw/zinc/97/77/60/1136977760.db2.gz RTUZCCYNKJYYGB-FLBPPNCPSA-N 1 1 344.224 3.512 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000805767487 1137029062 /nfs/dbraw/zinc/02/90/62/1137029062.db2.gz WRVSJXQCZOTYCI-PKOBYXMFSA-N 1 1 342.508 3.753 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)c2ccc(F)cc2)cc1 ZINC000822166021 1137051271 /nfs/dbraw/zinc/05/12/71/1137051271.db2.gz DWDSKFVOHOPJOI-HXUWFJFHSA-N 1 1 330.447 3.837 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822529950 1137062548 /nfs/dbraw/zinc/06/25/48/1137062548.db2.gz LNSWPSOJPZKSDR-KRWDZBQOSA-N 1 1 339.838 3.966 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822529950 1137062549 /nfs/dbraw/zinc/06/25/49/1137062549.db2.gz LNSWPSOJPZKSDR-KRWDZBQOSA-N 1 1 339.838 3.966 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)cc1 ZINC000824608664 1137144916 /nfs/dbraw/zinc/14/49/16/1137144916.db2.gz LRJPEDCHGQLKDW-SFHVURJKSA-N 1 1 345.531 3.646 20 10 EHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)cc1Cl ZINC000824877067 1137157091 /nfs/dbraw/zinc/15/70/91/1137157091.db2.gz IVASOZFTIZGXOR-JOCHJYFZSA-N 1 1 337.872 3.723 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c1 ZINC000824893709 1137157270 /nfs/dbraw/zinc/15/72/70/1137157270.db2.gz YRYQCNMZOULUPI-MSOLQXFVSA-N 1 1 331.456 3.572 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2CNc3ccccc3C2)c1 ZINC000844908127 1137264223 /nfs/dbraw/zinc/26/42/23/1137264223.db2.gz RDJDHXGWGOIRQW-AWEZNQCLSA-N 1 1 347.256 3.590 20 10 EHCDMO COc1cccc([C@@H]2CCCC[N@H+]2Cc2c(O)cc(O)cc2O)c1 ZINC001144508838 1137303483 /nfs/dbraw/zinc/30/34/83/1137303483.db2.gz AAWLODOVVOHHCZ-KRWDZBQOSA-N 1 1 329.396 3.539 20 10 EHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H](O)C(F)(F)F ZINC000121860106 1137387350 /nfs/dbraw/zinc/38/73/50/1137387350.db2.gz RCTUMABQTHHLJP-DYVFJYSZSA-N 1 1 339.357 3.879 20 10 EHCDMO CC1(C)C(=O)Nc2cc(NCc3cc4ccccc4cc3O)[nH+]cc21 ZINC001171402252 1137472259 /nfs/dbraw/zinc/47/22/59/1137472259.db2.gz KAPSAAGMLHIPMN-UHFFFAOYSA-N 1 1 333.391 3.782 20 10 EHCDMO COc1ccc(C[NH2+]Cc2ncc(Br)s2)cc1C ZINC000714930836 1137474307 /nfs/dbraw/zinc/47/43/07/1137474307.db2.gz QQUVQCWFWOXTCQ-UHFFFAOYSA-N 1 1 327.247 3.512 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](C[C@@H]3CCOC3)C1)CCCC2 ZINC000773263070 1137482175 /nfs/dbraw/zinc/48/21/75/1137482175.db2.gz PJVDFPYPKGOOQD-SJORKVTESA-N 1 1 329.484 3.910 20 10 EHCDMO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](C)Cc1ccc(N3CCCC3)cc1)C2 ZINC001172121488 1137539071 /nfs/dbraw/zinc/53/90/71/1137539071.db2.gz JWHDGKSDFBYRPD-WKCHPHFGSA-N 1 1 327.516 3.734 20 10 EHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)c1C ZINC000872632518 1137582081 /nfs/dbraw/zinc/58/20/81/1137582081.db2.gz WKJTZEMBLRWMQQ-UHFFFAOYSA-N 1 1 345.487 3.861 20 10 EHCDMO O=c1c(C[N@H+](Cc2ccccc2O)C2CCCC2)cccn1C(F)F ZINC000876722537 1137659680 /nfs/dbraw/zinc/65/96/80/1137659680.db2.gz XQOXWUNSJLRLBY-UHFFFAOYSA-N 1 1 348.393 3.894 20 10 EHCDMO Cc1cccc(O)c1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000877031796 1137668149 /nfs/dbraw/zinc/66/81/49/1137668149.db2.gz BKEZVIVOPRLUJN-IHWFROFDSA-N 1 1 336.479 3.986 20 10 EHCDMO C[C@]12CC[N@@H+](Cc3ccc(Br)cc3O)C[C@H]1C2(F)F ZINC000825955384 1137674295 /nfs/dbraw/zinc/67/42/95/1137674295.db2.gz LZIABYWTKMWIHU-OLZOCXBDSA-N 1 1 332.188 3.632 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](CCC[C@@H]2CCO2)Cc2ccco2)cc1 ZINC000877523029 1137679639 /nfs/dbraw/zinc/67/96/39/1137679639.db2.gz VGBYZQRSGJJJHP-LJQANCHMSA-N 1 1 328.456 3.917 20 10 EHCDMO CSC1CC[NH+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000877663167 1137684689 /nfs/dbraw/zinc/68/46/89/1137684689.db2.gz JCVDJWPDZNPDCO-UHFFFAOYSA-N 1 1 330.291 3.791 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC2(CO1)CCOCC2 ZINC000877977901 1137698183 /nfs/dbraw/zinc/69/81/83/1137698183.db2.gz XSAKGNZKVBLPSC-HXUWFJFHSA-N 1 1 346.515 3.549 20 10 EHCDMO COC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC=CC[C@@H]4C3)cc2)CC1 ZINC000879530102 1137749964 /nfs/dbraw/zinc/74/99/64/1137749964.db2.gz MEADCSUHSNUTBJ-KDURUIRLSA-N 1 1 326.484 3.700 20 10 EHCDMO CC[C@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1CCCOC1 ZINC000880465644 1137779428 /nfs/dbraw/zinc/77/94/28/1137779428.db2.gz GVQFDZCMESKHNV-WBMJQRKESA-N 1 1 325.836 3.543 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H](O)c1ccccc1C(F)(F)F ZINC000882926506 1137838884 /nfs/dbraw/zinc/83/88/84/1137838884.db2.gz WNVQLJNRZKKDDX-CQSZACIVSA-N 1 1 347.283 3.512 20 10 EHCDMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000109769901 1137897351 /nfs/dbraw/zinc/89/73/51/1137897351.db2.gz YGLMOJAFVKFCED-CYBMUJFWSA-N 1 1 332.831 3.813 20 10 EHCDMO CC(C)C(=O)Nc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886494946 1138083336 /nfs/dbraw/zinc/08/33/36/1138083336.db2.gz ALQXAYWTDDAOFL-ZDUSSCGKSA-N 1 1 330.403 3.977 20 10 EHCDMO COc1cc2c(cc1C[NH2+][C@H](C)c1c(O)cccc1F)O[C@H](C)C2 ZINC000886500320 1138084392 /nfs/dbraw/zinc/08/43/92/1138084392.db2.gz PEAZLYJQPUURRW-VXGBXAGGSA-N 1 1 331.387 3.714 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOC2=O)cc1)c1c(O)cccc1F ZINC000886512537 1138087210 /nfs/dbraw/zinc/08/72/10/1138087210.db2.gz INWAGZAIJTYFKY-QWHCGFSZSA-N 1 1 344.386 3.900 20 10 EHCDMO CC[C@@H]([NH2+]CC(F)(F)CNC(=O)OC(C)(C)C)c1ccccc1O ZINC000301907942 1138669483 /nfs/dbraw/zinc/66/94/83/1138669483.db2.gz QANPJEWLYIYAQB-CYBMUJFWSA-N 1 1 344.402 3.593 20 10 EHCDMO CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000185671099 1140162363 /nfs/dbraw/zinc/16/23/63/1140162363.db2.gz WJNBCQTXNNTETG-DOTOQJQBSA-N 1 1 330.472 3.553 20 10 EHCDMO CCOc1cccc(C[N@@H+](Cc2ccc(O)c(OC)c2)C2CC2)c1O ZINC000191511338 1140469302 /nfs/dbraw/zinc/46/93/02/1140469302.db2.gz QTXSHEMCCKEFJS-UHFFFAOYSA-N 1 1 343.423 3.670 20 10 EHCDMO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)[nH]1 ZINC000271599158 1141404380 /nfs/dbraw/zinc/40/43/80/1141404380.db2.gz ZLHABCWOHBAKLH-HUUCEWRRSA-N 1 1 327.476 3.769 20 10 EHCDMO COc1ccccc1[C@H](C[NH2+]Cc1cccc(F)c1O)OC(C)C ZINC000274525992 1014188682 /nfs/dbraw/zinc/18/86/82/1014188682.db2.gz ZXUUXLQTFWXSOD-SFHVURJKSA-N 1 1 333.403 3.796 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)cc1OC ZINC000160205316 1014356220 /nfs/dbraw/zinc/35/62/20/1014356220.db2.gz LMPXHXLTHAKSHM-GDBMZVCRSA-N 1 1 327.424 3.787 20 10 EHCDMO COc1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)cc1C ZINC000274769822 1015053730 /nfs/dbraw/zinc/05/37/30/1015053730.db2.gz IHRZONPQHHLPJL-HXUWFJFHSA-N 1 1 339.414 3.755 20 10 EHCDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3cccs3)cc2F)CC1 ZINC000155267897 1016383883 /nfs/dbraw/zinc/38/38/83/1016383883.db2.gz MHHDQKAYWFFQDH-OAHLLOKOSA-N 1 1 347.503 3.880 20 10 EHCDMO Cc1nnc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)s1 ZINC000892743624 1017291830 /nfs/dbraw/zinc/29/18/30/1017291830.db2.gz PDCJFCZMUDHGMN-UHFFFAOYSA-N 1 1 330.501 3.905 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cc1OC ZINC000160377690 1018650940 /nfs/dbraw/zinc/65/09/40/1018650940.db2.gz GHEYMNXCALYCMZ-YOEHRIQHSA-N 1 1 327.424 3.787 20 10 EHCDMO Cc1cc(Br)cc(C[NH2+]Cc2ncc(Cl)s2)c1O ZINC000877807345 1019195018 /nfs/dbraw/zinc/19/50/18/1019195018.db2.gz PFKNWAQPMLQDKS-UHFFFAOYSA-N 1 1 347.665 3.863 20 10 EHCDMO CC[N@@H+](Cc1ccc(F)cn1)Cc1cc(Br)ccc1O ZINC000276218238 1020939636 /nfs/dbraw/zinc/93/96/36/1020939636.db2.gz LULIKXKKBWBYLG-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](C)CNC(=O)OC(C)(C)C)c1ccc(F)cc1O ZINC000796835331 1021195267 /nfs/dbraw/zinc/19/52/67/1021195267.db2.gz AITHTRMNMJZJKJ-WFASDCNBSA-N 1 1 340.439 3.733 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2[O-])C[C@@H]1C ZINC000894902757 1022059765 /nfs/dbraw/zinc/05/97/65/1022059765.db2.gz LAGDUQLKZCKWPI-TVQRCGJNSA-N 1 1 348.668 3.665 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@@H]1Cc1ccc(F)cc1)OCO2 ZINC000729471527 1023197082 /nfs/dbraw/zinc/19/70/82/1023197082.db2.gz CZTVGENMBJEKMX-QGZVFWFLSA-N 1 1 343.398 3.857 20 10 EHCDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891914818 1023392729 /nfs/dbraw/zinc/39/27/29/1023392729.db2.gz BVXODLPNIMHOAS-INIZCTEOSA-N 1 1 343.423 3.755 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3OC)C2)c1 ZINC000093593664 1023493472 /nfs/dbraw/zinc/49/34/72/1023493472.db2.gz CVJFZRGLTFFFKA-HNNXBMFYSA-N 1 1 327.424 3.789 20 10 EHCDMO Oc1ccccc1C[N@@H+](C1CCCC1)[C@@H]1CCC2(C[C@@H]1F)OCCO2 ZINC000892011947 1024330297 /nfs/dbraw/zinc/33/02/97/1024330297.db2.gz IONOIEMSWSOIJX-ZWKOTPCHSA-N 1 1 349.446 3.771 20 10 EHCDMO CCc1cc(C[N@H+]2CC[C@H](COCCOC)C2)c(O)c(C(C)(C)C)c1 ZINC000173391023 1033274698 /nfs/dbraw/zinc/27/46/98/1033274698.db2.gz ZELYEQBHFWDOQD-KRWDZBQOSA-N 1 1 349.515 3.737 20 10 EHCDMO Cc1ccc(C[N@H+]2Cc3ccccc3OC3(CCOCC3)C2)c(O)c1 ZINC000896440858 1025450406 /nfs/dbraw/zinc/45/04/06/1025450406.db2.gz BQSOMEQYAKDINY-UHFFFAOYSA-N 1 1 339.435 3.644 20 10 EHCDMO Nc1ccc(C[NH+]2CCN(c3ccc(F)c(Cl)c3F)CC2)cc1 ZINC001204763606 1026011000 /nfs/dbraw/zinc/01/10/00/1026011000.db2.gz MXZBVKAUYZZSHE-UHFFFAOYSA-N 1 1 337.801 3.523 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nnc3n2CCCCC3)cc1 ZINC000326817916 1026074300 /nfs/dbraw/zinc/07/43/00/1026074300.db2.gz WZBCPWFVAAHVCT-MRXNPFEDSA-N 1 1 341.503 3.702 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2OC)c1 ZINC000273430203 1027421913 /nfs/dbraw/zinc/42/19/13/1027421913.db2.gz VIGWRBKODPIFCY-CHWSQXEVSA-N 1 1 329.396 3.599 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000840938383 1027837280 /nfs/dbraw/zinc/83/72/80/1027837280.db2.gz OHLQPNHQDKILQR-UHFFFAOYSA-N 1 1 331.460 3.654 20 10 EHCDMO c1cncc(O[C@@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000093690674 1029338044 /nfs/dbraw/zinc/33/80/44/1029338044.db2.gz GBCUNQXNKYVMST-OAQYLSRUSA-N 1 1 337.467 3.725 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C(=O)NCC3CC3)C2)cc1C(C)C ZINC000054521137 1029789260 /nfs/dbraw/zinc/78/92/60/1029789260.db2.gz SLSHMQPTZKOGSU-KRWDZBQOSA-N 1 1 344.499 3.562 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCCC[C@@H]1c1ccncc1)OCO2 ZINC000157032292 1030214343 /nfs/dbraw/zinc/21/43/43/1030214343.db2.gz VTIXFGDFRBXOBW-MRXNPFEDSA-N 1 1 326.396 3.633 20 10 EHCDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000160123333 1030547076 /nfs/dbraw/zinc/54/70/76/1030547076.db2.gz NCLAFXIFUXZHDE-MRXNPFEDSA-N 1 1 343.423 3.755 20 10 EHCDMO CCCNc1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)cc1 ZINC000278393844 1030565418 /nfs/dbraw/zinc/56/54/18/1030565418.db2.gz DYXBGRHBGRWIRM-AWEZNQCLSA-N 1 1 342.439 3.852 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)cc1OC ZINC000160179432 1030580445 /nfs/dbraw/zinc/58/04/45/1030580445.db2.gz FGAFOUHVNJAFRT-AWEZNQCLSA-N 1 1 348.468 3.684 20 10 EHCDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000093863749 1030683243 /nfs/dbraw/zinc/68/32/43/1030683243.db2.gz TZFQRXKWVDJQTG-FQEVSTJZSA-N 1 1 338.499 3.920 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCCc3sccc32)ccc1[N+](=O)[O-] ZINC000278492230 1031096670 /nfs/dbraw/zinc/09/66/70/1031096670.db2.gz LPESJQJMKHWHSO-LBPRGKRZSA-N 1 1 334.397 3.538 20 10 EHCDMO C[C@H](NCc1cc(N(C)C)cc[nH+]1)c1cc2c(cc1O)CCCC2 ZINC000903198253 1031280306 /nfs/dbraw/zinc/28/03/06/1031280306.db2.gz HXHQBVVADFTHSQ-AWEZNQCLSA-N 1 1 325.456 3.583 20 10 EHCDMO [O-]c1c(Cl)cccc1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000898218711 1033376386 /nfs/dbraw/zinc/37/63/86/1033376386.db2.gz NFNVLSALQSFDAE-UHFFFAOYSA-N 1 1 344.886 3.842 20 10 EHCDMO C[C@@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1ccc(F)cc1O ZINC000310051185 1034204154 /nfs/dbraw/zinc/20/41/54/1034204154.db2.gz GUJFWMDZLIYJKO-GFCCVEGCSA-N 1 1 338.423 3.581 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1OC ZINC000179439646 1034305402 /nfs/dbraw/zinc/30/54/02/1034305402.db2.gz VOCJTOORPKNBTB-INIZCTEOSA-N 1 1 331.387 3.886 20 10 EHCDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000376044487 1035177149 /nfs/dbraw/zinc/17/71/49/1035177149.db2.gz SYKLEXPYVOCSAU-IBGZPJMESA-N 1 1 338.499 3.790 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c1O ZINC000164413108 1035603312 /nfs/dbraw/zinc/60/33/12/1035603312.db2.gz QSUUBJUBKHUROX-SFHVURJKSA-N 1 1 341.451 3.748 20 10 EHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cn3cccc(C)c3n2)cc1F ZINC000152285721 1036311128 /nfs/dbraw/zinc/31/11/28/1036311128.db2.gz GFJXKBIVEWRDPW-UHFFFAOYSA-N 1 1 340.446 3.918 20 10 EHCDMO C[C@H](C(=O)Nc1ccc(F)cc1Cl)[N@@H+](C)Cc1ccccc1O ZINC000109773320 1036971921 /nfs/dbraw/zinc/97/19/21/1036971921.db2.gz CTNDTEWXHPNEEM-LLVKDONJSA-N 1 1 336.794 3.644 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c1O ZINC000182784606 1038636827 /nfs/dbraw/zinc/63/68/27/1038636827.db2.gz SMYLJPKLOLKOHC-QGZVFWFLSA-N 1 1 331.387 3.502 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccccc1-n1cccn1)c1ccc(F)cc1O ZINC000367625341 1038756431 /nfs/dbraw/zinc/75/64/31/1038756431.db2.gz LGPUQFJTNKCQHP-QGZVFWFLSA-N 1 1 325.387 3.958 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@]3(CC(F)(F)C3(F)F)C1)CCC2 ZINC000905676788 1039037283 /nfs/dbraw/zinc/03/72/83/1039037283.db2.gz FTNSPNNYPUYQGL-OAHLLOKOSA-N 1 1 329.337 3.747 20 10 EHCDMO CCN1CCC([N@@H+](C)Cc2ccc(N3CCCCC3)c(C)c2)CC1 ZINC000827973655 1039189385 /nfs/dbraw/zinc/18/93/85/1039189385.db2.gz KZMFKXWFZYPLEV-UHFFFAOYSA-N 1 1 329.532 3.901 20 10 EHCDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893911204 1039818820 /nfs/dbraw/zinc/81/88/20/1039818820.db2.gz SCTARUGDDJDSJC-UHFFFAOYSA-N 1 1 346.377 3.521 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c(O)c1OC ZINC000893940633 1039854647 /nfs/dbraw/zinc/85/46/47/1039854647.db2.gz KRAAYOZPPZIYAO-GFCCVEGCSA-N 1 1 333.350 3.572 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccccc2OC)c1O ZINC000156041612 1039872342 /nfs/dbraw/zinc/87/23/42/1039872342.db2.gz SWQCYHYTMKDSAV-HNNXBMFYSA-N 1 1 329.440 3.863 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000894088640 1040064093 /nfs/dbraw/zinc/06/40/93/1040064093.db2.gz NCSYWJMPPHIIHG-DZGCQCFKSA-N 1 1 339.407 3.820 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000894088640 1040064108 /nfs/dbraw/zinc/06/41/08/1040064108.db2.gz NCSYWJMPPHIIHG-DZGCQCFKSA-N 1 1 339.407 3.820 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000894088640 1040064126 /nfs/dbraw/zinc/06/41/26/1040064126.db2.gz NCSYWJMPPHIIHG-DZGCQCFKSA-N 1 1 339.407 3.820 20 10 EHCDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000128500793 1040261354 /nfs/dbraw/zinc/26/13/54/1040261354.db2.gz SHLCKNGYDAHFGR-INIZCTEOSA-N 1 1 335.455 3.526 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccc(C(=O)NC3CC3)cc2)c1 ZINC000912859438 1040390765 /nfs/dbraw/zinc/39/07/65/1040390765.db2.gz SUJIDJXBYOKGGL-UHFFFAOYSA-N 1 1 338.451 3.533 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000248183253 1040714629 /nfs/dbraw/zinc/71/46/29/1040714629.db2.gz WWJSXRCRFGDMCE-UEXGIBASSA-N 1 1 347.547 3.540 20 10 EHCDMO COc1cc(Br)cc(C[N@@H+](C)[C@@H](C)CCSC)c1O ZINC000093558609 1042358644 /nfs/dbraw/zinc/35/86/44/1042358644.db2.gz VDQQOXNVJFGLOU-JTQLQIEISA-N 1 1 348.306 3.737 20 10 EHCDMO CNC(=O)C1CCC([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000278898703 1042875546 /nfs/dbraw/zinc/87/55/46/1042875546.db2.gz ZFZPQKXGEGLTBB-WHXUTIOJSA-N 1 1 345.270 3.654 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccc(OC)cc1 ZINC000278934537 1042994280 /nfs/dbraw/zinc/99/42/80/1042994280.db2.gz WSQWXMJQXXJYDZ-OAHLLOKOSA-N 1 1 346.383 3.559 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(-n2cncn2)cc1 ZINC000184884734 1126707066 /nfs/dbraw/zinc/70/70/66/1126707066.db2.gz GZXZMLDCBLERBZ-OLZOCXBDSA-N 1 1 326.375 3.524 20 10 EHCDMO C[C@H](NCCC[NH+]1CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764665055 1127520201 /nfs/dbraw/zinc/52/02/01/1127520201.db2.gz ATZSBNKETIBYCL-KRWDZBQOSA-N 1 1 333.495 3.953 20 10 EHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCN1CC(F)F ZINC000765713994 1127734066 /nfs/dbraw/zinc/73/40/66/1127734066.db2.gz DUPWXQXKZZPMFM-OAHLLOKOSA-N 1 1 334.410 3.707 20 10 EHCDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccc(N(C)C)cc2)CC1 ZINC000765720270 1127738218 /nfs/dbraw/zinc/73/82/18/1127738218.db2.gz RCJRZGCDJQWUAZ-MRXNPFEDSA-N 1 1 329.513 3.693 20 10 EHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(F)c(F)c1 ZINC000917013928 1122438899 /nfs/dbraw/zinc/43/88/99/1122438899.db2.gz IMSARERJTJRNIM-HXUWFJFHSA-N 1 1 348.437 3.975 20 10 EHCDMO CC[C@H]1CCCCN1C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074166 1122470492 /nfs/dbraw/zinc/47/04/92/1122470492.db2.gz RREDEMIRFSXMKL-SFHVURJKSA-N 1 1 343.515 3.508 20 10 EHCDMO C[C@@H]1CCC[C@@H](C)N1C(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917073993 1122470640 /nfs/dbraw/zinc/47/06/40/1122470640.db2.gz LSNAXGBXEKOLBV-IAGOWNOFSA-N 1 1 343.515 3.507 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCCOc3ccccc3)CC2)cc1 ZINC000917089722 1122487022 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/nfs/dbraw/zinc/59/22/50/1135592250.db2.gz SDXDVFAUCBFESM-PMACEKPBSA-N 1 1 347.572 3.544 20 10 EHCDMO CCCOc1ccc2c(c1)CC[N@H+](Cc1cc(OC)ccc1O)C2 ZINC000775737619 1135601815 /nfs/dbraw/zinc/60/18/15/1135601815.db2.gz VZPAPUBJDAKTJP-UHFFFAOYSA-N 1 1 327.424 3.748 20 10 EHCDMO COc1cc(C[N@@H+]2CC[C@@H](N3CCCC3)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191649 1135628067 /nfs/dbraw/zinc/62/80/67/1135628067.db2.gz OVOVJGHLORNFSJ-DNVCBOLYSA-N 1 1 346.515 3.757 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@@H](N3CCCC3)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191649 1135628068 /nfs/dbraw/zinc/62/80/68/1135628068.db2.gz OVOVJGHLORNFSJ-DNVCBOLYSA-N 1 1 346.515 3.757 20 10 EHCDMO C[C@H]([NH2+]Cc1nnc(-c2cccc(F)c2)o1)c1ccc(N(C)C)cc1 ZINC000775835200 1135794811 /nfs/dbraw/zinc/79/48/11/1135794811.db2.gz SHJGSCFTNDCCNS-ZDUSSCGKSA-N 1 1 340.402 3.793 20 10 EHCDMO C[N@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)C[C@@H]1CCOC1 ZINC000809589435 1135858625 /nfs/dbraw/zinc/85/86/25/1135858625.db2.gz GUFFJTCFLNMPJM-FQEVSTJZSA-N 1 1 336.479 3.718 20 10 EHCDMO c1ccc(CN2CCc3cc(C[N@H+]4CC[C@@]5(CCOC5)C4)ccc32)cc1 ZINC000809590420 1135858792 /nfs/dbraw/zinc/85/87/92/1135858792.db2.gz RGNNWWHLCACXMQ-HSZRJFAPSA-N 1 1 348.490 3.862 20 10 EHCDMO C[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@H]1CCCOC1 ZINC000809693332 1135867278 /nfs/dbraw/zinc/86/72/78/1135867278.db2.gz SVTBWBJUGWYBJP-SFHVURJKSA-N 1 1 327.424 3.582 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c1O ZINC000809700569 1135869351 /nfs/dbraw/zinc/86/93/51/1135869351.db2.gz JILCGCXASGFSQM-SWLSCSKDSA-N 1 1 327.852 3.570 20 10 EHCDMO CCN(CC)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000809705626 1135874781 /nfs/dbraw/zinc/87/47/81/1135874781.db2.gz YHTIDUQIBDMJDH-JWTNVVGKSA-N 1 1 333.495 3.729 20 10 EHCDMO CCOc1cccc(C[N@H+](CCN(C)C)Cc2cccc(C)c2)c1O ZINC000809741703 1135883370 /nfs/dbraw/zinc/88/33/70/1135883370.db2.gz SYNWWUTVPOLWKM-UHFFFAOYSA-N 1 1 342.483 3.663 20 10 EHCDMO CCOc1cccc(C[N@@H+](CCN(C)C)Cc2cccc(C)c2)c1O ZINC000809741703 1135883372 /nfs/dbraw/zinc/88/33/72/1135883372.db2.gz SYNWWUTVPOLWKM-UHFFFAOYSA-N 1 1 342.483 3.663 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CCC[C@@H](C3CC3)C2)c1O ZINC000809786544 1135890911 /nfs/dbraw/zinc/89/09/11/1135890911.db2.gz DYMIYJYISZLLQS-GFCCVEGCSA-N 1 1 340.261 3.785 20 10 EHCDMO Cc1nnc(CC[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)s1 ZINC000810243572 1135947339 /nfs/dbraw/zinc/94/73/39/1135947339.db2.gz QKMNCESZWXBPER-SSDOTTSWSA-N 1 1 332.256 3.752 20 10 EHCDMO CC[C@H]([NH2+]C[C@]1(CO)C[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000810246135 1135947654 /nfs/dbraw/zinc/94/76/54/1135947654.db2.gz LLDQLMJLFGABMG-HBFSDRIKSA-N 1 1 329.415 3.738 20 10 EHCDMO COc1cc(C[NH2+]C2CCN(C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850012401 1136199388 /nfs/dbraw/zinc/19/93/88/1136199388.db2.gz KFUYYASKSNQXBI-UHFFFAOYSA-N 1 1 334.504 3.661 20 10 EHCDMO COC[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CCOCC1 ZINC000850494681 1136271180 /nfs/dbraw/zinc/27/11/80/1136271180.db2.gz WDWUYRDJIXFDBR-XHDPSFHLSA-N 1 1 347.377 3.503 20 10 EHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccc(N2CCCCC2)c(F)c1 ZINC000850498820 1136271869 /nfs/dbraw/zinc/27/18/69/1136271869.db2.gz DLMKWXPFJNOMJH-JKIFEVAISA-N 1 1 343.450 3.764 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)COc1c(F)cccc1F)c1ccc(F)cc1O ZINC000850522796 1136276932 /nfs/dbraw/zinc/27/69/32/1136276932.db2.gz MFCRWMNMYDXISI-WDEREUQCSA-N 1 1 325.330 3.928 20 10 EHCDMO C[C@H]1C[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000850581085 1136292105 /nfs/dbraw/zinc/29/21/05/1136292105.db2.gz CXRUYMRDEOKKDH-GUYCJALGSA-N 1 1 332.463 3.791 20 10 EHCDMO C[C@H](C(=O)Nc1cc(Cl)ccc1F)[N@@H+](C)Cc1ccccc1O ZINC000109771447 1136339850 /nfs/dbraw/zinc/33/98/50/1136339850.db2.gz OFIGWGCGMSDTPQ-LLVKDONJSA-N 1 1 336.794 3.644 20 10 EHCDMO CO[C@@H](C[N@@H+](Cc1ccccc1O)C1CCCCC1)[C@@H]1CCOC1 ZINC000851769647 1136406487 /nfs/dbraw/zinc/40/64/87/1136406487.db2.gz KIPLFIZAFLRTMX-XLIONFOSSA-N 1 1 333.472 3.578 20 10 EHCDMO CCc1ccc([C@@H]2CC[N@@H+](Cc3cc(OC)c(OC)cc3O)C2)cc1 ZINC000814224690 1136425753 /nfs/dbraw/zinc/42/57/53/1136425753.db2.gz LQUZDRJFPWXTGO-QGZVFWFLSA-N 1 1 341.451 3.961 20 10 EHCDMO Cc1cc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)ccc1N(C)C ZINC000815011116 1136536707 /nfs/dbraw/zinc/53/67/07/1136536707.db2.gz ALFQPOINQVTPDY-UHFFFAOYSA-N 1 1 334.467 3.879 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCCC3)[C@@H]1c1ccco1)[C@H](O)CO2 ZINC000853538696 1136542036 /nfs/dbraw/zinc/54/20/36/1136542036.db2.gz JFGGTWAPCGCYHQ-APWZRJJASA-N 1 1 341.407 3.528 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccncc2)cc1OC ZINC000853632640 1136551008 /nfs/dbraw/zinc/55/10/08/1136551008.db2.gz IPQVPJXCIXDPPC-LJQANCHMSA-N 1 1 340.423 3.532 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2c2ccncc2)cc1OC ZINC000853632640 1136551010 /nfs/dbraw/zinc/55/10/10/1136551010.db2.gz IPQVPJXCIXDPPC-LJQANCHMSA-N 1 1 340.423 3.532 20 10 EHCDMO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H](C)c2ccccc2O)cc1 ZINC000854223288 1136599277 /nfs/dbraw/zinc/59/92/77/1136599277.db2.gz SCCYBTPNXHAKOG-XPGWFJOJSA-N 1 1 340.467 3.587 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000854248055 1136601062 /nfs/dbraw/zinc/60/10/62/1136601062.db2.gz MUHWVUFMBSSQSY-QGZVFWFLSA-N 1 1 347.503 3.577 20 10 EHCDMO C[C@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815554220 1136609675 /nfs/dbraw/zinc/60/96/75/1136609675.db2.gz VCDJSTSXDKOHSM-SMDDNHRTSA-N 1 1 342.361 3.958 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815580123 1136614033 /nfs/dbraw/zinc/61/40/33/1136614033.db2.gz CNTHTBLQDGQGBK-OCCSQVGLSA-N 1 1 339.357 3.665 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815580124 1136614208 /nfs/dbraw/zinc/61/42/08/1136614208.db2.gz CNTHTBLQDGQGBK-TZMCWYRMSA-N 1 1 339.357 3.665 20 10 EHCDMO C[C@H]([NH2+]CCNc1ccccn1)c1cccc(C(F)(F)F)c1O ZINC000815583031 1136614529 /nfs/dbraw/zinc/61/45/29/1136614529.db2.gz VIFCCRHOIQHMDJ-NSHDSACASA-N 1 1 325.334 3.569 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CSCCS1)c1cccc(C(F)(F)F)c1O ZINC000815587739 1136615609 /nfs/dbraw/zinc/61/56/09/1136615609.db2.gz SDFXSFKUSUDSEW-UWVGGRQHSA-N 1 1 337.432 3.910 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1cccc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000815593132 1136616061 /nfs/dbraw/zinc/61/60/61/1136616061.db2.gz CMKKXNMBFVBWKY-MEBBXXQBSA-N 1 1 343.320 3.934 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(N(C)C)n1)c1cccc(C(F)(F)F)c1O ZINC000815598401 1136616859 /nfs/dbraw/zinc/61/68/59/1136616859.db2.gz UHBHOMDSRACTGM-LLVKDONJSA-N 1 1 339.361 3.723 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000815648686 1136626187 /nfs/dbraw/zinc/62/61/87/1136626187.db2.gz UGOWHZCZIKCPJY-OWQGQXMQSA-N 1 1 325.408 3.633 20 10 EHCDMO Oc1cc(F)c(Cl)cc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000816483956 1136723742 /nfs/dbraw/zinc/72/37/42/1136723742.db2.gz LOQPJOCELVMMKF-UHFFFAOYSA-N 1 1 326.843 3.635 20 10 EHCDMO CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816496303 1136725073 /nfs/dbraw/zinc/72/50/73/1136725073.db2.gz DRRKMUYBFWXWKE-INIZCTEOSA-N 1 1 342.439 3.644 20 10 EHCDMO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816506915 1136728557 /nfs/dbraw/zinc/72/85/57/1136728557.db2.gz QCOAWHKJHFFXEQ-UHFFFAOYSA-N 1 1 333.387 3.848 20 10 EHCDMO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816506915 1136728560 /nfs/dbraw/zinc/72/85/60/1136728560.db2.gz QCOAWHKJHFFXEQ-UHFFFAOYSA-N 1 1 333.387 3.848 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000816531296 1136730860 /nfs/dbraw/zinc/73/08/60/1136730860.db2.gz MPUNEZRSMLWFBV-HNNXBMFYSA-N 1 1 330.186 3.661 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCN(Cc2ccccc2)C1 ZINC000816529368 1136734024 /nfs/dbraw/zinc/73/40/24/1136734024.db2.gz QGWGHLLLDFOGRR-HNNXBMFYSA-N 1 1 334.822 3.549 20 10 EHCDMO COc1cccc(O[C@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816554380 1136735933 /nfs/dbraw/zinc/73/59/33/1136735933.db2.gz XECXSHZGKRBXCN-LLVKDONJSA-N 1 1 339.794 3.750 20 10 EHCDMO CC(=O)N1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)c2ccccc21 ZINC000816559071 1136736673 /nfs/dbraw/zinc/73/66/73/1136736673.db2.gz WFJMNBRGKKYQBY-MRXNPFEDSA-N 1 1 348.805 3.772 20 10 EHCDMO CN(C)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1cccs1 ZINC000816561228 1136737048 /nfs/dbraw/zinc/73/70/48/1136737048.db2.gz PSCLNKBPHGUOBY-CYBMUJFWSA-N 1 1 328.840 3.639 20 10 EHCDMO Cc1ccnc(C2CC[NH+](Cc3cc(Cl)c(F)cc3O)CC2)n1 ZINC000816568718 1136738183 /nfs/dbraw/zinc/73/81/83/1136738183.db2.gz ONSXKUHNDKOAMI-UHFFFAOYSA-N 1 1 335.810 3.663 20 10 EHCDMO COCC[N@@H+](Cc1scnc1C)Cc1ccc2ccccc2c1O ZINC000816593752 1136739393 /nfs/dbraw/zinc/73/93/93/1136739393.db2.gz CSZZVCLHVUPKAJ-UHFFFAOYSA-N 1 1 342.464 3.959 20 10 EHCDMO CN(C)C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc(F)cc1 ZINC000816612665 1136741400 /nfs/dbraw/zinc/74/14/00/1136741400.db2.gz VRWPNFBQUXUWHE-INIZCTEOSA-N 1 1 340.801 3.716 20 10 EHCDMO C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1[O-] ZINC000817585179 1136825567 /nfs/dbraw/zinc/82/55/67/1136825567.db2.gz BZGBGLIQWATMOR-XGNXJENSSA-N 1 1 341.293 3.678 20 10 EHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(OC)c1 ZINC000817940340 1136848731 /nfs/dbraw/zinc/84/87/31/1136848731.db2.gz GBMQCRLKTKPFTK-WOJBJXKFSA-N 1 1 327.472 3.502 20 10 EHCDMO Cc1ccc2c(c1)OCCC[C@H]2NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940821 1136848770 /nfs/dbraw/zinc/84/87/70/1136848770.db2.gz HZDDJKNDNZZJFZ-VQTJNVASSA-N 1 1 339.483 3.564 20 10 EHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1nccc2ccccc21 ZINC000817942545 1136849377 /nfs/dbraw/zinc/84/93/77/1136849377.db2.gz PMRZCFNXMZKWSQ-MGPUTAFESA-N 1 1 334.467 3.651 20 10 EHCDMO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817948337 1136850418 /nfs/dbraw/zinc/85/04/18/1136850418.db2.gz XZAYDBWPZQTPQV-XYJFISCASA-N 1 1 333.495 3.855 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1[O-] ZINC000817979578 1136854965 /nfs/dbraw/zinc/85/49/65/1136854965.db2.gz LXVHWYZLVSILKN-DHSIGJKJSA-N 1 1 346.421 3.714 20 10 EHCDMO Cc1cc(C[NH2+]Cc2cnn(C)c2Cl)c(C)n1-c1ccccc1 ZINC000858294343 1136955698 /nfs/dbraw/zinc/95/56/98/1136955698.db2.gz FHMHWQSZNBRQSO-UHFFFAOYSA-N 1 1 328.847 3.771 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000858484723 1136972189 /nfs/dbraw/zinc/97/21/89/1136972189.db2.gz ZMYMNDNRVUOSBK-DJJJIMSYSA-N 1 1 340.423 3.766 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CO[C@@H](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000858548252 1136977952 /nfs/dbraw/zinc/97/79/52/1136977952.db2.gz RTUZCCYNKJYYGB-KPWYMIHSSA-N 1 1 344.224 3.512 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ncc(Br)cn1 ZINC000805749851 1136995794 /nfs/dbraw/zinc/99/57/94/1136995794.db2.gz AYNXDDDSSXTZCF-NWDGAFQWSA-N 1 1 349.276 3.717 20 10 EHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Br)on1 ZINC000862227696 1137133393 /nfs/dbraw/zinc/13/33/93/1137133393.db2.gz GJDZPUPIVIVTGY-CYBMUJFWSA-N 1 1 337.217 3.788 20 10 EHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2c(O)cccc2Br)on1 ZINC000862227696 1137133394 /nfs/dbraw/zinc/13/33/94/1137133394.db2.gz GJDZPUPIVIVTGY-CYBMUJFWSA-N 1 1 337.217 3.788 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000824468149 1137140463 /nfs/dbraw/zinc/14/04/63/1137140463.db2.gz CPVNCDPVTCAFJG-OAHLLOKOSA-N 1 1 346.358 3.615 20 10 EHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000824566074 1137143163 /nfs/dbraw/zinc/14/31/63/1137143163.db2.gz FBEXXWWDPINYJK-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000824566074 1137143164 /nfs/dbraw/zinc/14/31/64/1137143164.db2.gz FBEXXWWDPINYJK-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO COc1ccc([C@H](CO)[N@@H+](C)Cc2cc(Cl)c(C)cc2O)cc1 ZINC000824813994 1137153583 /nfs/dbraw/zinc/15/35/83/1137153583.db2.gz KXAZLZNOIVNAHK-KRWDZBQOSA-N 1 1 335.831 3.528 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@]2(CCOC2)O1 ZINC000794693383 1137234296 /nfs/dbraw/zinc/23/42/96/1137234296.db2.gz IQXDPVTYOMLWBQ-PXNSSMCTSA-N 1 1 333.472 3.594 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H](OC(C)C)C3)c2c1 ZINC000844719630 1137247759 /nfs/dbraw/zinc/24/77/59/1137247759.db2.gz KHGQRHPVOSXDJC-QGZVFWFLSA-N 1 1 329.440 3.943 20 10 EHCDMO CC[C@@]1(CO)CCC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000825567405 1137275777 /nfs/dbraw/zinc/27/57/77/1137275777.db2.gz IVJZEQSDIKKYPK-HXUWFJFHSA-N 1 1 335.488 3.683 20 10 EHCDMO C[C@@H](O)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1F ZINC000846015657 1137326099 /nfs/dbraw/zinc/32/60/99/1137326099.db2.gz ZDDAFBYDQAOXNI-JDNHERCYSA-N 1 1 327.758 3.536 20 10 EHCDMO C[C@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1ccc(Cl)cc1O ZINC000846180486 1137339760 /nfs/dbraw/zinc/33/97/60/1137339760.db2.gz KYPKATVIHCZPQT-DJJJIMSYSA-N 1 1 331.843 3.573 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)c1 ZINC000846184844 1137340061 /nfs/dbraw/zinc/34/00/61/1137340061.db2.gz OFQHZBNSZZNRPP-HNHYXYPQSA-N 1 1 329.799 3.534 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)[C@@H](O)C(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000866464526 1137356948 /nfs/dbraw/zinc/35/69/48/1137356948.db2.gz WGYXPUWXLRFTBJ-ZJXQECPTSA-N 1 1 332.149 3.661 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](C[C@@H]3CCOC3)C1)CCCC2 ZINC000773263065 1137482015 /nfs/dbraw/zinc/48/20/15/1137482015.db2.gz PJVDFPYPKGOOQD-IRXDYDNUSA-N 1 1 329.484 3.910 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000873234310 1137594696 /nfs/dbraw/zinc/59/46/96/1137594696.db2.gz BDAWOMYEQNYDJL-GOSISDBHSA-N 1 1 330.859 3.932 20 10 EHCDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876554205 1137655390 /nfs/dbraw/zinc/65/53/90/1137655390.db2.gz GGAWOSYEJTWGAL-INIZCTEOSA-N 1 1 342.458 3.980 20 10 EHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876697028 1137659376 /nfs/dbraw/zinc/65/93/76/1137659376.db2.gz OGUZCIIVQYUUSP-QGZVFWFLSA-N 1 1 336.479 3.767 20 10 EHCDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000877476610 1137677612 /nfs/dbraw/zinc/67/76/12/1137677612.db2.gz IYDVAZUJVMUEJX-UHFFFAOYSA-N 1 1 338.495 3.897 20 10 EHCDMO COc1cccc(C)c1C[NH2+]Cc1cccc(Br)c1O ZINC000877478422 1137677686 /nfs/dbraw/zinc/67/76/86/1137677686.db2.gz GCZQHGYATRORBW-UHFFFAOYSA-N 1 1 336.229 3.762 20 10 EHCDMO CCCC[N@@H+](Cc1cnc(CCOC)s1)Cc1ccccc1O ZINC000877503097 1137678929 /nfs/dbraw/zinc/67/89/29/1137678929.db2.gz AWLIIPJBDQTYAD-UHFFFAOYSA-N 1 1 334.485 3.840 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)c1O ZINC000877673207 1137685283 /nfs/dbraw/zinc/68/52/83/1137685283.db2.gz PKXKTPVVPMJSBF-IRXDYDNUSA-N 1 1 347.842 3.752 20 10 EHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@@H](C)Cc1ccc(OC)cc1 ZINC000128416141 1137778622 /nfs/dbraw/zinc/77/86/22/1137778622.db2.gz MCNWLLBHBYYDBF-HNNXBMFYSA-N 1 1 329.440 3.863 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000882939318 1137839028 /nfs/dbraw/zinc/83/90/28/1137839028.db2.gz WABZCPKUKYDBKL-SJORKVTESA-N 1 1 337.341 3.819 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000130898474 1137843372 /nfs/dbraw/zinc/84/33/72/1137843372.db2.gz HQGHVAQWDZLEQV-UHFFFAOYSA-N 1 1 325.456 3.713 20 10 EHCDMO CN(C)C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)cc1 ZINC000883112913 1137845014 /nfs/dbraw/zinc/84/50/14/1137845014.db2.gz CJPWOUYQQHQXLU-INIZCTEOSA-N 1 1 340.801 3.716 20 10 EHCDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)cs1 ZINC000883290890 1137852918 /nfs/dbraw/zinc/85/29/18/1137852918.db2.gz LENWGEYSPKRKFD-MRXNPFEDSA-N 1 1 329.513 3.659 20 10 EHCDMO COc1cccc2c1OCCC[C@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000883328947 1137855256 /nfs/dbraw/zinc/85/52/56/1137855256.db2.gz AIIZSWMBMAMSFC-OAHLLOKOSA-N 1 1 335.350 3.683 20 10 EHCDMO Cc1cnc([C@@H](C)[NH2+]Cc2cccc(Br)c2O)s1 ZINC000134906791 1137961440 /nfs/dbraw/zinc/96/14/40/1137961440.db2.gz OSXWYWLAKKZOPI-SECBINFHSA-N 1 1 327.247 3.770 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1c(O)cccc1F ZINC000886508671 1138086246 /nfs/dbraw/zinc/08/62/46/1138086246.db2.gz JTRGLUYHDTUNNH-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@@H]([NH2+][C@H](Cc1nccn1C)c1ccccc1)c1c(O)cccc1F ZINC000886535170 1138092050 /nfs/dbraw/zinc/09/20/50/1138092050.db2.gz VXDWANWLRPDGSE-RHSMWYFYSA-N 1 1 339.414 3.899 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](O)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886545552 1138094334 /nfs/dbraw/zinc/09/43/34/1138094334.db2.gz NQRPUOMBHHSPAB-BMIGLBTASA-N 1 1 343.320 3.934 20 10 EHCDMO COC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(F)c(F)c1 ZINC000886562113 1138097631 /nfs/dbraw/zinc/09/76/31/1138097631.db2.gz QQYGOAWRVAXDKC-BONVTDFDSA-N 1 1 325.330 3.848 20 10 EHCDMO COc1ccc(N2CC[C@H](C[NH2+][C@H](C)c3c(O)cccc3F)C2)cc1 ZINC000886627974 1138103703 /nfs/dbraw/zinc/10/37/03/1138103703.db2.gz BTBMBPKBUQSATG-HUUCEWRRSA-N 1 1 344.430 3.717 20 10 EHCDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)n1 ZINC000091832256 1138222370 /nfs/dbraw/zinc/22/23/70/1138222370.db2.gz LYXXILPZRWOJTE-SFHVURJKSA-N 1 1 340.471 3.748 20 10 EHCDMO C[C@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1O ZINC000185090538 1140135650 /nfs/dbraw/zinc/13/56/50/1140135650.db2.gz JGRJCJOURQMLSA-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO COc1cccc(N2CC[C@@H](C[NH2+][C@@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185312369 1140144415 /nfs/dbraw/zinc/14/44/15/1140144415.db2.gz WFSLNGQUABXDQX-GJZGRUSLSA-N 1 1 344.430 3.717 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1O ZINC000777439856 1140280909 /nfs/dbraw/zinc/28/09/09/1140280909.db2.gz PICCXRSJYSXQHC-SFHVURJKSA-N 1 1 335.806 3.587 20 10 EHCDMO C[C@H](CO[C@@H]1CCOC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192943217 1140556396 /nfs/dbraw/zinc/55/63/96/1140556396.db2.gz RYOLBUFGXKQNOZ-OUAUKWLOSA-N 1 1 334.243 3.544 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2csc([C@H](C)OC)n2)c(O)c1 ZINC000267596220 1140808596 /nfs/dbraw/zinc/80/85/96/1140808596.db2.gz CCUQMRKKHBGPGV-LBPRGKRZSA-N 1 1 336.457 3.635 20 10 EHCDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001204432501 1015570039 /nfs/dbraw/zinc/57/00/39/1015570039.db2.gz TWNNAJFRJWPXPJ-CVEARBPZSA-N 1 1 330.497 3.994 20 10 EHCDMO COc1c(Br)cccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001140155522 1017201745 /nfs/dbraw/zinc/20/17/45/1017201745.db2.gz CRDJWTGFYKJINM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1c(Br)cccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001140155522 1017201753 /nfs/dbraw/zinc/20/17/53/1017201753.db2.gz CRDJWTGFYKJINM-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000377711247 1018242439 /nfs/dbraw/zinc/24/24/39/1018242439.db2.gz ZENWWFTYODUZKA-INIZCTEOSA-N 1 1 343.427 3.779 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000377711247 1018242452 /nfs/dbraw/zinc/24/24/52/1018242452.db2.gz ZENWWFTYODUZKA-INIZCTEOSA-N 1 1 343.427 3.779 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3ccsc3)C1)CCCC2 ZINC000160396163 1018707277 /nfs/dbraw/zinc/70/72/77/1018707277.db2.gz VSRAOZJVYNLRDK-IBGZPJMESA-N 1 1 329.465 3.906 20 10 EHCDMO CCOCCCN1CC[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)[C@H](C)C1 ZINC000280054355 1020039351 /nfs/dbraw/zinc/03/93/51/1020039351.db2.gz JUZXNMPHUFRTPF-HOJAQTOUSA-N 1 1 348.531 3.878 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000050901245 1020664880 /nfs/dbraw/zinc/66/48/80/1020664880.db2.gz GZZQRPJJUPRGQL-DLBZAZTESA-N 1 1 332.488 3.526 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c(O)c1OC ZINC000891553467 1021913975 /nfs/dbraw/zinc/91/39/75/1021913975.db2.gz NJWUNZDYZLSGRX-NSHDSACASA-N 1 1 337.366 3.881 20 10 EHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000894746679 1022828979 /nfs/dbraw/zinc/82/89/79/1022828979.db2.gz AVXIRGLKSGKDEC-ZIFCJYIRSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000894746679 1022828999 /nfs/dbraw/zinc/82/89/99/1022828999.db2.gz AVXIRGLKSGKDEC-ZIFCJYIRSA-N 1 1 345.389 3.675 20 10 EHCDMO Oc1c(F)cc(F)cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000894746679 1022829019 /nfs/dbraw/zinc/82/90/19/1022829019.db2.gz AVXIRGLKSGKDEC-ZIFCJYIRSA-N 1 1 345.389 3.675 20 10 EHCDMO Cc1cc(C)c2[nH+]c(NCCc3cc(O)c(O)cc3O)cc(C)c2c1 ZINC001168006556 1024430168 /nfs/dbraw/zinc/43/01/68/1024430168.db2.gz PSNQISUAXNVUJD-UHFFFAOYSA-N 1 1 338.407 3.931 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1ccc(F)cc1O ZINC000273467856 1027442222 /nfs/dbraw/zinc/44/22/22/1027442222.db2.gz JGOHQMYZXQVLEH-JSGCOSHPSA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccc(F)cc1[O-] ZINC000359872336 1027864592 /nfs/dbraw/zinc/86/45/92/1027864592.db2.gz OSMCEVXXPSLTOJ-YYFZDKIDSA-N 1 1 328.431 3.875 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)cc1C(C)C ZINC000054521138 1029788968 /nfs/dbraw/zinc/78/89/68/1029788968.db2.gz SLSHMQPTZKOGSU-QGZVFWFLSA-N 1 1 344.499 3.562 20 10 EHCDMO COCc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cc1 ZINC000160180220 1030583505 /nfs/dbraw/zinc/58/35/05/1030583505.db2.gz UJRSHGIPSLCRQK-FQEVSTJZSA-N 1 1 341.451 3.720 20 10 EHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c1 ZINC000160197975 1030597159 /nfs/dbraw/zinc/59/71/59/1030597159.db2.gz MOWPYCVMCSHHGO-GOSISDBHSA-N 1 1 327.424 3.587 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(Br)o2)c1O ZINC000130686766 1030832943 /nfs/dbraw/zinc/83/29/43/1030832943.db2.gz JAQQTZKOASKJIG-UHFFFAOYSA-N 1 1 340.217 3.778 20 10 EHCDMO CC[C@H]([NH2+]C[C@@H](c1cccc(OC)c1)N(C)C)c1ccc(F)cc1O ZINC000796663771 1033880881 /nfs/dbraw/zinc/88/08/81/1033880881.db2.gz PTAIOAXWSZTKDB-OALUTQOASA-N 1 1 346.446 3.884 20 10 EHCDMO CC[N@@H+](CCc1ccccn1)Cc1cc(Br)ccc1O ZINC000174426767 1033925454 /nfs/dbraw/zinc/92/54/54/1033925454.db2.gz YJWFXWZANNEUMH-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000179429656 1034309524 /nfs/dbraw/zinc/30/95/24/1034309524.db2.gz XNOSOCYOJQMFIU-IBGZPJMESA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000179429656 1034309531 /nfs/dbraw/zinc/30/95/31/1034309531.db2.gz XNOSOCYOJQMFIU-IBGZPJMESA-N 1 1 331.387 3.504 20 10 EHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(OC)c2O)C12CCC2 ZINC000761202521 1034411149 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CN(C)c1ccc(C[N@@H+](Cc2c3c(nn2C)CCCC3)C2CC2)cc1 ZINC001180558844 1133390963 /nfs/dbraw/zinc/39/09/63/1133390963.db2.gz WZGFIXTXIHCYSJ-UHFFFAOYSA-N 1 1 338.499 3.530 20 10 EHCDMO C[N@@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)CC1(O)CCC1 ZINC001180655587 1133403558 /nfs/dbraw/zinc/40/35/58/1133403558.db2.gz YRSXDNYONZTIQE-UHFFFAOYSA-N 1 1 336.479 3.596 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1 ZINC000770325270 1133411337 /nfs/dbraw/zinc/41/13/37/1133411337.db2.gz NPGRZEYICOXKAD-XLIONFOSSA-N 1 1 326.488 3.812 20 10 EHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC001181454781 1133488697 /nfs/dbraw/zinc/48/86/97/1133488697.db2.gz GPIHEVCLWJIRDD-NRFANRHFSA-N 1 1 326.484 3.751 20 10 EHCDMO C[C@@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000771844333 1133598972 /nfs/dbraw/zinc/59/89/72/1133598972.db2.gz SKCKBEYICGGVOI-OAHLLOKOSA-N 1 1 345.437 3.567 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(Br)ccc2O)cc1 ZINC000771933634 1133616563 /nfs/dbraw/zinc/61/65/63/1133616563.db2.gz OHXDQXZUXNYHAY-UHFFFAOYSA-N 1 1 349.272 3.853 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774226768 1133642598 /nfs/dbraw/zinc/64/25/98/1133642598.db2.gz RWCWKRTUJUHZOI-AMJWSMQMSA-N 1 1 329.271 3.832 20 10 EHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1[C@H]2Cc3ccc(Br)cc3[C@@H]12 ZINC001183472065 1133811212 /nfs/dbraw/zinc/81/12/12/1133811212.db2.gz LJOUIUXQBIOVCF-NUEKZKHPSA-N 1 1 348.215 3.722 20 10 EHCDMO COc1cc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(O)cc1C ZINC000774702620 1133884335 /nfs/dbraw/zinc/88/43/35/1133884335.db2.gz MQYZPQIKDGTOGL-NRFANRHFSA-N 1 1 339.435 3.731 20 10 EHCDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000787416311 1134001193 /nfs/dbraw/zinc/00/11/93/1134001193.db2.gz BWUMSONKQXCXRB-INIZCTEOSA-N 1 1 342.405 3.686 20 10 EHCDMO COc1c(O)c(C[N@H+](C)[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000774818033 1134030061 /nfs/dbraw/zinc/03/00/61/1134030061.db2.gz BKLMEFBFQFQKOZ-MRXNPFEDSA-N 1 1 342.395 3.818 20 10 EHCDMO COc1c(O)c(C[N@@H+](C)[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000774818033 1134030067 /nfs/dbraw/zinc/03/00/67/1134030067.db2.gz BKLMEFBFQFQKOZ-MRXNPFEDSA-N 1 1 342.395 3.818 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774910422 1134117622 /nfs/dbraw/zinc/11/76/22/1134117622.db2.gz XJTCXKSJEINHQD-XJKSGUPXSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774910422 1134117629 /nfs/dbraw/zinc/11/76/29/1134117629.db2.gz XJTCXKSJEINHQD-XJKSGUPXSA-N 1 1 342.395 3.687 20 10 EHCDMO COc1c(O)c(C[NH2+][C@@H](c2cccs2)C2CC2)ccc1[N+](=O)[O-] ZINC000774966657 1134158067 /nfs/dbraw/zinc/15/80/67/1134158067.db2.gz LXRYWRLEGRHYCN-CQSZACIVSA-N 1 1 334.397 3.611 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(C)c(F)c2)ccc1[N+](=O)[O-] ZINC000775036073 1134237114 /nfs/dbraw/zinc/23/71/14/1134237114.db2.gz AXRDPNHTESYKHZ-LLVKDONJSA-N 1 1 334.347 3.607 20 10 EHCDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(C(C)C)c(C)cc1O ZINC000789519689 1134290233 /nfs/dbraw/zinc/29/02/33/1134290233.db2.gz MSHNJIXIIKSYPZ-QGZVFWFLSA-N 1 1 332.488 3.705 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)cc1C(C)C ZINC000790403086 1134416839 /nfs/dbraw/zinc/41/68/39/1134416839.db2.gz MNBJHZJGTUQNOL-RZQQEMMASA-N 1 1 333.472 3.592 20 10 EHCDMO O=C1O[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CC12CCC2 ZINC000792231684 1134669254 /nfs/dbraw/zinc/66/92/54/1134669254.db2.gz MFWKHOFJKKLYSZ-QGZVFWFLSA-N 1 1 329.440 3.623 20 10 EHCDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001190549626 1134717731 /nfs/dbraw/zinc/71/77/31/1134717731.db2.gz CYXORVNJEJSHGP-PKOBYXMFSA-N 1 1 345.531 3.578 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccn2C)c(C(F)(F)F)c1 ZINC000792827319 1134796765 /nfs/dbraw/zinc/79/67/65/1134796765.db2.gz BDMZPUBDVDASSE-UHFFFAOYSA-N 1 1 325.378 3.742 20 10 EHCDMO CCc1ccc(CN2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)s1 ZINC001191123479 1134797712 /nfs/dbraw/zinc/79/77/12/1134797712.db2.gz WDDGIJMYCYPLEF-UHFFFAOYSA-N 1 1 343.540 3.694 20 10 EHCDMO C[C@H](CNCc1ccc(N(C)C)cc1C(F)(F)F)C[NH+]1CCCC1 ZINC000792919328 1134825044 /nfs/dbraw/zinc/82/50/44/1134825044.db2.gz FYHCVAQEOAYWBN-CQSZACIVSA-N 1 1 343.437 3.593 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2C(C)(C)O)c(C(F)(F)F)c1 ZINC000793075355 1134846714 /nfs/dbraw/zinc/84/67/14/1134846714.db2.gz AXEOIINNYMNPJL-HNNXBMFYSA-N 1 1 330.394 3.507 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccn1C(F)F ZINC001205668052 1135283704 /nfs/dbraw/zinc/28/37/04/1135283704.db2.gz TWCBUZBUYHPAKT-UHFFFAOYSA-N 1 1 331.160 3.641 20 10 EHCDMO CC[C@H]([NH2+]CCC[N@@H+](C)CCOC)c1cc(Cl)cc(Cl)c1[O-] ZINC000806131434 1135388473 /nfs/dbraw/zinc/38/84/73/1135388473.db2.gz JHUNQSYJSOSVFG-HNNXBMFYSA-N 1 1 349.302 3.708 20 10 EHCDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2[C@H](C)NC(=O)OC(C)(C)C)c1O ZINC000775653630 1135419812 /nfs/dbraw/zinc/41/98/12/1135419812.db2.gz KQTYVLYWGRDGBH-RDJZCZTQSA-N 1 1 348.487 3.968 20 10 EHCDMO CC[N@@H+]1[C@H](C)CN(Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC001195669855 1135448393 /nfs/dbraw/zinc/44/83/93/1135448393.db2.gz MBDFECIFWYVHDY-KDURUIRLSA-N 1 1 329.532 3.900 20 10 EHCDMO CCN1[C@H](C)C[N@@H+](Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC001195669855 1135448397 /nfs/dbraw/zinc/44/83/97/1135448397.db2.gz MBDFECIFWYVHDY-KDURUIRLSA-N 1 1 329.532 3.900 20 10 EHCDMO CCN1[C@H](C)C[N@H+](Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC001195669855 1135448398 /nfs/dbraw/zinc/44/83/98/1135448398.db2.gz MBDFECIFWYVHDY-KDURUIRLSA-N 1 1 329.532 3.900 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](CC(C)C)C[C@@H](O)c2ccc(F)cc2)c1 ZINC000775702920 1135540558 /nfs/dbraw/zinc/54/05/58/1135540558.db2.gz FXPNXZQSBUEYOM-HXUWFJFHSA-N 1 1 347.430 3.732 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735222 1135590133 /nfs/dbraw/zinc/59/01/33/1135590133.db2.gz NZURKSNTGMFTOJ-GCJKJVERSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735222 1135590136 /nfs/dbraw/zinc/59/01/36/1135590136.db2.gz NZURKSNTGMFTOJ-GCJKJVERSA-N 1 1 335.495 3.631 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCN(C)CC3)cc2)[C@@H]1c1ccccc1 ZINC000775735222 1135590137 /nfs/dbraw/zinc/59/01/37/1135590137.db2.gz NZURKSNTGMFTOJ-GCJKJVERSA-N 1 1 335.495 3.631 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](CC(C)C)CC(C)(C)C(=O)OC)cc1 ZINC001197325975 1135679827 /nfs/dbraw/zinc/67/98/27/1135679827.db2.gz MCSPAVYTXPDBQQ-UHFFFAOYSA-N 1 1 334.504 3.800 20 10 EHCDMO CCc1cc(CCC[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)on1 ZINC000809575944 1135852569 /nfs/dbraw/zinc/85/25/69/1135852569.db2.gz NJKYVODXKPGYKF-LJQANCHMSA-N 1 1 344.455 3.556 20 10 EHCDMO COc1ccc(C[N@H+](C)Cc2ccccc2O)c(Br)c1 ZINC000809549395 1135855516 /nfs/dbraw/zinc/85/55/16/1135855516.db2.gz PLAVLKNWYIZVBQ-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)c(Br)c1 ZINC000809549395 1135855519 /nfs/dbraw/zinc/85/55/19/1135855519.db2.gz PLAVLKNWYIZVBQ-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000809767391 1135879745 /nfs/dbraw/zinc/87/97/45/1135879745.db2.gz JRVUBRWMIZWOJU-GFCCVEGCSA-N 1 1 348.306 3.737 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c1 ZINC000809738197 1135882905 /nfs/dbraw/zinc/88/29/05/1135882905.db2.gz SZKJFPSUITZUKL-UHFFFAOYSA-N 1 1 327.424 3.909 20 10 EHCDMO COc1cccc(CN(CC[NH+](C)C)Cc2cccc(Cl)c2O)c1 ZINC000809752548 1135886075 /nfs/dbraw/zinc/88/60/75/1135886075.db2.gz RQWBEGKVEZHKAT-UHFFFAOYSA-N 1 1 348.874 3.618 20 10 EHCDMO COC(=O)c1occc1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000776174187 1136021713 /nfs/dbraw/zinc/02/17/13/1136021713.db2.gz KFLGZSZPVPXXBL-UHFFFAOYSA-N 1 1 342.439 3.592 20 10 EHCDMO Cc1cc(C[NH2+][C@H]2C[C@@H](C)n3ncnc32)c(C)n1-c1cccc(C)c1 ZINC000850352259 1136239604 /nfs/dbraw/zinc/23/96/04/1136239604.db2.gz QCOAYXZADDTTBH-BEFAXECRSA-N 1 1 335.455 3.790 20 10 EHCDMO CC[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)[C@H]1CCOC1 ZINC000812780537 1136246603 /nfs/dbraw/zinc/24/66/03/1136246603.db2.gz HUJJNTLFHQUJFY-SFHVURJKSA-N 1 1 327.424 3.582 20 10 EHCDMO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccc(N2CCCCC2)c(F)c1 ZINC000850498822 1136271956 /nfs/dbraw/zinc/27/19/56/1136271956.db2.gz DLMKWXPFJNOMJH-ZQIUZPCESA-N 1 1 343.450 3.764 20 10 EHCDMO CCOCc1cc(CNC[C@@]2([NH+](C)C)CCC[C@H](C)C2)ccc1OC ZINC000747854027 1136326384 /nfs/dbraw/zinc/32/63/84/1136326384.db2.gz LLDBLHCMBAAWDO-LAUBAEHRSA-N 1 1 348.531 3.832 20 10 EHCDMO CC[C@H](CC(F)F)C[N@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000851841665 1136413525 /nfs/dbraw/zinc/41/35/25/1136413525.db2.gz WIIHOOWWYXSFQH-LLVKDONJSA-N 1 1 349.805 3.702 20 10 EHCDMO CC[C@H](CC(F)F)C[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000851841665 1136413527 /nfs/dbraw/zinc/41/35/27/1136413527.db2.gz WIIHOOWWYXSFQH-LLVKDONJSA-N 1 1 349.805 3.702 20 10 EHCDMO COC(CC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1)OC ZINC000851879341 1136415726 /nfs/dbraw/zinc/41/57/26/1136415726.db2.gz IJMWNYSSFMIIEQ-MRXNPFEDSA-N 1 1 329.440 3.964 20 10 EHCDMO CCN(C(=O)C[N@@H+](C)Cc1ccccc1O)[C@@H](C)c1ccc(F)cc1 ZINC000111235810 1136524549 /nfs/dbraw/zinc/52/45/49/1136524549.db2.gz DGHFVSJFLNQKOD-HNNXBMFYSA-N 1 1 344.430 3.573 20 10 EHCDMO CCc1ccc([C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000111235232 1136524808 /nfs/dbraw/zinc/52/48/08/1136524808.db2.gz HRNDOUQSYQVTNV-HZPDHXFCSA-N 1 1 340.467 3.652 20 10 EHCDMO C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@](C)(C(F)F)O1 ZINC000853631073 1136551225 /nfs/dbraw/zinc/55/12/25/1136551225.db2.gz SAYRUGNJPGKBGD-BBATYDOGSA-N 1 1 343.414 3.640 20 10 EHCDMO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@](C)(C(F)F)O1 ZINC000853631073 1136551228 /nfs/dbraw/zinc/55/12/28/1136551228.db2.gz SAYRUGNJPGKBGD-BBATYDOGSA-N 1 1 343.414 3.640 20 10 EHCDMO CCCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000854248054 1136601193 /nfs/dbraw/zinc/60/11/93/1136601193.db2.gz MUHWVUFMBSSQSY-KRWDZBQOSA-N 1 1 347.503 3.577 20 10 EHCDMO C[C@H]([NH2+]Cc1ncccc1N(C)C)c1cccc(C(F)(F)F)c1O ZINC000815627417 1136620816 /nfs/dbraw/zinc/62/08/16/1136620816.db2.gz ACVZGFPSBAKAAA-NSHDSACASA-N 1 1 339.361 3.723 20 10 EHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000776767498 1136656088 /nfs/dbraw/zinc/65/60/88/1136656088.db2.gz SQBNGDBHHCVKPK-OAQYLSRUSA-N 1 1 337.394 3.778 20 10 EHCDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816499194 1136727607 /nfs/dbraw/zinc/72/76/07/1136727607.db2.gz IQKRAZVMOZKOME-MRXNPFEDSA-N 1 1 340.467 3.674 20 10 EHCDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816509598 1136728979 /nfs/dbraw/zinc/72/89/79/1136728979.db2.gz WHJCEVPNKUYMNY-JTQLQIEISA-N 1 1 346.830 3.530 20 10 EHCDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816509598 1136728982 /nfs/dbraw/zinc/72/89/82/1136728982.db2.gz WHJCEVPNKUYMNY-JTQLQIEISA-N 1 1 346.830 3.530 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cccc(Cn2cccn2)c1 ZINC000816537957 1136731106 /nfs/dbraw/zinc/73/11/06/1136731106.db2.gz ZOIVESLPUYRFKG-UHFFFAOYSA-N 1 1 345.805 3.719 20 10 EHCDMO Cn1cc([C@@H]2CSCC[N@H+]2Cc2ccc3ccccc3c2O)cn1 ZINC000816591278 1136735027 /nfs/dbraw/zinc/73/50/27/1136735027.db2.gz ZJJYKGQWCWYMLN-SFHVURJKSA-N 1 1 339.464 3.569 20 10 EHCDMO COc1c(O)c(C[NH2+]C[C@@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000816618826 1136742209 /nfs/dbraw/zinc/74/22/09/1136742209.db2.gz JXKYUXFXRYZKHG-INIZCTEOSA-N 1 1 342.395 3.592 20 10 EHCDMO COc1cc2c(cc1Cl)C[N@H+](Cc1c(O)cccc1OC)CC2 ZINC000816664979 1136746681 /nfs/dbraw/zinc/74/66/81/1136746681.db2.gz MRYSLTKBJCCYMN-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1cc2c(cc1Cl)C[N@@H+](Cc1c(O)cccc1OC)CC2 ZINC000816664979 1136746682 /nfs/dbraw/zinc/74/66/82/1136746682.db2.gz MRYSLTKBJCCYMN-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO CC[C@@H]1C[C@H]([NH2+]Cc2cc(C)cc(Br)c2O)CCO1 ZINC000817415806 1136806747 /nfs/dbraw/zinc/80/67/47/1136806747.db2.gz ZNQZIRWAKRIBNG-CHWSQXEVSA-N 1 1 328.250 3.510 20 10 EHCDMO C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1[O-] ZINC000817585176 1136825286 /nfs/dbraw/zinc/82/52/86/1136825286.db2.gz BZGBGLIQWATMOR-LMWSTFAQSA-N 1 1 341.293 3.678 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CC(Cc2ccsc2)C1 ZINC000857068182 1136840743 /nfs/dbraw/zinc/84/07/43/1136840743.db2.gz LSROEFGIWBCEER-UHFFFAOYSA-N 1 1 338.270 3.891 20 10 EHCDMO CC(C)Oc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938101 1136847561 /nfs/dbraw/zinc/84/75/61/1136847561.db2.gz DPOCEFVYHOFMHW-HRAATJIYSA-N 1 1 341.499 3.890 20 10 EHCDMO CC(C)Oc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938103 1136847855 /nfs/dbraw/zinc/84/78/55/1136847855.db2.gz DPOCEFVYHOFMHW-IIBYNOLFSA-N 1 1 341.499 3.890 20 10 EHCDMO CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)cc(Cl)c1[O-] ZINC000817957445 1136851606 /nfs/dbraw/zinc/85/16/06/1136851606.db2.gz CIBQRCJHSQVBKL-MWLCHTKSSA-N 1 1 349.700 3.832 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1[O-] ZINC000817969198 1136853910 /nfs/dbraw/zinc/85/39/10/1136853910.db2.gz RNTKQUSDAMIDEM-LLVKDONJSA-N 1 1 347.256 3.609 20 10 EHCDMO CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817979730 1136854983 /nfs/dbraw/zinc/85/49/83/1136854983.db2.gz DRHDKAOXKGSIGG-HIFRSBDPSA-N 1 1 330.394 3.984 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3cc(Cl)c(F)cc3O)C2)nc1 ZINC000858012033 1136930435 /nfs/dbraw/zinc/93/04/35/1136930435.db2.gz BNZDJSDOCXTRGD-CYBMUJFWSA-N 1 1 336.794 3.541 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C2)nc1 ZINC000858012033 1136930437 /nfs/dbraw/zinc/93/04/37/1136930437.db2.gz BNZDJSDOCXTRGD-CYBMUJFWSA-N 1 1 336.794 3.541 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858013540 1136931018 /nfs/dbraw/zinc/93/10/18/1136931018.db2.gz FFQHJUZTMQOVTC-QGZVFWFLSA-N 1 1 344.842 3.971 20 10 EHCDMO CC1(C)C[C@H](c2ccccc2)[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000819901200 1136965850 /nfs/dbraw/zinc/96/58/50/1136965850.db2.gz VDHKWDOPKQEJSL-IEBWSBKVSA-N 1 1 339.435 3.791 20 10 EHCDMO CCOC(=O)C1=CC[C@@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000858506097 1136974570 /nfs/dbraw/zinc/97/45/70/1136974570.db2.gz CUZGKLLKQMNHGK-CMPLNLGQSA-N 1 1 343.345 3.714 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CO[C@H](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000858548251 1136977876 /nfs/dbraw/zinc/97/78/76/1136977876.db2.gz RTUZCCYNKJYYGB-KPCOEVGBSA-N 1 1 344.224 3.512 20 10 EHCDMO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001136336030 1136990466 /nfs/dbraw/zinc/99/04/66/1136990466.db2.gz YHGIFXFLBKOADX-LJQANCHMSA-N 1 1 345.531 3.610 20 10 EHCDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1sccc1-n1c(C)ccc1C ZINC001136755442 1137107670 /nfs/dbraw/zinc/10/76/70/1137107670.db2.gz WCEMERQRCQVEHK-INIZCTEOSA-N 1 1 345.512 3.760 20 10 EHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)c(C)s1 ZINC000772875201 1137113154 /nfs/dbraw/zinc/11/31/54/1137113154.db2.gz KBEGYPIILBYYSQ-GFCCVEGCSA-N 1 1 349.475 3.586 20 10 EHCDMO CCC(CC)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000862024066 1137127253 /nfs/dbraw/zinc/12/72/53/1137127253.db2.gz OZKJOHIVJWCQRI-MRXNPFEDSA-N 1 1 333.520 3.658 20 10 EHCDMO Cn1ncc2c1CC(C)(C)C[N@@H+](Cc1ccc3ccccc3c1O)C2 ZINC000828014210 1137132896 /nfs/dbraw/zinc/13/28/96/1137132896.db2.gz XDFSBMJSUHLALV-UHFFFAOYSA-N 1 1 335.451 3.863 20 10 EHCDMO CCOCc1cc(C[NH2+]Cc2cc(F)cnc2Cl)ccc1OC ZINC000824537466 1137141695 /nfs/dbraw/zinc/14/16/95/1137141695.db2.gz DFHFFQCOCAIUKS-UHFFFAOYSA-N 1 1 338.810 3.709 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CCCC2(F)F)c1 ZINC000824799036 1137153076 /nfs/dbraw/zinc/15/30/76/1137153076.db2.gz JLJVINWUFLJNRB-LLVKDONJSA-N 1 1 334.204 3.988 20 10 EHCDMO CCc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(CC)c1O ZINC001144151574 1137245463 /nfs/dbraw/zinc/24/54/63/1137245463.db2.gz YNVHZCANHOPJHW-UHFFFAOYSA-N 1 1 341.451 3.877 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]c3nc(Cl)ccc23)cc1 ZINC001144416335 1137288339 /nfs/dbraw/zinc/28/83/39/1137288339.db2.gz GGFXFOBZWFEVHB-UHFFFAOYSA-N 1 1 328.847 3.914 20 10 EHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC000845970819 1137322465 /nfs/dbraw/zinc/32/24/65/1137322465.db2.gz CIQDECWKFBBVTC-QMMMGPOBSA-N 1 1 332.347 3.727 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@](O)(c2ccc(Cl)cc2)C1 ZINC000846009463 1137325222 /nfs/dbraw/zinc/32/52/22/1137325222.db2.gz ACJULKNUMDGNIW-LJQANCHMSA-N 1 1 347.842 3.538 20 10 EHCDMO COc1cccc([C@@H](C)NC[C@@H]2CCC[N@@H+]2C2CCCCC2)c1O ZINC000846167963 1137337490 /nfs/dbraw/zinc/33/74/90/1137337490.db2.gz PKFDGGKGCSDCLP-WBVHZDCISA-N 1 1 332.488 3.849 20 10 EHCDMO COc1cccc([C@@H](C)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1O ZINC000846167963 1137337492 /nfs/dbraw/zinc/33/74/92/1137337492.db2.gz PKFDGGKGCSDCLP-WBVHZDCISA-N 1 1 332.488 3.849 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846216416 1137341867 /nfs/dbraw/zinc/34/18/67/1137341867.db2.gz SBETYWUCSICASG-PWSUYJOCSA-N 1 1 346.254 3.803 20 10 EHCDMO CC[C@@H]([NH2+]CCc1cn(C)c2ncccc12)c1ccc(F)cc1O ZINC000866574066 1137366124 /nfs/dbraw/zinc/36/61/24/1137366124.db2.gz QUULKQKUGDGXNB-QGZVFWFLSA-N 1 1 327.403 3.701 20 10 EHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1Br ZINC000121141082 1137368352 /nfs/dbraw/zinc/36/83/52/1137368352.db2.gz NEDGIEMHFNIRRG-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO Cc1cc(N(C)C)ccc1CNC1CC[NH+](C2CCCCC2)CC1 ZINC000122658494 1137457693 /nfs/dbraw/zinc/45/76/93/1137457693.db2.gz GGOSENHUHUSKMB-UHFFFAOYSA-N 1 1 329.532 3.948 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC001171879087 1137518624 /nfs/dbraw/zinc/51/86/24/1137518624.db2.gz MSZRQUNODOTDBM-QGZVFWFLSA-N 1 1 345.512 3.568 20 10 EHCDMO C[NH+](C)CCCOc1ccc(NCc2ccc(F)c(F)c2O)cc1 ZINC000876858616 1137663769 /nfs/dbraw/zinc/66/37/69/1137663769.db2.gz UPCZKDZPAFKLQT-UHFFFAOYSA-N 1 1 336.382 3.613 20 10 EHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC12CCC2 ZINC000877175855 1137672278 /nfs/dbraw/zinc/67/22/78/1137672278.db2.gz LOHNLRVHXJUQEO-KRWDZBQOSA-N 1 1 328.500 3.660 20 10 EHCDMO Cc1cccc(O)c1C[N@@H+]1CCc2c(ncn2CCc2ccccc2)C1 ZINC000877181232 1137672378 /nfs/dbraw/zinc/67/23/78/1137672378.db2.gz JWBOSFCEIQTZEM-UHFFFAOYSA-N 1 1 347.462 3.698 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCc2c(ncn2CCc2ccccc2)C1 ZINC000877181232 1137672379 /nfs/dbraw/zinc/67/23/79/1137672379.db2.gz JWBOSFCEIQTZEM-UHFFFAOYSA-N 1 1 347.462 3.698 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000877195777 1137672693 /nfs/dbraw/zinc/67/26/93/1137672693.db2.gz QRDRLSPEWAURDW-CYBMUJFWSA-N 1 1 339.361 3.753 20 10 EHCDMO CC[N@@H+](Cc1occc1C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877589434 1137682189 /nfs/dbraw/zinc/68/21/89/1137682189.db2.gz DYJFBGDSFTVXTB-UHFFFAOYSA-N 1 1 328.456 3.571 20 10 EHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](OCc3ccccn3)C2)c1O ZINC000877645795 1137684311 /nfs/dbraw/zinc/68/43/11/1137684311.db2.gz WSJUOYAOKDTHHA-QGZVFWFLSA-N 1 1 332.831 3.540 20 10 EHCDMO CCC(=O)N1CCC[N@@H+](Cc2cc(CC)cc(C(C)(C)C)c2O)CC1 ZINC000128731455 1137796313 /nfs/dbraw/zinc/79/63/13/1137796313.db2.gz WCSNVJRKLJVIKG-UHFFFAOYSA-N 1 1 346.515 3.696 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1OC ZINC000882887555 1137836956 /nfs/dbraw/zinc/83/69/56/1137836956.db2.gz XPTVMGSVYVESGW-UHFFFAOYSA-N 1 1 337.366 3.758 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000882939317 1137839015 /nfs/dbraw/zinc/83/90/15/1137839015.db2.gz WABZCPKUKYDBKL-IRXDYDNUSA-N 1 1 337.341 3.819 20 10 EHCDMO COc1ccc(OC(F)F)c(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000883037534 1137842435 /nfs/dbraw/zinc/84/24/35/1137842435.db2.gz BKVWDVHNGYESLM-UHFFFAOYSA-N 1 1 345.292 3.570 20 10 EHCDMO Cc1cc(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000131077681 1137846053 /nfs/dbraw/zinc/84/60/53/1137846053.db2.gz TXZABCSNMPEMGN-DLBZAZTESA-N 1 1 335.513 3.704 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccccc1CN1CCCC1=O)c1c(O)cccc1F ZINC000886501223 1138084410 /nfs/dbraw/zinc/08/44/10/1138084410.db2.gz BFBQEXABLOROED-CQSZACIVSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1c(O)cccc1F ZINC000886553627 1138095622 /nfs/dbraw/zinc/09/56/22/1138095622.db2.gz RYDFCNIJAIGWSQ-QWHCGFSZSA-N 1 1 325.449 3.627 20 10 EHCDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886644845 1138105749 /nfs/dbraw/zinc/10/57/49/1138105749.db2.gz LXPCUEAMNWKEGO-YGRLFVJLSA-N 1 1 343.320 3.934 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2cscc2Cl)c1 ZINC000886656598 1138108812 /nfs/dbraw/zinc/10/88/12/1138108812.db2.gz LJUSJTQUSGCNLW-SECBINFHSA-N 1 1 325.817 3.745 20 10 EHCDMO CC[C@H]([NH2+]Cc1nc(Cc2ccccc2F)no1)c1ccccc1O ZINC000886714796 1138124004 /nfs/dbraw/zinc/12/40/04/1138124004.db2.gz VHTAYMIPUJFHSN-INIZCTEOSA-N 1 1 341.386 3.746 20 10 EHCDMO CC[N@H+](Cc1nc(C)c(C)o1)Cc1cc(Br)ccc1O ZINC000076118498 1138130159 /nfs/dbraw/zinc/13/01/59/1138130159.db2.gz SBARKEGCZYOVML-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO CC[N@@H+](Cc1nc(C)c(C)o1)Cc1cc(Br)ccc1O ZINC000076118498 1138130162 /nfs/dbraw/zinc/13/01/62/1138130162.db2.gz SBARKEGCZYOVML-UHFFFAOYSA-N 1 1 339.233 3.782 20 10 EHCDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cccc(OC)c1O ZINC000092507079 1138228996 /nfs/dbraw/zinc/22/89/96/1138228996.db2.gz GFZVHQYDNZCEBM-UHFFFAOYSA-N 1 1 329.440 3.830 20 10 EHCDMO CC[C@H]([NH2+]CC(F)(F)CNC(=O)OC(C)(C)C)c1ccccc1O ZINC000301907945 1138669438 /nfs/dbraw/zinc/66/94/38/1138669438.db2.gz QANPJEWLYIYAQB-ZDUSSCGKSA-N 1 1 344.402 3.593 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncc(Br)s1 ZINC000179194827 1139741082 /nfs/dbraw/zinc/74/10/82/1139741082.db2.gz QWNVDXQNAHCPIC-SNVBAGLBSA-N 1 1 340.290 3.822 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000179427422 1139756543 /nfs/dbraw/zinc/75/65/43/1139756543.db2.gz AXJJEHCZRWVQPJ-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000179427422 1139756545 /nfs/dbraw/zinc/75/65/45/1139756545.db2.gz AXJJEHCZRWVQPJ-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C[C@H]1CCCOC1 ZINC000183050722 1140010478 /nfs/dbraw/zinc/01/04/78/1140010478.db2.gz LVQPCIJPLRBFLU-GOSISDBHSA-N 1 1 341.451 3.830 20 10 EHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2cc(Cl)cc(OC)c2O)o1 ZINC000184708468 1140116461 /nfs/dbraw/zinc/11/64/61/1140116461.db2.gz MOUFZKLSPZPGLV-AWEZNQCLSA-N 1 1 339.819 3.687 20 10 EHCDMO Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192793856 1140552158 /nfs/dbraw/zinc/55/21/58/1140552158.db2.gz DALQXBXPLSFNPM-QMMMGPOBSA-N 1 1 328.243 3.900 20 10 EHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](c2noc(C3CC3)n2)C1 ZINC000271231307 1141329598 /nfs/dbraw/zinc/32/95/98/1141329598.db2.gz UOGNGXTWLWBZJN-LBPRGKRZSA-N 1 1 333.819 3.686 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1cc(F)cc(F)c1)C[C@H]1CCCO1 ZINC000160168207 1014177032 /nfs/dbraw/zinc/17/70/32/1014177032.db2.gz CLDDANIZYHWKHR-GOSISDBHSA-N 1 1 333.378 3.852 20 10 EHCDMO COc1cc(O)c(C[N@@H+]2CCc3c(Cl)cccc3C2)cc1OC ZINC000160279940 1016476769 /nfs/dbraw/zinc/47/67/69/1016476769.db2.gz WZCHUDVQXCAKFU-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3c(Cl)cccc3C2)cc1OC ZINC000160279940 1016476781 /nfs/dbraw/zinc/47/67/81/1016476781.db2.gz WZCHUDVQXCAKFU-UHFFFAOYSA-N 1 1 333.815 3.621 20 10 EHCDMO Cc1noc(C[C@@H]2CCC[N@@H+](Cc3c(O)cc(C)cc3Cl)C2)n1 ZINC000897577178 1032820130 /nfs/dbraw/zinc/82/01/30/1032820130.db2.gz OAGLGPFDDBYELT-ZDUSSCGKSA-N 1 1 335.835 3.500 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1O ZINC000091891082 1032859078 /nfs/dbraw/zinc/85/90/78/1032859078.db2.gz OUPJWZVKHFJSLD-HOTGVXAUSA-N 1 1 347.480 3.941 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Br)ccc2O)CC1 ZINC000280348509 1020306399 /nfs/dbraw/zinc/30/63/99/1020306399.db2.gz SPWNIOPMKUOGMT-OAHLLOKOSA-N 1 1 328.250 3.546 20 10 EHCDMO COc1cc(C)cc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1O ZINC000894595665 1022606840 /nfs/dbraw/zinc/60/68/40/1022606840.db2.gz PBANXBFCMWRKHP-UHFFFAOYSA-N 1 1 329.293 3.555 20 10 EHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)c(O)c1OC ZINC000891991631 1024237730 /nfs/dbraw/zinc/23/77/30/1024237730.db2.gz FMUWKQIVFCVEDZ-NSHDSACASA-N 1 1 336.457 3.676 20 10 EHCDMO CC1CCN(c2ccc(C[NH2+]Cc3ncc(Cl)n3C)cc2)CC1 ZINC000281577874 1024410870 /nfs/dbraw/zinc/41/08/70/1024410870.db2.gz CZBCSKGOKOLEII-UHFFFAOYSA-N 1 1 332.879 3.600 20 10 EHCDMO CC[N@@H+](Cc1ccc(NC(C)=O)cc1)Cc1ccc(N(C)C)cc1 ZINC000156841626 1024614049 /nfs/dbraw/zinc/61/40/49/1024614049.db2.gz TZOFTWZOQLZPDG-UHFFFAOYSA-N 1 1 325.456 3.733 20 10 EHCDMO C[N@@H+](CCC(=O)N1CCCCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000067457040 1024709279 /nfs/dbraw/zinc/70/92/79/1024709279.db2.gz XOPGQSVSDFWGOI-UHFFFAOYSA-N 1 1 343.515 3.511 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)c(O)c1OC ZINC000892154420 1025051153 /nfs/dbraw/zinc/05/11/53/1025051153.db2.gz YEQMSGSSGBLLGD-HIFRSBDPSA-N 1 1 331.412 3.976 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000840775811 1026168323 /nfs/dbraw/zinc/16/83/23/1026168323.db2.gz RYMZHOQKKBBHHF-LSDHHAIUSA-N 1 1 342.439 3.636 20 10 EHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)cc1F ZINC000273469129 1027444703 /nfs/dbraw/zinc/44/47/03/1027444703.db2.gz FGPYTFXYUUBXSR-LBPRGKRZSA-N 1 1 347.386 3.567 20 10 EHCDMO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cc2c(cc1O)CCCC2 ZINC000273510380 1027468665 /nfs/dbraw/zinc/46/86/65/1027468665.db2.gz RSAPLUIQAKMDIU-KZULUSFZSA-N 1 1 347.405 3.933 20 10 EHCDMO COC[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708215987 1028969146 /nfs/dbraw/zinc/96/91/46/1028969146.db2.gz PWLDRXFJGXNQFN-GFCCVEGCSA-N 1 1 348.668 3.809 20 10 EHCDMO COC[C@H]1CCCCN1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708215987 1028969163 /nfs/dbraw/zinc/96/91/63/1028969163.db2.gz PWLDRXFJGXNQFN-GFCCVEGCSA-N 1 1 348.668 3.809 20 10 EHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H]1CCc2ccc(F)cc21 ZINC000179196655 1029106534 /nfs/dbraw/zinc/10/65/34/1029106534.db2.gz ORSOPCXOOSHBNL-NRFANRHFSA-N 1 1 340.442 3.782 20 10 EHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000729852399 1030976952 /nfs/dbraw/zinc/97/69/52/1030976952.db2.gz ZQTMYMGQCDZNCN-OAQYLSRUSA-N 1 1 334.419 3.904 20 10 EHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC(n2cnc3ccccc32)CC1 ZINC001142534788 1033345591 /nfs/dbraw/zinc/34/55/91/1033345591.db2.gz XBQCDVKQLCXWFA-UHFFFAOYSA-N 1 1 343.377 3.857 20 10 EHCDMO CCN(CCC[NH2+][C@@H](C)c1ccc(F)cc1O)C(=O)OC(C)(C)C ZINC000310081133 1034255797 /nfs/dbraw/zinc/25/57/97/1034255797.db2.gz WVDHCAVDBZOFAP-ZDUSSCGKSA-N 1 1 340.439 3.829 20 10 EHCDMO COCC[N@@H+](CCc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761192266 1034377007 /nfs/dbraw/zinc/37/70/07/1034377007.db2.gz IXJZLTVNVAAMER-UHFFFAOYSA-N 1 1 349.858 3.745 20 10 EHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC000761191804 1034384554 /nfs/dbraw/zinc/38/45/54/1034384554.db2.gz WHGWLMOSNJKBAY-UHFFFAOYSA-N 1 1 327.758 3.964 20 10 EHCDMO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccccc3OC)C2)c1O ZINC000164396263 1035537523 /nfs/dbraw/zinc/53/75/23/1035537523.db2.gz BIRYPAAQTHKLTA-HNNXBMFYSA-N 1 1 327.424 3.707 20 10 EHCDMO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000186113540 1035585446 /nfs/dbraw/zinc/58/54/46/1035585446.db2.gz ATNMATIGVHYOAU-STQMWFEESA-N 1 1 326.375 3.524 20 10 EHCDMO Oc1ccc(Cl)cc1C[NH2+]Cc1ncc(Br)s1 ZINC000714950585 1036101713 /nfs/dbraw/zinc/10/17/13/1036101713.db2.gz JCYNVRUPUCSNJH-UHFFFAOYSA-N 1 1 333.638 3.554 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@]3(CC(F)(F)C3(F)F)C1)CCC2 ZINC000905676787 1039036592 /nfs/dbraw/zinc/03/65/92/1039036592.db2.gz FTNSPNNYPUYQGL-HNNXBMFYSA-N 1 1 329.337 3.747 20 10 EHCDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cc3ccc(N)cc3)cc2)C1 ZINC000237675847 1039409336 /nfs/dbraw/zinc/40/93/36/1039409336.db2.gz JPFIPCWFRCLGAG-INIZCTEOSA-N 1 1 337.467 3.682 20 10 EHCDMO Oc1cccc2c1C[N@H+](Cc1cccc(F)c1Br)CC2 ZINC001137722410 1042305299 /nfs/dbraw/zinc/30/52/99/1042305299.db2.gz NFKHUYPNSHDRKR-UHFFFAOYSA-N 1 1 336.204 3.852 20 10 EHCDMO Oc1cccc2c1C[N@@H+](Cc1cccc(F)c1Br)CC2 ZINC001137722410 1042305304 /nfs/dbraw/zinc/30/53/04/1042305304.db2.gz NFKHUYPNSHDRKR-UHFFFAOYSA-N 1 1 336.204 3.852 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](c2ccccc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000278947638 1043069978 /nfs/dbraw/zinc/06/99/78/1043069978.db2.gz YZKGBIUODUFBHZ-QGZVFWFLSA-N 1 1 342.395 3.940 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c(C3CC3)nc3sccn23)cc1 ZINC000183376066 1125542898 /nfs/dbraw/zinc/54/28/98/1125542898.db2.gz JJCFMHXDESLMNF-UHFFFAOYSA-N 1 1 340.496 3.971 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3ccc(OC)c(Cl)c3)CC2)cc1 ZINC000764136381 1127448730 /nfs/dbraw/zinc/44/87/30/1127448730.db2.gz GIJHMOXPIGDQCV-UHFFFAOYSA-N 1 1 346.858 3.679 20 10 EHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)c1nncn1C ZINC000765747084 1127764423 /nfs/dbraw/zinc/76/44/23/1127764423.db2.gz BLAQFEWFKIGAEW-HZPDHXFCSA-N 1 1 327.476 3.607 20 10 EHCDMO C[C@H](CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[N@H+](C)C1CC1 ZINC000765807126 1128414309 /nfs/dbraw/zinc/41/43/09/1128414309.db2.gz XJGMOTHTOARAQK-CVEARBPZSA-N 1 1 333.495 3.949 20 10 EHCDMO C[C@H](CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[N@@H+](C)C1CC1 ZINC000765807126 1128414313 /nfs/dbraw/zinc/41/43/13/1128414313.db2.gz XJGMOTHTOARAQK-CVEARBPZSA-N 1 1 333.495 3.949 20 10 EHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)cc1OC ZINC000762120344 1121111081 /nfs/dbraw/zinc/11/10/81/1121111081.db2.gz OFJQIUKJEYQISN-UHFFFAOYSA-N 1 1 339.794 3.834 20 10 EHCDMO COc1cc(C[N@@H+](C)CCc2ccccn2)c(O)c(C(C)(C)C)c1 ZINC000915794425 1121628858 /nfs/dbraw/zinc/62/88/58/1121628858.db2.gz IMAJYSMHDJNYIX-UHFFFAOYSA-N 1 1 328.456 3.768 20 10 EHCDMO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000915827267 1121675959 /nfs/dbraw/zinc/67/59/59/1121675959.db2.gz DQAWANWXWBQCAK-UHFFFAOYSA-N 1 1 326.440 3.642 20 10 EHCDMO C[C@@H](CNCc1ccc(N2CCCCC2)cc1)C[NH+]1CCCCC1 ZINC000324485209 1121925879 /nfs/dbraw/zinc/92/58/79/1121925879.db2.gz NECCXBWAZBLALG-IBGZPJMESA-N 1 1 329.532 3.889 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2ccc(F)c(F)c2)cc1 ZINC000917019879 1122440145 /nfs/dbraw/zinc/44/01/45/1122440145.db2.gz KNLNFTSSTQNEHK-FQEVSTJZSA-N 1 1 348.437 3.976 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](CCO[C@H]3CCCC[C@@H]3C)CC2)cc1 ZINC000917088358 1122485142 /nfs/dbraw/zinc/48/51/42/1122485142.db2.gz RORKHKDQUNTYLY-RXVVDRJESA-N 1 1 346.515 3.803 20 10 EHCDMO Cc1ccc(N2CCC[N@@H+](Cc3c(O)ccc4ccncc43)CC2)cc1 ZINC000917485311 1122614921 /nfs/dbraw/zinc/61/49/21/1122614921.db2.gz OVTQNCPWKJSNDO-UHFFFAOYSA-N 1 1 347.462 3.961 20 10 EHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000179560155 1123796866 /nfs/dbraw/zinc/79/68/66/1123796866.db2.gz DMPLLXKVVHJQRB-IRXDYDNUSA-N 1 1 338.234 3.789 20 10 EHCDMO COc1ccc(O)c(C[N@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c1 ZINC000180339787 1123989008 /nfs/dbraw/zinc/98/90/08/1123989008.db2.gz CBPNWURUMQXCPQ-UHFFFAOYSA-N 1 1 343.267 3.718 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@H](C)CC23CC3)c(Br)c1 ZINC001237071758 1125261423 /nfs/dbraw/zinc/26/14/23/1125261423.db2.gz WZSHAGMYSFSJTM-SNVBAGLBSA-N 1 1 326.234 3.538 20 10 EHCDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000183082383 1125441799 /nfs/dbraw/zinc/44/17/99/1125441799.db2.gz WSMHNDUAXMRAIU-APWZRJJASA-N 1 1 341.451 3.707 20 10 EHCDMO O=C(C[N@H+](Cc1ccccc1O)C1CCCC1)NC1CCCCCC1 ZINC000731847863 1130849783 /nfs/dbraw/zinc/84/97/83/1130849783.db2.gz PTCRSDAGRUWDNI-UHFFFAOYSA-N 1 1 344.499 3.976 20 10 EHCDMO CCCCCC[N@@H+](C)CC(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000732278324 1130904944 /nfs/dbraw/zinc/90/49/44/1130904944.db2.gz IDPDHJKVGIFKBE-UHFFFAOYSA-N 1 1 345.531 3.805 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H](n4ccnc4)C3)c2c1 ZINC000738160746 1131463165 /nfs/dbraw/zinc/46/31/65/1131463165.db2.gz YVPYBRIWQPERPY-INIZCTEOSA-N 1 1 337.423 3.588 20 10 EHCDMO COC[C@H]1CC[N@@H+](CC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C1 ZINC000739920179 1131517115 /nfs/dbraw/zinc/51/71/15/1131517115.db2.gz KDYKMUOPWVTFLP-SFHVURJKSA-N 1 1 340.467 3.554 20 10 EHCDMO CCN(C)c1ccc(C[N@H+](C)CC(=O)Nc2ccc(C)cc2)cc1 ZINC000741753431 1131644219 /nfs/dbraw/zinc/64/42/19/1131644219.db2.gz YGZDGDZJILJASC-UHFFFAOYSA-N 1 1 325.456 3.522 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)CC(=O)Nc2ccc(C)cc2)cc1 ZINC000741753431 1131644221 /nfs/dbraw/zinc/64/42/21/1131644221.db2.gz YGZDGDZJILJASC-UHFFFAOYSA-N 1 1 325.456 3.522 20 10 EHCDMO CCN(C)c1ccc(CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1 ZINC001174993005 1132524222 /nfs/dbraw/zinc/52/42/22/1132524222.db2.gz DUSOMCRJGPEMNU-VXKWHMMOSA-N 1 1 335.495 3.601 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CN3Cc2ccccc2)cc1 ZINC001174993005 1132524226 /nfs/dbraw/zinc/52/42/26/1132524226.db2.gz DUSOMCRJGPEMNU-VXKWHMMOSA-N 1 1 335.495 3.601 20 10 EHCDMO CCN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CN3Cc2ccccc2)cc1 ZINC001174993005 1132524233 /nfs/dbraw/zinc/52/42/33/1132524233.db2.gz DUSOMCRJGPEMNU-VXKWHMMOSA-N 1 1 335.495 3.601 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(OC)cc(OC)c1 ZINC000768132734 1133100183 /nfs/dbraw/zinc/10/01/83/1133100183.db2.gz JIZSCIIKMWOPIZ-UHFFFAOYSA-N 1 1 328.456 3.792 20 10 EHCDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000768199022 1133107147 /nfs/dbraw/zinc/10/71/47/1133107147.db2.gz SPKLMRFJBURSQR-MRXNPFEDSA-N 1 1 328.431 3.855 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)[C@H](O)CO2 ZINC000768440925 1133139693 /nfs/dbraw/zinc/13/96/93/1133139693.db2.gz HUHGMJDTKWGKMS-SJLPKXTDSA-N 1 1 345.826 3.809 20 10 EHCDMO COc1cc(C[N@H+]2CCc3ccc(C(C)=O)cc3CC2)c(O)cc1C ZINC000768464988 1133144159 /nfs/dbraw/zinc/14/41/59/1133144159.db2.gz HLGXACKRWBQMML-UHFFFAOYSA-N 1 1 339.435 3.513 20 10 EHCDMO Cc1cc(C)n(-c2ccccc2C[NH2+]Cc2cc(F)cc(F)c2O)n1 ZINC001178172103 1133144406 /nfs/dbraw/zinc/14/44/06/1133144406.db2.gz XARFNQICZYDUQM-UHFFFAOYSA-N 1 1 343.377 3.763 20 10 EHCDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768466562 1133145172 /nfs/dbraw/zinc/14/51/72/1133145172.db2.gz SBMDZQYCIBNNFG-JLBUNGTFSA-N 1 1 343.398 3.540 20 10 EHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000768541319 1133153126 /nfs/dbraw/zinc/15/31/26/1133153126.db2.gz NHTMYSZTKXSIHA-ZDUSSCGKSA-N 1 1 327.852 3.693 20 10 EHCDMO CCC[C@@H](C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768915723 1133202474 /nfs/dbraw/zinc/20/24/74/1133202474.db2.gz MKQXZHRRLQGLLX-CZUORRHYSA-N 1 1 338.879 3.562 20 10 EHCDMO CCOc1ccc(O)c(C[N@@H+](C)C[C@H]2OCCc3ccccc32)c1 ZINC000769020227 1133214600 /nfs/dbraw/zinc/21/46/00/1133214600.db2.gz BGCPMHOYJRGKSP-HXUWFJFHSA-N 1 1 327.424 3.537 20 10 EHCDMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769120267 1133229486 /nfs/dbraw/zinc/22/94/86/1133229486.db2.gz JLFSFGPGBREDBK-HXUWFJFHSA-N 1 1 343.515 3.510 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c1 ZINC000769238699 1133249155 /nfs/dbraw/zinc/24/91/55/1133249155.db2.gz GRNIISQHOBDQEM-TZIWHRDSSA-N 1 1 341.451 3.879 20 10 EHCDMO CCOc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)c(O)c1 ZINC000769309235 1133258257 /nfs/dbraw/zinc/25/82/57/1133258257.db2.gz SWZBJLLKGUCDEO-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c(O)c1 ZINC000769309235 1133258262 /nfs/dbraw/zinc/25/82/62/1133258262.db2.gz SWZBJLLKGUCDEO-LJQANCHMSA-N 1 1 331.387 3.504 20 10 EHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000769447728 1133292798 /nfs/dbraw/zinc/29/27/98/1133292798.db2.gz JZCJQWOXZVJYPC-ZWNOBZJWSA-N 1 1 328.250 3.784 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000769544624 1133312322 /nfs/dbraw/zinc/31/23/22/1133312322.db2.gz ZKQPCPARKDNDHP-GOSISDBHSA-N 1 1 341.451 3.625 20 10 EHCDMO COc1ccccc1C[N@@H+](C)Cc1ccc(Br)cc1O ZINC001180497825 1133385868 /nfs/dbraw/zinc/38/58/68/1133385868.db2.gz VFQHLILMYOEDFT-UHFFFAOYSA-N 1 1 336.229 3.795 20 10 EHCDMO CCO[C@@H]1COCC[C@@H]1[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774349819 1133668659 /nfs/dbraw/zinc/66/86/59/1133668659.db2.gz VUASHNKVCSXVPG-ZDBHGNHJSA-N 1 1 334.243 3.544 20 10 EHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(C)c(Br)cc1O ZINC001250116925 1133824006 /nfs/dbraw/zinc/82/40/06/1133824006.db2.gz ILXKNFBDGSNBDV-UHFFFAOYSA-N 1 1 335.245 3.880 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cccc(C(F)(F)F)c1O ZINC000788694046 1134158198 /nfs/dbraw/zinc/15/81/98/1134158198.db2.gz UJUKWQNOPGYIGH-RYUDHWBXSA-N 1 1 345.361 3.747 20 10 EHCDMO COc1c(O)c(C[NH2+]C(C)(C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000775014924 1134212427 /nfs/dbraw/zinc/21/24/27/1134212427.db2.gz XLBIVHDKYJSSJD-UHFFFAOYSA-N 1 1 344.411 3.728 20 10 EHCDMO C[N@@H+](CCCCOC(C)(C)C)Cc1ccc(N2CCOCC2)cc1 ZINC000789304634 1134251363 /nfs/dbraw/zinc/25/13/63/1134251363.db2.gz CBFZZFNAZSXLAT-UHFFFAOYSA-N 1 1 334.504 3.550 20 10 EHCDMO c1n[nH]c2cc(CC[NH2+]Cc3ccc(N4CCCCC4)cc3)ccc12 ZINC000790620207 1134447174 /nfs/dbraw/zinc/44/71/74/1134447174.db2.gz XLBSRKLLRSZGAB-UHFFFAOYSA-N 1 1 334.467 3.886 20 10 EHCDMO COCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@H]1CC[C@@H](C)C1 ZINC000792193493 1134666611 /nfs/dbraw/zinc/66/66/11/1134666611.db2.gz XJZKGJJTQFUYPN-DOMZBBRYSA-N 1 1 327.852 3.691 20 10 EHCDMO CO[C@]1(C)CCC[N@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000793338919 1134907590 /nfs/dbraw/zinc/90/75/90/1134907590.db2.gz HPPBNIPFPSQFDM-MRXNPFEDSA-N 1 1 342.277 3.854 20 10 EHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000793338919 1134907595 /nfs/dbraw/zinc/90/75/95/1134907595.db2.gz HPPBNIPFPSQFDM-MRXNPFEDSA-N 1 1 342.277 3.854 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000793747517 1134988426 /nfs/dbraw/zinc/98/84/26/1134988426.db2.gz PXHMZEZHYKLYDD-MRXNPFEDSA-N 1 1 333.472 3.644 20 10 EHCDMO CCCc1nc(C)c(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)o1 ZINC000794289126 1135037267 /nfs/dbraw/zinc/03/72/67/1135037267.db2.gz RJRJNCFCPGEHAI-UHFFFAOYSA-N 1 1 343.471 3.656 20 10 EHCDMO COCCC1(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)CCCCC1 ZINC000775588638 1135122003 /nfs/dbraw/zinc/12/20/03/1135122003.db2.gz KTVLNIYSAHSXDY-OAHLLOKOSA-N 1 1 349.471 3.816 20 10 EHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1O ZINC000775646915 1135399484 /nfs/dbraw/zinc/39/94/84/1135399484.db2.gz QFBHPDOEVNUXIL-QGZVFWFLSA-N 1 1 325.408 3.809 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CNC(=O)C(C)C)C2)cc1C(C)C ZINC000101904754 1135418160 /nfs/dbraw/zinc/41/81/60/1135418160.db2.gz ROCIOIHEIFGKNF-QGZVFWFLSA-N 1 1 346.515 3.808 20 10 EHCDMO COc1cc(C[N@@H+]2CC[C@H](N3CCCC3)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191652 1135628312 /nfs/dbraw/zinc/62/83/12/1135628312.db2.gz OVOVJGHLORNFSJ-KXBFYZLASA-N 1 1 346.515 3.757 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](N3CCCC3)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000808191652 1135628316 /nfs/dbraw/zinc/62/83/16/1135628316.db2.gz OVOVJGHLORNFSJ-KXBFYZLASA-N 1 1 346.515 3.757 20 10 EHCDMO CC(C)[N@@H+](Cc1cnnn1-c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000808709454 1135717350 /nfs/dbraw/zinc/71/73/50/1135717350.db2.gz BORSCGNKDLWNMK-UHFFFAOYSA-N 1 1 349.482 3.744 20 10 EHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)CC1(SC)CC1 ZINC000809592779 1135859499 /nfs/dbraw/zinc/85/94/99/1135859499.db2.gz QCWMJVKMBKHQFY-UHFFFAOYSA-N 1 1 330.291 3.872 20 10 EHCDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1cc(-c2ccccc2)ccc1O ZINC000809697372 1135868444 /nfs/dbraw/zinc/86/84/44/1135868444.db2.gz FVTHHVNFLBRKKF-IEIALMLTSA-N 1 1 335.447 3.914 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000809764271 1135888929 /nfs/dbraw/zinc/88/89/29/1135888929.db2.gz VXBVZKGJLVMMET-UHFFFAOYSA-N 1 1 333.229 3.714 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000809764271 1135888931 /nfs/dbraw/zinc/88/89/31/1135888931.db2.gz VXBVZKGJLVMMET-UHFFFAOYSA-N 1 1 333.229 3.714 20 10 EHCDMO CC[C@H]([NH2+]Cc1nnc(C)s1)c1ccc(C(F)(F)F)cc1O ZINC000810234258 1135942494 /nfs/dbraw/zinc/94/24/94/1135942494.db2.gz BBBMXDCZYZKXAN-NSHDSACASA-N 1 1 331.363 3.812 20 10 EHCDMO COc1cc(C[NH2+]Cc2ccc3cncn3c2)c(O)c(C(C)(C)C)c1 ZINC000850323065 1136234944 /nfs/dbraw/zinc/23/49/44/1136234944.db2.gz BXTQDMWHQQXDNA-UHFFFAOYSA-N 1 1 339.439 3.636 20 10 EHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@](CO)(Cc3ccccc3)C2)cc1 ZINC000812780283 1136246379 /nfs/dbraw/zinc/24/63/79/1136246379.db2.gz YTIGEBFDRRSCQR-QFIPXVFZSA-N 1 1 338.495 3.570 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2CCc3ccc(O)cc32)c1 ZINC000850386619 1136247278 /nfs/dbraw/zinc/24/72/78/1136247278.db2.gz KELAUWGYYRGRFP-MRXNPFEDSA-N 1 1 348.240 3.946 20 10 EHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850845 1136261346 /nfs/dbraw/zinc/26/13/46/1136261346.db2.gz YNHXTMXTWDRZLO-DJJJIMSYSA-N 1 1 345.414 3.678 20 10 EHCDMO CCOCc1cc(CNC[C@]2([NH+](C)C)CCC[C@H](C)C2)ccc1OC ZINC000747854035 1136326571 /nfs/dbraw/zinc/32/65/71/1136326571.db2.gz LLDBLHCMBAAWDO-UWJYYQICSA-N 1 1 348.531 3.832 20 10 EHCDMO CC[C@@H](CC(F)F)C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000851733336 1136402294 /nfs/dbraw/zinc/40/22/94/1136402294.db2.gz RPQFWDKBJIEXGW-HNNXBMFYSA-N 1 1 326.431 3.889 20 10 EHCDMO Cc1cccc(C[N@H+]2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1O ZINC000814177312 1136411738 /nfs/dbraw/zinc/41/17/38/1136411738.db2.gz ZLPFVCDELKVSNT-RDJZCZTQSA-N 1 1 346.471 3.532 20 10 EHCDMO CSC[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000814179035 1136411774 /nfs/dbraw/zinc/41/17/74/1136411774.db2.gz NTIAQMDWPYMSKR-LLVKDONJSA-N 1 1 330.291 3.730 20 10 EHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000814179035 1136411779 /nfs/dbraw/zinc/41/17/79/1136411779.db2.gz NTIAQMDWPYMSKR-LLVKDONJSA-N 1 1 330.291 3.730 20 10 EHCDMO COCC(C)(C)[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000814178492 1136411924 /nfs/dbraw/zinc/41/19/24/1136411924.db2.gz RWIWZCPFFIGEGG-UHFFFAOYSA-N 1 1 329.440 3.828 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C(=O)NC(C)C)C2)cc1C(C)C ZINC000853601140 1136548167 /nfs/dbraw/zinc/54/81/67/1136548167.db2.gz FAGZJZRKMBWUHQ-MRXNPFEDSA-N 1 1 332.488 3.561 20 10 EHCDMO CC[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)N1CCCC1 ZINC000815559109 1136610677 /nfs/dbraw/zinc/61/06/77/1136610677.db2.gz XXYVFKXDBZHGAX-STQMWFEESA-N 1 1 330.394 3.936 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc(C(F)(F)F)c1O ZINC000815586588 1136615191 /nfs/dbraw/zinc/61/51/91/1136615191.db2.gz MOOYHIPQBCSUGL-TZMCWYRMSA-N 1 1 339.357 3.838 20 10 EHCDMO CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815632248 1136622053 /nfs/dbraw/zinc/62/20/53/1136622053.db2.gz HXTFAUFLQGIJAS-NWDGAFQWSA-N 1 1 346.393 3.614 20 10 EHCDMO CO[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(F)(F)F ZINC000815605364 1136622264 /nfs/dbraw/zinc/62/22/64/1136622264.db2.gz RYKUSFDKFHGDAX-GMSGAONNSA-N 1 1 331.256 3.639 20 10 EHCDMO CO[C@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(F)(F)F ZINC000815605365 1136622510 /nfs/dbraw/zinc/62/25/10/1136622510.db2.gz RYKUSFDKFHGDAX-OIBJUYFYSA-N 1 1 331.256 3.639 20 10 EHCDMO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@H](C(F)(F)F)O1 ZINC000816515791 1136730250 /nfs/dbraw/zinc/73/02/50/1136730250.db2.gz KZDSWEDSASHTOF-IAQYHMDHSA-N 1 1 325.330 3.697 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C[C@H](C(F)(F)F)O1 ZINC000816515791 1136730251 /nfs/dbraw/zinc/73/02/51/1136730251.db2.gz KZDSWEDSASHTOF-IAQYHMDHSA-N 1 1 325.330 3.697 20 10 EHCDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816550499 1136733265 /nfs/dbraw/zinc/73/32/65/1136733265.db2.gz SJCRYTHEYUQZMH-AWEZNQCLSA-N 1 1 337.778 3.807 20 10 EHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554471 1136735942 /nfs/dbraw/zinc/73/59/42/1136735942.db2.gz ZMGZAGUMQRWXKO-HNNXBMFYSA-N 1 1 337.778 3.807 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000816558737 1136736725 /nfs/dbraw/zinc/73/67/25/1136736725.db2.gz JYSFAWFJVULQNN-XZJROXQQSA-N 1 1 325.811 3.622 20 10 EHCDMO CCc1nocc1C[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000816652867 1136744695 /nfs/dbraw/zinc/74/46/95/1136744695.db2.gz XEEAOUMMKFRREX-UHFFFAOYSA-N 1 1 341.377 3.954 20 10 EHCDMO CCc1nocc1C[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000816652867 1136744699 /nfs/dbraw/zinc/74/46/99/1136744699.db2.gz XEEAOUMMKFRREX-UHFFFAOYSA-N 1 1 341.377 3.954 20 10 EHCDMO CCCN1C[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)CC1=O ZINC000817588978 1136827199 /nfs/dbraw/zinc/82/71/99/1136827199.db2.gz KMDPMGJMVOYHPX-QWRGUYRKSA-N 1 1 345.270 3.608 20 10 EHCDMO CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCSc3ccccc32)cc1 ZINC000817938664 1136847264 /nfs/dbraw/zinc/84/72/64/1136847264.db2.gz PBLXSQLSYKMEIY-QZTJIDSGSA-N 1 1 327.497 3.579 20 10 EHCDMO CN(C)c1ccc([C@@H]([NH3+])CN[C@@H]2CCSc3ccccc32)cc1 ZINC000817938666 1136847463 /nfs/dbraw/zinc/84/74/63/1136847463.db2.gz PBLXSQLSYKMEIY-ZWKOTPCHSA-N 1 1 327.497 3.579 20 10 EHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc(F)c(F)c(F)c1 ZINC000817938113 1136847473 /nfs/dbraw/zinc/84/74/73/1136847473.db2.gz DUPQJZCQCSOLFR-DIFFPNOSSA-N 1 1 337.389 3.521 20 10 EHCDMO COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000817938480 1136847483 /nfs/dbraw/zinc/84/74/83/1136847483.db2.gz LDVGIIVWNIGIFU-UGSOOPFHSA-N 1 1 347.890 3.765 20 10 EHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000817938554 1136847784 /nfs/dbraw/zinc/84/77/84/1136847784.db2.gz MXAQCSBBFYEKMT-SCLBCKFNSA-N 1 1 349.425 3.705 20 10 EHCDMO CCOc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938485 1136847954 /nfs/dbraw/zinc/84/79/54/1136847954.db2.gz LGOUQTGZGTWRSS-FOIQADDNSA-N 1 1 327.472 3.502 20 10 EHCDMO CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947140 1136850305 /nfs/dbraw/zinc/85/03/05/1136850305.db2.gz LFQCSCJGHXGQFZ-HUBLWGQQSA-N 1 1 330.394 3.840 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966465 1136853227 /nfs/dbraw/zinc/85/32/27/1136853227.db2.gz OJPBQIHOUUUDBW-ZBFHGGJFSA-N 1 1 330.394 3.841 20 10 EHCDMO CCc1cccc(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1O ZINC000858021651 1136932898 /nfs/dbraw/zinc/93/28/98/1136932898.db2.gz ZVKMEHLMZAEVBH-LJQANCHMSA-N 1 1 338.451 3.880 20 10 EHCDMO CCc1cc(C[N@H+]2CCC[C@H](n3ccnn3)C2)c(O)c(C(C)(C)C)c1 ZINC000819898209 1136965167 /nfs/dbraw/zinc/96/51/67/1136965167.db2.gz VXKXGSQIRJUMTM-KRWDZBQOSA-N 1 1 342.487 3.681 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Br)cc1[O-] ZINC000858490632 1136972862 /nfs/dbraw/zinc/97/28/62/1136972862.db2.gz KYTLAIRDMZHSPK-STQMWFEESA-N 1 1 341.293 3.537 20 10 EHCDMO CCOc1ccc(O)c(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c1 ZINC000822529997 1137062628 /nfs/dbraw/zinc/06/26/28/1137062628.db2.gz MZVIUUWAKDMIJB-LJQANCHMSA-N 1 1 331.456 3.572 20 10 EHCDMO C[N@@H+](CCSc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000118000228 1137092808 /nfs/dbraw/zinc/09/28/08/1137092808.db2.gz IKUQJXMEXNIMJW-UHFFFAOYSA-N 1 1 342.508 3.747 20 10 EHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(O[C@@H]3CCOC3)cc2)cc1 ZINC000824474291 1137138824 /nfs/dbraw/zinc/13/88/24/1137138824.db2.gz MIRABSRHQMZYBV-OAQYLSRUSA-N 1 1 340.467 3.552 20 10 EHCDMO COc1c(O)c(C[NH2+]CC[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000824548907 1137142661 /nfs/dbraw/zinc/14/26/61/1137142661.db2.gz PZIOCAAOLDLVHK-AWEZNQCLSA-N 1 1 342.395 3.519 20 10 EHCDMO COc1c(O)c(C[NH2+]CC[C@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000824548908 1137142686 /nfs/dbraw/zinc/14/26/86/1137142686.db2.gz PZIOCAAOLDLVHK-CQSZACIVSA-N 1 1 342.395 3.519 20 10 EHCDMO C[C@@H]1C[NH+](Cc2cccc(Br)c2O)C[C@@H](C)C1(F)F ZINC000862442270 1137145062 /nfs/dbraw/zinc/14/50/62/1137145062.db2.gz HISZSEPWPFLSES-NXEZZACHSA-N 1 1 334.204 3.878 20 10 EHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1O ZINC000824820273 1137153897 /nfs/dbraw/zinc/15/38/97/1137153897.db2.gz COLZKOZHKGCFIB-OAHLLOKOSA-N 1 1 342.395 3.689 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@]3(CCSC3)C2)c1O ZINC000825215786 1137169241 /nfs/dbraw/zinc/16/92/41/1137169241.db2.gz WCIDYQAWYLPITA-INIZCTEOSA-N 1 1 327.877 3.773 20 10 EHCDMO OCCC[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000825336973 1137173276 /nfs/dbraw/zinc/17/32/76/1137173276.db2.gz BLVHXYLUSKBHHV-QGZVFWFLSA-N 1 1 341.451 3.566 20 10 EHCDMO OCCC[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000825336972 1137173467 /nfs/dbraw/zinc/17/34/67/1137173467.db2.gz BLVHXYLUSKBHHV-KRWDZBQOSA-N 1 1 341.451 3.566 20 10 EHCDMO C[N@@H+](Cc1ccnc(NC(=O)OC(C)(C)C)c1)Cc1ccccc1O ZINC001143697812 1137190406 /nfs/dbraw/zinc/19/04/06/1137190406.db2.gz ZHACZYPUBLMODH-UHFFFAOYSA-N 1 1 343.427 3.766 20 10 EHCDMO COc1cc(O)c(C[N@H+]2CCc3ccccc3[C@H](C)C2)cc1OC ZINC000844741673 1137248936 /nfs/dbraw/zinc/24/89/36/1137248936.db2.gz KYJLHDDCTUMWKL-CQSZACIVSA-N 1 1 327.424 3.571 20 10 EHCDMO CC[N@H+](Cc1ccncc1)Cc1cc(Br)c(F)cc1O ZINC001144298436 1137268428 /nfs/dbraw/zinc/26/84/28/1137268428.db2.gz DKKBMTYETZOOEE-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(Br)c(F)cc1O ZINC001144298436 1137268429 /nfs/dbraw/zinc/26/84/29/1137268429.db2.gz DKKBMTYETZOOEE-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)c(O)c1 ZINC001144515025 1137304412 /nfs/dbraw/zinc/30/44/12/1137304412.db2.gz BPUZHSBZALEKLV-OAHLLOKOSA-N 1 1 349.814 3.500 20 10 EHCDMO C[C@@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1ccc(Cl)cc1O ZINC000846180488 1137339744 /nfs/dbraw/zinc/33/97/44/1137339744.db2.gz KYPKATVIHCZPQT-YJYMSZOUSA-N 1 1 331.843 3.573 20 10 EHCDMO CC[C@@H]([NH2+]Cc1ccc(Br)cn1)c1ccc(F)cc1O ZINC000866569586 1137365831 /nfs/dbraw/zinc/36/58/31/1137365831.db2.gz YHANIIWFNMMKMD-CQSZACIVSA-N 1 1 339.208 3.930 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCCn2nccc21)c1cccc(C(F)(F)F)c1O ZINC000866633520 1137371400 /nfs/dbraw/zinc/37/14/00/1137371400.db2.gz JEHRSWZVVNKSPP-ZWNOBZJWSA-N 1 1 325.334 3.793 20 10 EHCDMO C[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1n1ccnc1 ZINC000121731107 1137383431 /nfs/dbraw/zinc/38/34/31/1137383431.db2.gz NVHYJTXVSKPKGO-YOEHRIQHSA-N 1 1 343.471 3.675 20 10 EHCDMO C[C@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccoc1 ZINC000773146137 1137469881 /nfs/dbraw/zinc/46/98/81/1137469881.db2.gz ORRKTBDBICVBII-KRWDZBQOSA-N 1 1 339.483 3.662 20 10 EHCDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]2CCCC[C@@H]12 ZINC001171810028 1137514206 /nfs/dbraw/zinc/51/42/06/1137514206.db2.gz MLYHIPOPJTYYHT-NLWGTHIKSA-N 1 1 344.499 3.615 20 10 EHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872280052 1137577526 /nfs/dbraw/zinc/57/75/26/1137577526.db2.gz IUUMIAPRSSDTDD-KRWDZBQOSA-N 1 1 335.419 3.658 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCCN(c3ncccc3F)CC2)cc1Cl ZINC000825634023 1137585965 /nfs/dbraw/zinc/58/59/65/1137585965.db2.gz HCKKABQGYMXQAA-UHFFFAOYSA-N 1 1 349.837 3.600 20 10 EHCDMO COc1ccc(N2CCC([NH2+][C@@H](CCN(C)C)C(C)(C)C)CC2)cc1 ZINC000125919159 1137650076 /nfs/dbraw/zinc/65/00/76/1137650076.db2.gz LJPUKTFLKVQTNW-FQEVSTJZSA-N 1 1 347.547 3.620 20 10 EHCDMO OC1CCN(c2ccc(C[N@@H+](C3CC3)C3CCCCC3)cc2)CC1 ZINC000876581862 1137656246 /nfs/dbraw/zinc/65/62/46/1137656246.db2.gz FYXDGWUYWYJYMO-UHFFFAOYSA-N 1 1 328.500 3.945 20 10 EHCDMO COCCc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000876721574 1137659737 /nfs/dbraw/zinc/65/97/37/1137659737.db2.gz JONUSWRCJWRILL-UHFFFAOYSA-N 1 1 346.496 3.982 20 10 EHCDMO OC1CCN(c2ccc(CNc3cccc4cc[nH+]cc43)cc2)CC1 ZINC000877161189 1137671827 /nfs/dbraw/zinc/67/18/27/1137671827.db2.gz GUMYUFGSMDBGEW-UHFFFAOYSA-N 1 1 333.435 3.808 20 10 EHCDMO [O-]c1c(F)c(F)ccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000877485408 1137678089 /nfs/dbraw/zinc/67/80/89/1137678089.db2.gz SOOWVJICIQJRDG-UHFFFAOYSA-N 1 1 347.409 3.583 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](OCc3ccccn3)C2)cc1Cl ZINC000877645481 1137684169 /nfs/dbraw/zinc/68/41/69/1137684169.db2.gz MOGJUKSNYDXQHR-INIZCTEOSA-N 1 1 332.831 3.540 20 10 EHCDMO CCOc1cccc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000130643719 1137840381 /nfs/dbraw/zinc/84/03/81/1137840381.db2.gz JCAWWHBAXURWTP-KXBFYZLASA-N 1 1 327.424 3.753 20 10 EHCDMO Cc1sc2[nH]c([C@@H](C)[N@H+](C)Cc3ccccc3O)nc(=O)c2c1C ZINC000109772204 1137897366 /nfs/dbraw/zinc/89/73/66/1137897366.db2.gz OXHYBZSVYSWVGO-LLVKDONJSA-N 1 1 343.452 3.500 20 10 EHCDMO Cc1sc2[nH]c([C@@H](C)[N@@H+](C)Cc3ccccc3O)nc(=O)c2c1C ZINC000109772204 1137897367 /nfs/dbraw/zinc/89/73/67/1137897367.db2.gz OXHYBZSVYSWVGO-LLVKDONJSA-N 1 1 343.452 3.500 20 10 EHCDMO CCN(CC)C(=O)c1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886498669 1138083812 /nfs/dbraw/zinc/08/38/12/1138083812.db2.gz LFOYIHOIUVVHRR-AWEZNQCLSA-N 1 1 344.430 3.864 20 10 EHCDMO COc1cc([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cc(OC)c1OC ZINC000886504136 1138085118 /nfs/dbraw/zinc/08/51/18/1138085118.db2.gz SPIRTBBKVDPJSN-NEPJUHHUSA-N 1 1 349.402 3.969 20 10 EHCDMO C[C@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1c(O)cccc1F ZINC000886505011 1138085186 /nfs/dbraw/zinc/08/51/86/1138085186.db2.gz DVYULMFJNVMSGI-WMLDXEAASA-N 1 1 342.414 3.546 20 10 EHCDMO COc1sc(C[N@@H+](C)Cc2ccccc2O)cc1Br ZINC000091956623 1138223548 /nfs/dbraw/zinc/22/35/48/1138223548.db2.gz YZSJRSQFYRLJNM-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO CCOc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)c1O ZINC000092975195 1138233449 /nfs/dbraw/zinc/23/34/49/1138233449.db2.gz AFRVNYSDOVBRHC-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c1O ZINC000092975195 1138233452 /nfs/dbraw/zinc/23/34/52/1138233452.db2.gz AFRVNYSDOVBRHC-GOSISDBHSA-N 1 1 331.387 3.504 20 10 EHCDMO CC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)Cc1ccccn1 ZINC000264284142 1138464071 /nfs/dbraw/zinc/46/40/71/1138464071.db2.gz PMDLWRHCBNLKBZ-UHFFFAOYSA-N 1 1 339.483 3.719 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462383 1139091815 /nfs/dbraw/zinc/09/18/15/1139091815.db2.gz KERLKKFVTIQCGY-ROUUACIJSA-N 1 1 327.516 3.812 20 10 EHCDMO CCN(CC)C(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000184958203 1140127814 /nfs/dbraw/zinc/12/78/14/1140127814.db2.gz CEJNBXAWTBVVJC-AWEZNQCLSA-N 1 1 344.430 3.864 20 10 EHCDMO C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184997958 1140130348 /nfs/dbraw/zinc/13/03/48/1140130348.db2.gz HISYGRXWWTZMRS-WDEREUQCSA-N 1 1 329.271 3.834 20 10 EHCDMO COc1cccc(N2CC[C@@H](C[NH2+][C@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185312390 1140144365 /nfs/dbraw/zinc/14/43/65/1140144365.db2.gz WFSLNGQUABXDQX-CABCVRRESA-N 1 1 344.430 3.717 20 10 EHCDMO C[C@@H](OC[C@H](O)C[N@@H+](C)Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000269618400 1141128759 /nfs/dbraw/zinc/12/87/59/1141128759.db2.gz HIMVCSPJNHIHHR-RDTXWAMCSA-N 1 1 349.858 3.616 20 10 EHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@]2(CCOC2)C1 ZINC000183113448 1032134182 /nfs/dbraw/zinc/13/41/82/1032134182.db2.gz RZCZXOVMNVNULR-NRFANRHFSA-N 1 1 339.435 3.584 20 10 EHCDMO COCC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)[C@@H]1CCOC1 ZINC000782959959 1016860257 /nfs/dbraw/zinc/86/02/57/1016860257.db2.gz DTPVIBNABQKBQR-OAHLLOKOSA-N 1 1 341.407 3.529 20 10 EHCDMO C[C@H](N[C@@H](c1nccn1C)c1cccc(F)c1)c1ccc(F)cc1[O-] ZINC000184959509 1032346673 /nfs/dbraw/zinc/34/66/73/1032346673.db2.gz INDUUJQCBVOZPF-KPZWWZAWSA-N 1 1 343.377 3.844 20 10 EHCDMO COc1cc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c(O)cc1C ZINC000160300129 1017204615 /nfs/dbraw/zinc/20/46/15/1017204615.db2.gz IYNUCPIRJQANRN-SFHVURJKSA-N 1 1 341.451 3.748 20 10 EHCDMO COc1ccc(N2C[C@H]3CC[C@@H](C2)[N@@H+]3CCCC(F)(F)F)cc1 ZINC001279729820 1017396987 /nfs/dbraw/zinc/39/69/87/1017396987.db2.gz YYZKEOUKUHMXQH-GASCZTMLSA-N 1 1 328.378 3.691 20 10 EHCDMO C[C@H](O)CC[N@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255320946 1021085134 /nfs/dbraw/zinc/08/51/34/1021085134.db2.gz XAKYAAXTEHRCOT-HNNXBMFYSA-N 1 1 340.427 3.743 20 10 EHCDMO C[C@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255320946 1021085138 /nfs/dbraw/zinc/08/51/38/1021085138.db2.gz XAKYAAXTEHRCOT-HNNXBMFYSA-N 1 1 340.427 3.743 20 10 EHCDMO COc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c(O)c1OC ZINC000891441018 1021220221 /nfs/dbraw/zinc/22/02/21/1021220221.db2.gz QUHBEFVGSJVEFF-QGZVFWFLSA-N 1 1 342.439 3.922 20 10 EHCDMO CO[C@@H]1C[C@H]([NH2+]Cc2cc(C)cc(Br)c2O)C12CCC2 ZINC000839182940 1021743669 /nfs/dbraw/zinc/74/36/69/1021743669.db2.gz SAGOHCLSGWAOKT-UONOGXRCSA-N 1 1 340.261 3.510 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000277044965 1023720365 /nfs/dbraw/zinc/72/03/65/1023720365.db2.gz OFTHDNYNAHWEBA-UHFFFAOYSA-N 1 1 345.414 3.721 20 10 EHCDMO COc1cc(O)c(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cc1OC ZINC000160223933 1024599695 /nfs/dbraw/zinc/59/96/95/1024599695.db2.gz BCCHLPJNBAPYPP-DZGCQCFKSA-N 1 1 345.414 3.927 20 10 EHCDMO COC1(c2ccccc2)CC[NH+](Cc2cc(F)c(F)cc2O)CC1 ZINC001142527137 1033272354 /nfs/dbraw/zinc/27/23/54/1033272354.db2.gz LZFMLWIZCYGEIM-UHFFFAOYSA-N 1 1 333.378 3.808 20 10 EHCDMO CC[C@H]([NH2+]CCCC[NH+](C)C)c1cc(Br)ccc1[O-] ZINC000045663483 1026176373 /nfs/dbraw/zinc/17/63/73/1026176373.db2.gz RTBAOSXAJISQBB-AWEZNQCLSA-N 1 1 329.282 3.537 20 10 EHCDMO C[NH+](C)CCCOc1ccc(C[NH2+]Cc2c([O-])cccc2Cl)cc1 ZINC000113335136 1026549820 /nfs/dbraw/zinc/54/98/20/1026549820.db2.gz YRZBVGVCHONAHD-UHFFFAOYSA-N 1 1 348.874 3.666 20 10 EHCDMO CN(Cc1ccc(N2CCOCC2)cc1)c1cc[nH+]c2ccsc21 ZINC000301358287 1026774958 /nfs/dbraw/zinc/77/49/58/1026774958.db2.gz MXQGANOZABNAOF-UHFFFAOYSA-N 1 1 339.464 3.769 20 10 EHCDMO CC[C@@H]([NH2+][C@H]1CCN(c2ccc(F)cc2)C1=O)c1ccc(F)cc1O ZINC000840881224 1027091894 /nfs/dbraw/zinc/09/18/94/1027091894.db2.gz GHQXAYCXYYIGCT-SJORKVTESA-N 1 1 346.377 3.517 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000273417050 1027417493 /nfs/dbraw/zinc/41/74/93/1027417493.db2.gz RAKPZZSOACXVRW-WDEREUQCSA-N 1 1 335.350 3.869 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2OC)c1 ZINC000273430209 1027422640 /nfs/dbraw/zinc/42/26/40/1027422640.db2.gz VIGWRBKODPIFCY-OLZOCXBDSA-N 1 1 329.396 3.599 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000273437291 1027425039 /nfs/dbraw/zinc/42/50/39/1027425039.db2.gz MFXWBSKPSJTHEW-QLFBSQMISA-N 1 1 347.459 3.604 20 10 EHCDMO COC(=O)N1CCC([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)CC1 ZINC000278225052 1029728345 /nfs/dbraw/zinc/72/83/45/1029728345.db2.gz JOCNEZYDJCXKQF-SECBINFHSA-N 1 1 347.242 3.580 20 10 EHCDMO Cc1nc(C2([NH2+]Cc3c(O)ccc4ccncc43)CCCCC2)no1 ZINC000729849459 1030783493 /nfs/dbraw/zinc/78/34/93/1030783493.db2.gz KPQDFEVWCHLXNA-UHFFFAOYSA-N 1 1 338.411 3.581 20 10 EHCDMO COc1c(O)c(C[NH2+]Cc2ccc(C(F)F)cc2)ccc1[N+](=O)[O-] ZINC000278521255 1031213108 /nfs/dbraw/zinc/21/31/08/1031213108.db2.gz RZNRDJBKXLMCPC-UHFFFAOYSA-N 1 1 338.310 3.536 20 10 EHCDMO COc1ccc(N2CCC[N@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000179267198 1031761768 /nfs/dbraw/zinc/76/17/68/1031761768.db2.gz LOJGUPZOMZGNDC-UHFFFAOYSA-N 1 1 343.496 3.741 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000179267198 1031761781 /nfs/dbraw/zinc/76/17/81/1031761781.db2.gz LOJGUPZOMZGNDC-UHFFFAOYSA-N 1 1 343.496 3.741 20 10 EHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCCN(c2ccc(F)cc2)CC1 ZINC001142530343 1033327673 /nfs/dbraw/zinc/32/76/73/1033327673.db2.gz FDFJLSWCZFBYNB-UHFFFAOYSA-N 1 1 336.357 3.522 20 10 EHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCCN(c2ccc(F)cc2)CC1 ZINC001142530343 1033327689 /nfs/dbraw/zinc/32/76/89/1033327689.db2.gz FDFJLSWCZFBYNB-UHFFFAOYSA-N 1 1 336.357 3.522 20 10 EHCDMO COCCC1CC[NH+](Cc2cc(C)cc(Br)c2O)CC1 ZINC000529637253 1034323562 /nfs/dbraw/zinc/32/35/62/1034323562.db2.gz AADCLBUDFPFVCL-UHFFFAOYSA-N 1 1 342.277 3.712 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000029891472 1037415885 /nfs/dbraw/zinc/41/58/85/1037415885.db2.gz JOTMEIDZQZPWBG-IBGZPJMESA-N 1 1 341.451 3.969 20 10 EHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000029891472 1037415888 /nfs/dbraw/zinc/41/58/88/1037415888.db2.gz JOTMEIDZQZPWBG-IBGZPJMESA-N 1 1 341.451 3.969 20 10 EHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000180272903 1038111368 /nfs/dbraw/zinc/11/13/68/1038111368.db2.gz VNBPUUSLWKSERT-AEFFLSMTSA-N 1 1 333.403 3.993 20 10 EHCDMO O=C(CC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 ZINC000182650755 1038622854 /nfs/dbraw/zinc/62/28/54/1038622854.db2.gz AVGDPZWOSDQSNX-IBGZPJMESA-N 1 1 339.435 3.646 20 10 EHCDMO COc1ccc(CCC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1OC ZINC000185147346 1039028721 /nfs/dbraw/zinc/02/87/21/1039028721.db2.gz VJBIDSXATWFCKB-ZDUSSCGKSA-N 1 1 333.403 3.832 20 10 EHCDMO COc1cccc(N2CCC[C@H]([NH2+][C@@H](C)c3ccc(F)cc3O)C2)c1 ZINC000185480974 1039119861 /nfs/dbraw/zinc/11/98/61/1039119861.db2.gz PNBQRFVHAWFNNZ-HOCLYGCPSA-N 1 1 344.430 3.860 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1C ZINC000186953253 1039499419 /nfs/dbraw/zinc/49/94/19/1039499419.db2.gz SBXRCXFKNRGQCF-LJQANCHMSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1C ZINC000186953253 1039499434 /nfs/dbraw/zinc/49/94/34/1039499434.db2.gz SBXRCXFKNRGQCF-LJQANCHMSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cccc(C[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1O ZINC000364098687 1039738166 /nfs/dbraw/zinc/73/81/66/1039738166.db2.gz FOGWELFTZBGEBF-SFHVURJKSA-N 1 1 341.842 3.967 20 10 EHCDMO Oc1c(Br)cccc1C[NH2+]Cc1nccc2ccccc21 ZINC000728782502 1040417003 /nfs/dbraw/zinc/41/70/03/1040417003.db2.gz RWORYUUGIMQCPU-UHFFFAOYSA-N 1 1 343.224 3.993 20 10 EHCDMO C[N@@H+](Cc1cccnc1)Cc1ccc(OCc2ccccc2)cc1O ZINC000183660528 1125667759 /nfs/dbraw/zinc/66/77/59/1125667759.db2.gz OSGAIXMHHXZZAL-UHFFFAOYSA-N 1 1 334.419 3.998 20 10 EHCDMO C[C@@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000184967812 1126723851 /nfs/dbraw/zinc/72/38/51/1126723851.db2.gz VLIGYLZUSCUKOJ-CQSZACIVSA-N 1 1 325.387 3.610 20 10 EHCDMO C[C@H]([NH2+]CCOCC1CCC1)c1cc(Br)c(F)cc1O ZINC000765805909 1128410759 /nfs/dbraw/zinc/41/07/59/1128410759.db2.gz ALGKRXPAQMYWAZ-JTQLQIEISA-N 1 1 346.240 3.761 20 10 EHCDMO CN(C)Cc1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)ccc1F ZINC000921745863 1128723528 /nfs/dbraw/zinc/72/35/28/1128723528.db2.gz QMGGIZAXGIXUHJ-UHFFFAOYSA-N 1 1 328.431 3.502 20 10 EHCDMO Cc1cccc(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075165 1122472539 /nfs/dbraw/zinc/47/25/39/1122472539.db2.gz RCCNAVZPBKNPQV-UHFFFAOYSA-N 1 1 339.483 3.910 20 10 EHCDMO CC(C)[N@@H+](CCCOCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000919770604 1123147606 /nfs/dbraw/zinc/14/76/06/1123147606.db2.gz LFPUAOIWEILMKL-UHFFFAOYSA-N 1 1 332.410 3.932 20 10 EHCDMO CC[N@@H+](CCOC)Cc1c(O)ccc2cc(Br)ccc21 ZINC000921046124 1123458819 /nfs/dbraw/zinc/45/88/19/1123458819.db2.gz IWFFPPZVUNPIFX-UHFFFAOYSA-N 1 1 338.245 3.776 20 10 EHCDMO Oc1ccc(Br)cc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000069877018 1125088734 /nfs/dbraw/zinc/08/87/34/1125088734.db2.gz MWYWMSMSSGCFGJ-UHFFFAOYSA-N 1 1 339.258 3.778 20 10 EHCDMO CCCC[N@@H+](CCCCCS(=O)(=O)CC)Cc1ccccc1O ZINC000282407845 1129706946 /nfs/dbraw/zinc/70/69/46/1129706946.db2.gz IIEGMPDFRBVRTP-UHFFFAOYSA-N 1 1 341.517 3.599 20 10 EHCDMO CCc1cc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)on1 ZINC000766134733 1130382610 /nfs/dbraw/zinc/38/26/10/1130382610.db2.gz HHDOGJXIJHCWIM-CYBMUJFWSA-N 1 1 349.862 3.578 20 10 EHCDMO COC[C@@H](C)[N@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137839162 1130566716 /nfs/dbraw/zinc/56/67/16/1130566716.db2.gz UIRTZRVDYCIMCZ-CQSZACIVSA-N 1 1 333.403 3.577 20 10 EHCDMO COC[C@@H](C)[N@@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137839162 1130566721 /nfs/dbraw/zinc/56/67/21/1130566721.db2.gz UIRTZRVDYCIMCZ-CQSZACIVSA-N 1 1 333.403 3.577 20 10 EHCDMO CCOc1nnc(C[N@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000731848343 1130850391 /nfs/dbraw/zinc/85/03/91/1130850391.db2.gz WWDVJONLCFSVER-UHFFFAOYSA-N 1 1 333.457 3.587 20 10 EHCDMO CCOc1nnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000731848343 1130850401 /nfs/dbraw/zinc/85/04/01/1130850401.db2.gz WWDVJONLCFSVER-UHFFFAOYSA-N 1 1 333.457 3.587 20 10 EHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)C3=CC(=O)CS3)cc2)C1 ZINC000731869236 1130856802 /nfs/dbraw/zinc/85/68/02/1130856802.db2.gz CVADYODPGBKCIA-CQSZACIVSA-N 1 1 344.480 3.616 20 10 EHCDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000738056417 1131461778 /nfs/dbraw/zinc/46/17/78/1131461778.db2.gz POHFOSQFIILJAI-CABCVRRESA-N 1 1 325.408 3.807 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)C(=O)N(C(C)C)C(C)C)cc1 ZINC000741678522 1131634492 /nfs/dbraw/zinc/63/44/92/1131634492.db2.gz SOSQOBSXFQACEI-GOSISDBHSA-N 1 1 347.547 3.999 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)NC2CCCCCC2)cc1 ZINC000741677977 1131634912 /nfs/dbraw/zinc/63/49/12/1131634912.db2.gz GRFMWWRKJCKINZ-UHFFFAOYSA-N 1 1 345.531 3.804 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)NC2CCCCCC2)cc1 ZINC000741677977 1131634914 /nfs/dbraw/zinc/63/49/14/1131634914.db2.gz GRFMWWRKJCKINZ-UHFFFAOYSA-N 1 1 345.531 3.804 20 10 EHCDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1C ZINC000741725175 1131636670 /nfs/dbraw/zinc/63/66/70/1131636670.db2.gz OAVRGSLTEUSPBX-CRAIPNDOSA-N 1 1 339.483 3.615 20 10 EHCDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)CC)cc2)C1 ZINC000741754626 1131644166 /nfs/dbraw/zinc/64/41/66/1131644166.db2.gz UFPXJYFQHDVOHF-HKUYNNGSSA-N 1 1 345.531 3.660 20 10 EHCDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000742175700 1131697594 /nfs/dbraw/zinc/69/75/94/1131697594.db2.gz LGZSNKJLMKPJLR-MLGOLLRUSA-N 1 1 329.371 3.843 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)NCC1CCCCC1 ZINC000743870218 1131994879 /nfs/dbraw/zinc/99/48/79/1131994879.db2.gz LXPGWLNHTQBCPT-MRXNPFEDSA-N 1 1 332.488 3.689 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000743870441 1131995253 /nfs/dbraw/zinc/99/52/53/1131995253.db2.gz RJUKBTYIAXUAGT-SFNKJDCFSA-N 1 1 346.515 3.934 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1ccc(F)c(F)c1 ZINC000743870204 1131996633 /nfs/dbraw/zinc/99/66/33/1131996633.db2.gz LBBBRCHHLZHIIJ-CYBMUJFWSA-N 1 1 348.393 3.910 20 10 EHCDMO C[C@H]1c2sccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001175831620 1132771207 /nfs/dbraw/zinc/77/12/07/1132771207.db2.gz QSRIRDZQBBUZRG-HNNXBMFYSA-N 1 1 328.481 3.704 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](CO)[C@@H](C)c2ccccc2)c1O ZINC000766970057 1132924764 /nfs/dbraw/zinc/92/47/64/1132924764.db2.gz NGIRMXQHMCXKRZ-KPZWWZAWSA-N 1 1 347.842 3.502 20 10 EHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000768140284 1133101537 /nfs/dbraw/zinc/10/15/37/1133101537.db2.gz YUPQCQFFUIBTJI-ZDUSSCGKSA-N 1 1 328.250 3.928 20 10 EHCDMO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768437576 1133137973 /nfs/dbraw/zinc/13/79/73/1133137973.db2.gz ADKSCGGXVBLPQK-IBGZPJMESA-N 1 1 341.451 3.748 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccccc1Cl)[C@@H](O)CO2 ZINC000768440890 1133138953 /nfs/dbraw/zinc/13/89/53/1133138953.db2.gz AMYCNTGKGTUIGD-WMZOPIPTSA-N 1 1 345.826 3.809 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl)[C@H](O)CO2 ZINC000768440887 1133139316 /nfs/dbraw/zinc/13/93/16/1133139316.db2.gz AMYCNTGKGTUIGD-SJLPKXTDSA-N 1 1 345.826 3.809 20 10 EHCDMO COc1cc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c(O)cc1C ZINC000768441194 1133139634 /nfs/dbraw/zinc/13/96/34/1133139634.db2.gz XBDKTVIPJWDLEI-LJQANCHMSA-N 1 1 341.451 3.890 20 10 EHCDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768447936 1133140470 /nfs/dbraw/zinc/14/04/70/1133140470.db2.gz RSHOCHWQVMVTPO-ICSRJNTNSA-N 1 1 327.424 3.647 20 10 EHCDMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768463479 1133144242 /nfs/dbraw/zinc/14/42/42/1133144242.db2.gz UQBIPOIAGRJARU-FPOVZHCZSA-N 1 1 339.435 3.573 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1CCC1CCCC1)[C@@H](O)CO2 ZINC000768462530 1133144327 /nfs/dbraw/zinc/14/43/27/1133144327.db2.gz MQIZCCSEFKKNSK-APWZRJJASA-N 1 1 331.456 3.753 20 10 EHCDMO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC001178304393 1133155471 /nfs/dbraw/zinc/15/54/71/1133155471.db2.gz GCTHTRWGJCUZIG-QGHHPUGFSA-N 1 1 325.330 3.675 20 10 EHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cc(Br)cs1 ZINC000768814421 1133180489 /nfs/dbraw/zinc/18/04/89/1133180489.db2.gz ZURZPDQTQHPONA-UHFFFAOYSA-N 1 1 342.258 3.857 20 10 EHCDMO CC[N@H+](CCc1ccccn1)Cc1cccc(Br)c1O ZINC000769034591 1133216317 /nfs/dbraw/zinc/21/63/17/1133216317.db2.gz FENZYJZKULSFDY-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO CC[N@@H+](CCc1ccccn1)Cc1cccc(Br)c1O ZINC000769034591 1133216322 /nfs/dbraw/zinc/21/63/22/1133216322.db2.gz FENZYJZKULSFDY-UHFFFAOYSA-N 1 1 335.245 3.614 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)c1 ZINC000768999381 1133218763 /nfs/dbraw/zinc/21/87/63/1133218763.db2.gz WQNLMNCDNUQQBX-UHFFFAOYSA-N 1 1 340.467 3.806 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC(c2ccccn2)CC1 ZINC000769107701 1133227686 /nfs/dbraw/zinc/22/76/86/1133227686.db2.gz ZJKGKVFGIVLZRD-UHFFFAOYSA-N 1 1 347.256 3.929 20 10 EHCDMO COc1ccc2c(c1)C[N@@H+](Cc1cc(Br)ccc1O)CC2 ZINC000769121126 1133230049 /nfs/dbraw/zinc/23/00/49/1133230049.db2.gz QLHHNVJMUZIDAN-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO COc1ccc2c(c1)C[N@H+](Cc1cc(Br)ccc1O)CC2 ZINC000769121126 1133230054 /nfs/dbraw/zinc/23/00/54/1133230054.db2.gz QLHHNVJMUZIDAN-UHFFFAOYSA-N 1 1 348.240 3.722 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000769144944 1133231334 /nfs/dbraw/zinc/23/13/34/1133231334.db2.gz LBXZLCXVBYWPLU-OAQYLSRUSA-N 1 1 327.516 3.737 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@@H]1CN1CCCC1 ZINC000769144944 1133231339 /nfs/dbraw/zinc/23/13/39/1133231339.db2.gz LBXZLCXVBYWPLU-OAQYLSRUSA-N 1 1 327.516 3.737 20 10 EHCDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1c(O)cccc1OC ZINC000769190364 1133233450 /nfs/dbraw/zinc/23/34/50/1133233450.db2.gz TYTOYEBABRCXDD-INIZCTEOSA-N 1 1 327.424 3.617 20 10 EHCDMO Cc1cc(O)c(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1C ZINC000769148735 1133233754 /nfs/dbraw/zinc/23/37/54/1133233754.db2.gz QQGNSBUXJDIIPJ-LJQANCHMSA-N 1 1 330.516 3.953 20 10 EHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000769318106 1133261192 /nfs/dbraw/zinc/26/11/92/1133261192.db2.gz ISKZXLVBDUODHB-QGZVFWFLSA-N 1 1 342.458 3.898 20 10 EHCDMO Fc1cccc([C@H]2CC[N@@H+](Cc3ccc(N4CCOCC4)cc3)C2)c1 ZINC000769337065 1133266216 /nfs/dbraw/zinc/26/62/16/1133266216.db2.gz CIIJEKXAIXYDSW-IBGZPJMESA-N 1 1 340.442 3.652 20 10 EHCDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3c(O)cccc3OC)C2)cc1 ZINC000769394115 1133285586 /nfs/dbraw/zinc/28/55/86/1133285586.db2.gz ISNYCVXTLJFIGX-QGZVFWFLSA-N 1 1 341.451 3.864 20 10 EHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)ccc2O)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000769485713 1133288772 /nfs/dbraw/zinc/28/87/72/1133288772.db2.gz NZTIFHWAIWJUMW-RDJZCZTQSA-N 1 1 348.487 3.826 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CC[C@H](C)[C@H](C)C2)c1O ZINC000769450892 1133292629 /nfs/dbraw/zinc/29/26/29/1133292629.db2.gz JFHJNUMMTBEPMP-WDEREUQCSA-N 1 1 328.250 3.641 20 10 EHCDMO CCC[N@@H+](Cc1cccc(OCC)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000769469957 1133297163 /nfs/dbraw/zinc/29/71/63/1133297163.db2.gz ILBGLEYKOYDTLH-IPELMVKDSA-N 1 1 333.472 3.816 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC001179906514 1133305531 /nfs/dbraw/zinc/30/55/31/1133305531.db2.gz XGMIOWRLZZBHKG-NFOSPISASA-N 1 1 348.490 3.940 20 10 EHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC001179906514 1133305536 /nfs/dbraw/zinc/30/55/36/1133305536.db2.gz XGMIOWRLZZBHKG-NFOSPISASA-N 1 1 348.490 3.940 20 10 EHCDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cc3c(cc2O)OCO3)o1 ZINC000769549994 1133313191 /nfs/dbraw/zinc/31/31/91/1133313191.db2.gz QKZKJEVTUVSPIR-DOMZBBRYSA-N 1 1 329.396 3.996 20 10 EHCDMO Cc1ccc(O)c(C[N@H+](C)CC(C)(C)CNC(=O)OC(C)(C)C)c1 ZINC000769567137 1133316394 /nfs/dbraw/zinc/31/63/94/1133316394.db2.gz NTKUXHDJGHEWIR-UHFFFAOYSA-N 1 1 336.476 3.683 20 10 EHCDMO CCOC(=O)CC[N@H+](Cc1cc(Cl)c(C)cc1O)CC1CC1 ZINC001180253490 1133350953 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EHCDMO O[C@]1(C(F)(F)F)CCCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324480 1133584710 /nfs/dbraw/zinc/58/47/10/1133584710.db2.gz LOMFMSBCOLAKCT-QGZVFWFLSA-N 1 1 342.405 3.566 20 10 EHCDMO CC[N@@H+](CCC1CCN(C(=O)C2=CC(=O)CS2)CC1)CC(C)C ZINC000774407681 1133673659 /nfs/dbraw/zinc/67/36/59/1133673659.db2.gz XSGSWNVPTNTNTG-UHFFFAOYSA-N 1 1 338.517 3.674 20 10 EHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCC(F)(F)C1)C[C@@H]1CCCO1 ZINC000787731908 1134036247 /nfs/dbraw/zinc/03/62/47/1134036247.db2.gz UDSARSQPFJTDPT-HOCLYGCPSA-N 1 1 325.399 3.809 20 10 EHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000774835017 1134037500 /nfs/dbraw/zinc/03/75/00/1134037500.db2.gz HLKLEWUBUJYXPO-OAHLLOKOSA-N 1 1 328.368 3.646 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2ccccc2)CC(C)C)ccc1[N+](=O)[O-] ZINC000774838074 1134045527 /nfs/dbraw/zinc/04/55/27/1134045527.db2.gz HTPPDHQMRKBPSK-UHFFFAOYSA-N 1 1 344.411 3.967 20 10 EHCDMO COc1c(O)c(C[N@H+](Cc2ccccc2)CC(C)C)ccc1[N+](=O)[O-] ZINC000774838074 1134045532 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3.577 20 10 EHCDMO CC(C)(C)OCCCC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000789349622 1134253893 /nfs/dbraw/zinc/25/38/93/1134253893.db2.gz ZCODYDXMRCGVHJ-GOSISDBHSA-N 1 1 335.488 3.969 20 10 EHCDMO CC1(C)CC[N@@H+](Cc2cc(Br)ccc2O)CCS1 ZINC000789762916 1134328004 /nfs/dbraw/zinc/32/80/04/1134328004.db2.gz AZYPPSRJPZNWIB-UHFFFAOYSA-N 1 1 330.291 3.872 20 10 EHCDMO O=C(C[NH2+]Cc1c(O)ccc(Cl)c1F)Nc1ccc(Cl)cc1 ZINC000790954453 1134484781 /nfs/dbraw/zinc/48/47/81/1134484781.db2.gz SMBUKTSOYDWELW-UHFFFAOYSA-N 1 1 343.185 3.566 20 10 EHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc2c(c1)CC(=O)N2C ZINC000790960533 1134485376 /nfs/dbraw/zinc/48/53/76/1134485376.db2.gz VLMHENTWYOCDMQ-JTQLQIEISA-N 1 1 348.805 3.554 20 10 EHCDMO COc1ccc(N2CC[NH+](Cc3cccc(C(F)F)c3)CC2)cc1 ZINC000791441654 1134551327 /nfs/dbraw/zinc/55/13/27/1134551327.db2.gz UJSYENBVNQMYNC-UHFFFAOYSA-N 1 1 332.394 3.955 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+]2CCC[C@](C)(O)CC2)c(C)n1-c1ccccc1 ZINC000791630206 1134586752 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C[C@@H]1C[C@@H](C)C[NH+](CCCNCc2ccc(N3CCCC3)cc2)C1 ZINC001199329514 1135897956 /nfs/dbraw/zinc/89/79/56/1135897956.db2.gz USVZWFBYXHNNKS-RTBURBONSA-N 1 1 329.532 3.744 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000776015385 1135921310 /nfs/dbraw/zinc/92/13/10/1135921310.db2.gz BUFPRQJIBSKDQV-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000776015385 1135921312 /nfs/dbraw/zinc/92/13/12/1135921312.db2.gz BUFPRQJIBSKDQV-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000810209792 1135943328 /nfs/dbraw/zinc/94/33/28/1135943328.db2.gz VVCBOEXVWSOIFM-BLLLJJGKSA-N 1 1 342.405 3.936 20 10 EHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810209792 1135943333 /nfs/dbraw/zinc/94/33/33/1135943333.db2.gz VVCBOEXVWSOIFM-BLLLJJGKSA-N 1 1 342.405 3.936 20 10 EHCDMO COc1cccc(O)c1C[NH2+]Cc1nc(-c2ccccc2F)cs1 ZINC000811497404 1136093990 /nfs/dbraw/zinc/09/39/90/1136093990.db2.gz ZJXYFZZEZKYOJQ-UHFFFAOYSA-N 1 1 344.411 3.953 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1 ZINC000811511568 1136103350 /nfs/dbraw/zinc/10/33/50/1136103350.db2.gz NNEPXHOVDJOHKG-JTQLQIEISA-N 1 1 334.204 3.940 20 10 EHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1 ZINC000811511568 1136103352 /nfs/dbraw/zinc/10/33/52/1136103352.db2.gz NNEPXHOVDJOHKG-JTQLQIEISA-N 1 1 334.204 3.940 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000811513204 1136103373 /nfs/dbraw/zinc/10/33/73/1136103373.db2.gz REJDTERKVCJMRC-KRWDZBQOSA-N 1 1 328.843 3.683 20 10 EHCDMO Oc1cc2c(cc1C[N@H+]1CCCN3c4ccccc4C[C@@H]3C1)CCC2 ZINC000811784156 1136140208 /nfs/dbraw/zinc/14/02/08/1136140208.db2.gz PIFQNWAXSFTRMV-HXUWFJFHSA-N 1 1 334.463 3.518 20 10 EHCDMO Clc1cnc(SCc2ccc(C[NH+]3CCOCC3)cc2)s1 ZINC000850001679 1136198145 /nfs/dbraw/zinc/19/81/45/1136198145.db2.gz JYFOYQDQBOQPKL-UHFFFAOYSA-N 1 1 340.901 3.921 20 10 EHCDMO CC[C@H]([NH2+][C@@H]1CC(=O)N(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000812739953 1136240724 /nfs/dbraw/zinc/24/07/24/1136240724.db2.gz JAVKPFPZWGOZRU-CJNGLKHVSA-N 1 1 346.377 3.517 20 10 EHCDMO OC[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000812780245 1136246387 /nfs/dbraw/zinc/24/63/87/1136246387.db2.gz XQIHSISODCTJKT-HXUWFJFHSA-N 1 1 345.870 3.863 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCC2SCCS2)c1 ZINC000850407040 1136251072 /nfs/dbraw/zinc/25/10/72/1136251072.db2.gz HYICGMRJIAOMGW-UHFFFAOYSA-N 1 1 348.331 3.749 20 10 EHCDMO C[N@@H+](Cc1nc2ccc(Br)cc2o1)Cc1ccccc1O ZINC000812829422 1136255950 /nfs/dbraw/zinc/25/59/50/1136255950.db2.gz CSVUJYGNQPUKFM-UHFFFAOYSA-N 1 1 347.212 3.928 20 10 EHCDMO CC[C@@H]([NH2+][C@@H](COC)c1cccc(OC)c1)c1ccc(F)cc1O ZINC000850513777 1136274575 /nfs/dbraw/zinc/27/45/75/1136274575.db2.gz JJEJVCYSFIGDET-MSOLQXFVSA-N 1 1 333.403 3.968 20 10 EHCDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1)c1ccc(Cl)cc1O ZINC000850540234 1136282029 /nfs/dbraw/zinc/28/20/29/1136282029.db2.gz KDHWJPJZUDDBSJ-RVSPLBMKSA-N 1 1 333.863 3.841 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1)c1ccc(Cl)cc1O ZINC000850540233 1136282042 /nfs/dbraw/zinc/28/20/42/1136282042.db2.gz KDHWJPJZUDDBSJ-QEORTHHSSA-N 1 1 333.863 3.841 20 10 EHCDMO C[C@@H](C(=O)Nc1cc(Cl)ccc1F)[N@@H+](C)Cc1ccccc1O ZINC000109771443 1136340128 /nfs/dbraw/zinc/34/01/28/1136340128.db2.gz OFIGWGCGMSDTPQ-NSHDSACASA-N 1 1 336.794 3.644 20 10 EHCDMO COc1c(O)c(C[N@H+](Cc2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774815286 1136412657 /nfs/dbraw/zinc/41/26/57/1136412657.db2.gz RONSMFWRQIMBOQ-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO COc1c(O)c(C[N@@H+](Cc2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000774815286 1136412660 /nfs/dbraw/zinc/41/26/60/1136412660.db2.gz RONSMFWRQIMBOQ-UHFFFAOYSA-N 1 1 330.384 3.720 20 10 EHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCC(=O)O1 ZINC000851879307 1136415523 /nfs/dbraw/zinc/41/55/23/1136415523.db2.gz HYMVJSAEMXDCDH-QAPCUYQASA-N 1 1 325.408 3.661 20 10 EHCDMO CCN(C)c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000815116311 1136551445 /nfs/dbraw/zinc/55/14/45/1136551445.db2.gz INJNFCJUGYOJDW-UHFFFAOYSA-N 1 1 327.428 3.725 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cccc(C(F)(F)F)n1 ZINC000815142645 1136561915 /nfs/dbraw/zinc/56/19/15/1136561915.db2.gz XIUXRBZTHUFBCN-UHFFFAOYSA-N 1 1 348.727 3.931 20 10 EHCDMO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815576003 1136613083 /nfs/dbraw/zinc/61/30/83/1136613083.db2.gz GUAPZJDBDDAOJJ-VHSXEESVSA-N 1 1 327.350 3.865 20 10 EHCDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ncc(Br)cn2)c1 ZINC000815634294 1136621985 /nfs/dbraw/zinc/62/19/85/1136621985.db2.gz HYZIIQRTMPXCLJ-WDEREUQCSA-N 1 1 336.233 3.665 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000816531297 1136730783 /nfs/dbraw/zinc/73/07/83/1136730783.db2.gz MPUNEZRSMLWFBV-OAHLLOKOSA-N 1 1 330.186 3.661 20 10 EHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000816565907 1136737720 /nfs/dbraw/zinc/73/77/20/1136737720.db2.gz FXWDFJCGVQQKTB-OLZOCXBDSA-N 1 1 340.870 3.927 20 10 EHCDMO Oc1c(CNc2cccc(C[N@@H+]3CC[C@H](O)C3)c2)ccc2ccccc21 ZINC000816616789 1136741784 /nfs/dbraw/zinc/74/17/84/1136741784.db2.gz GMYGKHGCBSOIGA-FQEVSTJZSA-N 1 1 348.446 3.724 20 10 EHCDMO CCN(CC)c1ccc(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1F ZINC000816642133 1136743603 /nfs/dbraw/zinc/74/36/03/1136743603.db2.gz QBSXXNLXFYDCAS-HXUWFJFHSA-N 1 1 333.495 3.590 20 10 EHCDMO CSc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938016 1136847742 /nfs/dbraw/zinc/84/77/42/1136847742.db2.gz BOGPCMRMHQVKKL-KUHUBIRLSA-N 1 1 329.513 3.825 20 10 EHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000817940678 1136848742 /nfs/dbraw/zinc/84/87/42/1136848742.db2.gz GOOGTQZDUQOXMF-XIKOKIGWSA-N 1 1 335.854 3.896 20 10 EHCDMO CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966463 1136853185 /nfs/dbraw/zinc/85/31/85/1136853185.db2.gz OJPBQIHOUUUDBW-GOEBONIOSA-N 1 1 330.394 3.841 20 10 EHCDMO CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Br)ccc1[O-] ZINC000817985082 1136855471 /nfs/dbraw/zinc/85/54/71/1136855471.db2.gz GRRBYLSLKZAIDM-HNNXBMFYSA-N 1 1 339.277 3.505 20 10 EHCDMO C[C@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(Cl)c1[O-])CC[NH2+]CC2 ZINC000818431017 1136874151 /nfs/dbraw/zinc/87/41/51/1136874151.db2.gz CTRUCLCRVKEQAF-NSHDSACASA-N 1 1 329.271 3.663 20 10 EHCDMO COC(=O)c1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000818356699 1136875608 /nfs/dbraw/zinc/87/56/08/1136875608.db2.gz PVBFUAMMNGDZJK-BDAKNGLRSA-N 1 1 340.832 3.701 20 10 EHCDMO Cc1ccc(O[C@@H]2CC[N@H+](C/C=C\c3ccc(N(C)C)cc3)C2)nc1 ZINC000858013387 1136930556 /nfs/dbraw/zinc/93/05/56/1136930556.db2.gz ICNDTNUMRBIZOI-BBIZLLLXSA-N 1 1 337.467 3.623 20 10 EHCDMO Cc1csc(C(C)(C)[NH2+]Cc2c(O)cccc2Br)n1 ZINC000858139817 1136943298 /nfs/dbraw/zinc/94/32/98/1136943298.db2.gz QIQOVDVABGFBCJ-UHFFFAOYSA-N 1 1 341.274 3.945 20 10 EHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491179 1136972741 /nfs/dbraw/zinc/97/27/41/1136972741.db2.gz ZRDNGFAIMUXSIX-STQMWFEESA-N 1 1 330.394 3.794 20 10 EHCDMO COc1nccc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)n1 ZINC000823375376 1137096869 /nfs/dbraw/zinc/09/68/69/1137096869.db2.gz OCLQWFAFCCOXKB-UHFFFAOYSA-N 1 1 327.428 3.526 20 10 EHCDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1sccc1-n1c(C)ccc1C ZINC001136755443 1137107661 /nfs/dbraw/zinc/10/76/61/1137107661.db2.gz WCEMERQRCQVEHK-MRXNPFEDSA-N 1 1 345.512 3.760 20 10 EHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(OC3CCCC3)CC2)cc1F ZINC000862236879 1137133883 /nfs/dbraw/zinc/13/38/83/1137133883.db2.gz FRCIGQNUYAYUMV-UHFFFAOYSA-N 1 1 338.442 3.954 20 10 EHCDMO CC[N@@H+](Cc1c(C2CCC2)cnn1C)Cc1ccc(N(C)C)cc1 ZINC000824484678 1137139680 /nfs/dbraw/zinc/13/96/80/1137139680.db2.gz QHVPIIGGPQNEBO-UHFFFAOYSA-N 1 1 326.488 3.776 20 10 EHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC(C)(C)c2ccccn2)c1 ZINC000824583269 1137145232 /nfs/dbraw/zinc/14/52/32/1137145232.db2.gz KLFIAOJDKIEBRA-UHFFFAOYSA-N 1 1 349.272 3.926 20 10 EHCDMO C[N@@H+](Cc1c(O)cccc1Cl)[C@H](CO)c1ccc(Cl)cc1 ZINC000824691151 1137148383 /nfs/dbraw/zinc/14/83/83/1137148383.db2.gz VKPFKWIWCJLBAJ-OAHLLOKOSA-N 1 1 326.223 3.864 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@@H]1C ZINC000824821054 1137153998 /nfs/dbraw/zinc/15/39/98/1137153998.db2.gz SSQFNDZHRCPZKR-LRDDRELGSA-N 1 1 330.394 3.628 20 10 EHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215793 1137169219 /nfs/dbraw/zinc/16/92/19/1137169219.db2.gz WIWGFSZPFFDNQZ-OAHLLOKOSA-N 1 1 342.302 3.874 20 10 EHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2nc3cc(F)ccc3o2)cc1 ZINC000844402466 1137217471 /nfs/dbraw/zinc/21/74/71/1137217471.db2.gz YLWMSGMJMLCXCY-UHFFFAOYSA-N 1 1 343.402 3.544 20 10 EHCDMO CCc1cc(C[N@H+]2CCO[C@@]3(CCO[C@H]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000794665801 1137222548 /nfs/dbraw/zinc/22/25/48/1137222548.db2.gz VZYGJTRGPGMEFP-BTYIYWSLSA-N 1 1 347.499 3.632 20 10 EHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCCc2ccccc2F)c1 ZINC000794843151 1137285212 /nfs/dbraw/zinc/28/52/12/1137285212.db2.gz VDZNOOFWYDENKM-CYBMUJFWSA-N 1 1 331.387 3.601 20 10 EHCDMO Cc1ncc([C@@H](C)[NH2+]Cc2cccc(Br)c2O)s1 ZINC000865701518 1137305232 /nfs/dbraw/zinc/30/52/32/1137305232.db2.gz NHNUZZCWSBDOCU-MRVPVSSYSA-N 1 1 327.247 3.770 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc4cnccc4o3)CC2)cc1 ZINC000845905074 1137319038 /nfs/dbraw/zinc/31/90/38/1137319038.db2.gz MSLLNYSXBCHRCG-UHFFFAOYSA-N 1 1 337.423 3.549 20 10 EHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2occc2Br)c1 ZINC000845973247 1137322567 /nfs/dbraw/zinc/32/25/67/1137322567.db2.gz WMUNOKJTIGAACF-SECBINFHSA-N 1 1 326.190 3.607 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](c2ccccc2F)[C@@H](C)O)ccc1OC ZINC000846018564 1137326203 /nfs/dbraw/zinc/32/62/03/1137326203.db2.gz UNSCMMUSORTJKY-VLIAUNLRSA-N 1 1 347.430 3.583 20 10 EHCDMO COc1cccc([C@H](C)NC2CC[NH+](C3CCCCC3)CC2)c1O ZINC000846144485 1137339111 /nfs/dbraw/zinc/33/91/11/1137339111.db2.gz GXMVXQHRLRZNBI-HNNXBMFYSA-N 1 1 332.488 3.849 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846216415 1137341899 /nfs/dbraw/zinc/34/18/99/1137341899.db2.gz SBETYWUCSICASG-JQWIXIFHSA-N 1 1 346.254 3.803 20 10 EHCDMO C[C@@H]([NH2+]Cc1cccc(F)n1)c1ccc(N2CCOCC2)cc1Cl ZINC000773085274 1137464382 /nfs/dbraw/zinc/46/43/82/1137464382.db2.gz HCDSEDZWTIDMQQ-CYBMUJFWSA-N 1 1 349.837 3.562 20 10 EHCDMO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872035823 1137566803 /nfs/dbraw/zinc/56/68/03/1137566803.db2.gz QRUCFCOXAYMZQW-CYBMUJFWSA-N 1 1 331.391 3.959 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872258780 1137576580 /nfs/dbraw/zinc/57/65/80/1137576580.db2.gz AKDFMDREJNYVPA-INIZCTEOSA-N 1 1 339.863 3.978 20 10 EHCDMO OC1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CC=CCC4)C3)cc2)CC1 ZINC000876739175 1137660051 /nfs/dbraw/zinc/66/00/51/1137660051.db2.gz AHRUNAYKBYXDPR-QFIPXVFZSA-N 1 1 340.511 3.970 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@@H+]2Cc2c(C)cccc2O)n1 ZINC000877473316 1137677403 /nfs/dbraw/zinc/67/74/03/1137677403.db2.gz GJRAZLLFMJAZDP-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO CCOC(=O)c1csc([C@@H]2CCC[N@H+]2Cc2c(C)cccc2O)n1 ZINC000877473316 1137677404 /nfs/dbraw/zinc/67/74/04/1137677404.db2.gz GJRAZLLFMJAZDP-HNNXBMFYSA-N 1 1 346.452 3.671 20 10 EHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000877544737 1137680608 /nfs/dbraw/zinc/68/06/08/1137680608.db2.gz VPUALRKQWHOQQY-OAQYLSRUSA-N 1 1 325.452 3.518 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CC3(CO2)CCOCC3)cc1 ZINC000877921803 1137695658 /nfs/dbraw/zinc/69/56/58/1137695658.db2.gz MAKBENVOMUIOGY-HXUWFJFHSA-N 1 1 346.515 3.550 20 10 EHCDMO COc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)c(C(F)(F)F)c1 ZINC000882957428 1137839792 /nfs/dbraw/zinc/83/97/92/1137839792.db2.gz CBVNMOZNCGADTF-UHFFFAOYSA-N 1 1 347.283 3.988 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000883075906 1137843533 /nfs/dbraw/zinc/84/35/33/1137843533.db2.gz ORBBIOYQHKFKTF-ACJLOTCBSA-N 1 1 333.378 3.928 20 10 EHCDMO COC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(Cl)c1 ZINC000883121223 1137845279 /nfs/dbraw/zinc/84/52/79/1137845279.db2.gz BHSXWHDLDJKUMS-OAHLLOKOSA-N 1 1 327.758 3.801 20 10 EHCDMO OCC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)c(F)c1 ZINC000883193608 1137848093 /nfs/dbraw/zinc/84/80/93/1137848093.db2.gz ZXTQEAIUBYGOTO-HNNXBMFYSA-N 1 1 345.748 3.676 20 10 EHCDMO C[C@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(F)c1F ZINC000883290345 1137852968 /nfs/dbraw/zinc/85/29/68/1137852968.db2.gz RPIUBQOOSHIDGO-HNNXBMFYSA-N 1 1 345.437 3.567 20 10 EHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c2ccccc21 ZINC000883290955 1137853019 /nfs/dbraw/zinc/85/30/19/1137853019.db2.gz NYPCEWWVLVVAHQ-VGOFRKELSA-N 1 1 335.495 3.777 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H](O)c1c(F)cccc1Cl)c1c(O)cccc1F ZINC000886549519 1138094784 /nfs/dbraw/zinc/09/47/84/1138094784.db2.gz JDIABBKVLMDIRC-YMTOWFKASA-N 1 1 327.758 3.708 20 10 EHCDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1C)Cc1cc(C)ccc1O ZINC000093660498 1138239160 /nfs/dbraw/zinc/23/91/60/1138239160.db2.gz IEPQNKGJSWFBSL-UHFFFAOYSA-N 1 1 326.440 3.778 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)N(C)C1CC1)Cc1ccccc1O ZINC000179642718 1139771684 /nfs/dbraw/zinc/77/16/84/1139771684.db2.gz ZKLZXSVAXHDUAF-INIZCTEOSA-N 1 1 338.451 3.576 20 10 EHCDMO COc1cc(O)c(C[N@@H+](Cc2ccco2)C2CCCC2)cc1OC ZINC000179683338 1139774453 /nfs/dbraw/zinc/77/44/53/1139774453.db2.gz NRYDHGPDXDVXRT-UHFFFAOYSA-N 1 1 331.412 3.947 20 10 EHCDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cc(OC)ccc1O ZINC000179860826 1139788700 /nfs/dbraw/zinc/78/87/00/1139788700.db2.gz SWFVYLWLPBEGQY-UHFFFAOYSA-N 1 1 329.440 3.830 20 10 EHCDMO COc1ccc(N2CC[NH+]([C@@H](C)c3nc4ccccc4o3)CC2)cc1 ZINC000180905965 1139872028 /nfs/dbraw/zinc/87/20/28/1139872028.db2.gz DCXXRWLDQGAUBG-HNNXBMFYSA-N 1 1 337.423 3.720 20 10 EHCDMO C[C@@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1O ZINC000185604449 1140158087 /nfs/dbraw/zinc/15/80/87/1140158087.db2.gz DIXCCIHUWOCBSI-MRVPVSSYSA-N 1 1 334.338 3.900 20 10 EHCDMO C[C@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1ccc(F)cc1O ZINC000186148448 1140188997 /nfs/dbraw/zinc/18/89/97/1140188997.db2.gz ZHHCLFJHNUTFHN-KBXCAEBGSA-N 1 1 331.431 3.984 20 10 EHCDMO CSC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000188176568 1140285942 /nfs/dbraw/zinc/28/59/42/1140285942.db2.gz UQGZISATCXIVRM-YJBOKZPZSA-N 1 1 331.481 3.679 20 10 EHCDMO C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)c(F)c1[O-] ZINC000191179787 1140441840 /nfs/dbraw/zinc/44/18/40/1140441840.db2.gz MICWJSVNVHZEHJ-AWEZNQCLSA-N 1 1 346.421 3.986 20 10 EHCDMO CCOCc1cc(C[NH2+][C@H](COC)c2ccc(CC)o2)ccc1OC ZINC000266184735 1140652113 /nfs/dbraw/zinc/65/21/13/1140652113.db2.gz WNKOCURHKXBFLY-GOSISDBHSA-N 1 1 347.455 3.864 20 10 EHCDMO Cc1c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)nnn1-c1ccc(C)cc1 ZINC000268745664 1140981471 /nfs/dbraw/zinc/98/14/71/1140981471.db2.gz RVXVOHQNRHEDMB-INIZCTEOSA-N 1 1 349.482 3.801 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cccnc1Cl ZINC000268833387 1141003158 /nfs/dbraw/zinc/00/31/58/1141003158.db2.gz FZOZWJMXEVJPAK-CYBMUJFWSA-N 1 1 349.837 3.562 20 10 EHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1O ZINC000271277849 1141337986 /nfs/dbraw/zinc/33/79/86/1141337986.db2.gz OUPJWZVKHFJSLD-JKSUJKDBSA-N 1 1 347.480 3.941 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1c(F)cccc1F)C[C@@H]1CCCO1 ZINC000160205060 1014355979 /nfs/dbraw/zinc/35/59/79/1014355979.db2.gz MZBINJAGWKTEIN-HNNXBMFYSA-N 1 1 333.378 3.852 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1c(F)cccc1F)C[C@@H]1CCCO1 ZINC000160205060 1014355989 /nfs/dbraw/zinc/35/59/89/1014355989.db2.gz MZBINJAGWKTEIN-HNNXBMFYSA-N 1 1 333.378 3.852 20 10 EHCDMO COc1cccc(CNC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1O ZINC000377618632 1018071589 /nfs/dbraw/zinc/07/15/89/1018071589.db2.gz BWUHMKCGCKOJFC-CRAIPNDOSA-N 1 1 332.488 3.534 20 10 EHCDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000050901696 1020660278 /nfs/dbraw/zinc/66/02/78/1020660278.db2.gz RTKGFUDIYRRPFP-QGZVFWFLSA-N 1 1 340.467 3.674 20 10 EHCDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000050900065 1020664397 /nfs/dbraw/zinc/66/43/97/1020664397.db2.gz RJMVFYSIKUTMHK-MRXNPFEDSA-N 1 1 332.488 3.562 20 10 EHCDMO OCC1([C@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc2)CCC1 ZINC000894857718 1021472654 /nfs/dbraw/zinc/47/26/54/1021472654.db2.gz NIHVGKXPQZNSFT-GOSISDBHSA-N 1 1 333.378 3.664 20 10 EHCDMO COc1ccccc1-c1noc([C@H](C)[NH2+]Cc2cccc(C)c2O)n1 ZINC000276757856 1022614125 /nfs/dbraw/zinc/61/41/25/1022614125.db2.gz MJZOWOBEHXFNAR-ZDUSSCGKSA-N 1 1 339.395 3.610 20 10 EHCDMO COC(=O)CCC[N@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001142509172 1033077817 /nfs/dbraw/zinc/07/78/17/1033077817.db2.gz ZKVAWXIQXYXNDE-UHFFFAOYSA-N 1 1 349.377 3.626 20 10 EHCDMO COC(=O)CCC[N@@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001142509172 1033077824 /nfs/dbraw/zinc/07/78/24/1033077824.db2.gz ZKVAWXIQXYXNDE-UHFFFAOYSA-N 1 1 349.377 3.626 20 10 EHCDMO CC1(C)CC[C@H](C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)OC1 ZINC001167982355 1022825471 /nfs/dbraw/zinc/82/54/71/1022825471.db2.gz CNRATZYFNRMEFH-QZTJIDSGSA-N 1 1 333.472 3.578 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c(O)c1OC ZINC000891944120 1023483741 /nfs/dbraw/zinc/48/37/41/1023483741.db2.gz YNNDNTDZLVEZKX-CQSZACIVSA-N 1 1 331.387 3.538 20 10 EHCDMO Oc1cc2c(cc1C[N@H+](Cc1ccc(F)cc1F)C1CC1)OCO2 ZINC000054548051 1033169717 /nfs/dbraw/zinc/16/97/17/1033169717.db2.gz KDLFYDGXYMEAAM-UHFFFAOYSA-N 1 1 333.334 3.564 20 10 EHCDMO Oc1cc2c(cc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1)OCO2 ZINC000054548051 1033169724 /nfs/dbraw/zinc/16/97/24/1033169724.db2.gz KDLFYDGXYMEAAM-UHFFFAOYSA-N 1 1 333.334 3.564 20 10 EHCDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(O)c1OC ZINC000891995929 1024264658 /nfs/dbraw/zinc/26/46/58/1024264658.db2.gz OWVQKDYOOXXODW-CYBMUJFWSA-N 1 1 331.387 3.538 20 10 EHCDMO CC(=O)N1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000280859283 1024348505 /nfs/dbraw/zinc/34/85/05/1024348505.db2.gz CBGZWHIQEBQWQM-ZYHUDNBSSA-N 1 1 345.270 3.608 20 10 EHCDMO COc1ccccc1O[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520066 1033212341 /nfs/dbraw/zinc/21/23/41/1033212341.db2.gz BDISWVIUEBCLQO-AWEZNQCLSA-N 1 1 349.377 3.722 20 10 EHCDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520066 1033212356 /nfs/dbraw/zinc/21/23/56/1033212356.db2.gz BDISWVIUEBCLQO-AWEZNQCLSA-N 1 1 349.377 3.722 20 10 EHCDMO Cc1cccc(O)c1CNc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000895648126 1024679725 /nfs/dbraw/zinc/67/97/25/1024679725.db2.gz RYTQGBCIBPRUSL-LJQANCHMSA-N 1 1 337.467 3.597 20 10 EHCDMO Oc1c(Br)cccc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895658104 1024694988 /nfs/dbraw/zinc/69/49/88/1024694988.db2.gz GZKVLJRBFHXMFY-UHFFFAOYSA-N 1 1 340.261 3.690 20 10 EHCDMO CCCN(CC)C(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435627432 1025047630 /nfs/dbraw/zinc/04/76/30/1025047630.db2.gz NJWKOCBQXORAPB-UHFFFAOYSA-N 1 1 341.499 3.666 20 10 EHCDMO CCCOc1ccc(C[NH2+]Cc2cc(C(F)(F)F)n(C)n2)cc1C ZINC000898019353 1033290699 /nfs/dbraw/zinc/29/06/99/1033290699.db2.gz KJTKESZGFBQATP-UHFFFAOYSA-N 1 1 341.377 3.826 20 10 EHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000121290830 1026290707 /nfs/dbraw/zinc/29/07/07/1026290707.db2.gz BGGSXPVAODTHEQ-UHFFFAOYSA-N 1 1 340.467 3.554 20 10 EHCDMO Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000273412793 1027417748 /nfs/dbraw/zinc/41/77/48/1027417748.db2.gz QCPNAGXCVDKXAP-SNVBAGLBSA-N 1 1 328.243 3.945 20 10 EHCDMO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cc(OC)c1OC ZINC000273441951 1027428072 /nfs/dbraw/zinc/42/80/72/1027428072.db2.gz YVYZXBXSJDKFAI-RYUDHWBXSA-N 1 1 349.402 3.969 20 10 EHCDMO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cc2c(cc1O)CCCC2 ZINC000273510382 1027468272 /nfs/dbraw/zinc/46/82/72/1027468272.db2.gz RSAPLUIQAKMDIU-SGTLLEGYSA-N 1 1 347.405 3.933 20 10 EHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000273533792 1027477750 /nfs/dbraw/zinc/47/77/50/1027477750.db2.gz VNRNOGUEAQFBHD-YLJYHZDGSA-N 1 1 345.414 3.892 20 10 EHCDMO C[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(N(C)C)cc1 ZINC000284386930 1029107283 /nfs/dbraw/zinc/10/72/83/1029107283.db2.gz OXTDGRWUJQCFAT-KRWDZBQOSA-N 1 1 334.467 3.848 20 10 EHCDMO COc1cccc([C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)OC)c1 ZINC000527733671 1031164534 /nfs/dbraw/zinc/16/45/34/1031164534.db2.gz DPLBYCOPXZBISB-INIZCTEOSA-N 1 1 339.794 3.671 20 10 EHCDMO CN1CCCc2cc(C[NH2+]Cc3ncc(C(F)(F)F)s3)ccc21 ZINC000278564703 1031395202 /nfs/dbraw/zinc/39/52/02/1031395202.db2.gz CXRSCUYPWWXNML-UHFFFAOYSA-N 1 1 341.402 3.834 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2cc(C)sc2C)ccc1[N+](=O)[O-] ZINC000278570100 1031417985 /nfs/dbraw/zinc/41/79/85/1031417985.db2.gz CRKIVTJCOUUBLB-SNVBAGLBSA-N 1 1 336.413 3.838 20 10 EHCDMO CC[C@H]([NH2+]C[C@H](Cc1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000796664112 1031730753 /nfs/dbraw/zinc/73/07/53/1031730753.db2.gz UPYCRNIYTSZORA-HKUYNNGSSA-N 1 1 330.447 3.745 20 10 EHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761202807 1034409592 /nfs/dbraw/zinc/40/95/92/1034409592.db2.gz MSRBTOOMUZIINO-QGZVFWFLSA-N 1 1 349.858 3.827 20 10 EHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c1O ZINC000186443118 1035634771 /nfs/dbraw/zinc/63/47/71/1035634771.db2.gz MXRLDQYYMCGNKX-IBGZPJMESA-N 1 1 345.826 3.686 20 10 EHCDMO CCc1cc(C[N@@H+](C)C[C@@H]2CCN(C(C)=O)C2)c(O)c(C(C)(C)C)c1 ZINC000165093528 1036242533 /nfs/dbraw/zinc/24/25/33/1036242533.db2.gz PQCIYRRDCJMXMV-KRWDZBQOSA-N 1 1 346.515 3.552 20 10 EHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000191501192 1036397039 /nfs/dbraw/zinc/39/70/39/1036397039.db2.gz ILTIJJXYTQPEOW-UHFFFAOYSA-N 1 1 335.806 3.668 20 10 EHCDMO C[C@@H](C(=O)Nc1ccc(F)cc1Cl)[N@@H+](C)Cc1ccccc1O ZINC000109773318 1036971615 /nfs/dbraw/zinc/97/16/15/1036971615.db2.gz CTNDTEWXHPNEEM-NSHDSACASA-N 1 1 336.794 3.644 20 10 EHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](CCO)C2CCCCC2)c1O ZINC000760864051 1037534134 /nfs/dbraw/zinc/53/41/34/1037534134.db2.gz PZDMFHREEWTBLT-KRWDZBQOSA-N 1 1 339.863 3.669 20 10 EHCDMO CC[N@@H+](Cc1c[nH]c(Br)c1)Cc1ccc(N(C)C)cc1 ZINC001233438294 1037593217 /nfs/dbraw/zinc/59/32/17/1037593217.db2.gz KPYAXCAMZATWPF-UHFFFAOYSA-N 1 1 336.277 3.865 20 10 EHCDMO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000180141220 1038056803 /nfs/dbraw/zinc/05/68/03/1038056803.db2.gz XSXMNHZPGQESBI-UHFFFAOYSA-N 1 1 329.415 3.960 20 10 EHCDMO C[C@@H](O)c1ncc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000278824121 1038390033 /nfs/dbraw/zinc/39/00/33/1038390033.db2.gz CBZOGKCSXIQCRK-OAHLLOKOSA-N 1 1 345.512 3.819 20 10 EHCDMO C[C@@H](O)c1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000278824121 1038390043 /nfs/dbraw/zinc/39/00/43/1038390043.db2.gz CBZOGKCSXIQCRK-OAHLLOKOSA-N 1 1 345.512 3.819 20 10 EHCDMO CCn1cc[nH+]c1NCc1cc(Cl)cc(Br)c1O ZINC000905414574 1038871959 /nfs/dbraw/zinc/87/19/59/1038871959.db2.gz OZCKPOMUWKYLJU-UHFFFAOYSA-N 1 1 330.613 3.637 20 10 EHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000905677441 1039035890 /nfs/dbraw/zinc/03/58/90/1039035890.db2.gz IMDYZYGEMPIQKB-CQSZACIVSA-N 1 1 333.325 3.576 20 10 EHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H]3c3ccnn3C)c2c1 ZINC000905742870 1039076885 /nfs/dbraw/zinc/07/68/85/1039076885.db2.gz VLQCRIQJPAXWLR-LJQANCHMSA-N 1 1 337.423 3.625 20 10 EHCDMO C[C@@H]([NH2+]C[C@](O)(c1ccccc1)C(F)(F)F)c1ccc(F)cc1O ZINC000185326258 1039077216 /nfs/dbraw/zinc/07/72/16/1039077216.db2.gz KVWYRMLKDKYZMF-BZNIZROVSA-N 1 1 343.320 3.632 20 10 EHCDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)Cc2ccc(N)cc2)cc1 ZINC000237351197 1039348642 /nfs/dbraw/zinc/34/86/42/1039348642.db2.gz UPGOTPUWFQKZNF-MRXNPFEDSA-N 1 1 337.467 3.824 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000164275946 1041233916 /nfs/dbraw/zinc/23/39/16/1041233916.db2.gz GCJLQPYLBQYYRV-SFHVURJKSA-N 1 1 333.378 3.861 20 10 EHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000164275946 1041233934 /nfs/dbraw/zinc/23/39/34/1041233934.db2.gz GCJLQPYLBQYYRV-SFHVURJKSA-N 1 1 333.378 3.861 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H]2CCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000278915817 1042935354 /nfs/dbraw/zinc/93/53/54/1042935354.db2.gz TYAQYXNVNLLUHZ-ZDUSSCGKSA-N 1 1 346.408 3.636 20 10 EHCDMO COc1c(O)c(C[NH2+][C@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000278947596 1043069605 /nfs/dbraw/zinc/06/96/05/1043069605.db2.gz YXJNBFFRXIBUAX-CYBMUJFWSA-N 1 1 330.384 3.777 20 10 EHCDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)c(O)c1OC ZINC000893678632 1043823941 /nfs/dbraw/zinc/82/39/41/1043823941.db2.gz NCHSKFWGFUGXLN-CQSZACIVSA-N 1 1 334.441 3.511 20 10 EHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c(O)c1OC ZINC000893678632 1043823955 /nfs/dbraw/zinc/82/39/55/1043823955.db2.gz NCHSKFWGFUGXLN-CQSZACIVSA-N 1 1 334.441 3.511 20 10 EHCDMO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)c(=O)n1C ZINC000279556898 1044227763 /nfs/dbraw/zinc/22/77/63/1044227763.db2.gz RKABFMWXFWZVPX-JTQLQIEISA-N 1 1 341.238 3.557 20 10 EHCDMO CCN1CC[NH+](Cc2ccc(N[C@@H](C)c3ccccc3O)cc2)CC1 ZINC000183649659 1125657891 /nfs/dbraw/zinc/65/78/91/1125657891.db2.gz XNLVMAWOPIKIAE-KRWDZBQOSA-N 1 1 339.483 3.703 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc(F)cc1O ZINC000184884750 1126707169 /nfs/dbraw/zinc/70/71/69/1126707169.db2.gz GZXZMLDCBLERBZ-QWHCGFSZSA-N 1 1 326.375 3.524 20 10 EHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N1CCc2sccc2C1 ZINC000185174145 1126803304 /nfs/dbraw/zinc/80/33/04/1126803304.db2.gz SNYXDVJVPDYDNS-OLZOCXBDSA-N 1 1 334.460 3.690 20 10 EHCDMO C[C@@H]([NH2+]C[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(F)cc1O ZINC000185400013 1126885498 /nfs/dbraw/zinc/88/54/98/1126885498.db2.gz OBCDBHBLHZZRLH-TZMCWYRMSA-N 1 1 338.423 3.581 20 10 EHCDMO CCCn1c(C)nnc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000764256032 1127471402 /nfs/dbraw/zinc/47/14/02/1127471402.db2.gz PPEDLHHBZKDYBO-UHFFFAOYSA-N 1 1 328.460 3.647 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccnc(Cl)c1)C[C@@H]1CCCO1 ZINC000171923095 1127629536 /nfs/dbraw/zinc/62/95/36/1127629536.db2.gz SYEJXGMKJNRIAZ-INIZCTEOSA-N 1 1 332.831 3.622 20 10 EHCDMO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)[C@@H]1SC ZINC000842922772 1127664816 /nfs/dbraw/zinc/66/48/16/1127664816.db2.gz DAMQGGNPHTUKAA-OBEQPXDXSA-N 1 1 349.418 3.971 20 10 EHCDMO c1ccc(-c2nnc(C[NH2+]Cc3ccc4c(c3)CCCO4)s2)cc1 ZINC000921840406 1128802734 /nfs/dbraw/zinc/80/27/34/1128802734.db2.gz NZAYHQQJNXHJPE-UHFFFAOYSA-N 1 1 337.448 3.820 20 10 EHCDMO Cc1cn(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c(C)[nH+]1 ZINC000760179073 1120311598 /nfs/dbraw/zinc/31/15/98/1120311598.db2.gz FWQUODWONAYRKD-UHFFFAOYSA-N 1 1 325.387 3.929 20 10 EHCDMO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCOCC3)cc2)c1 ZINC000153504993 1121238765 /nfs/dbraw/zinc/23/87/65/1121238765.db2.gz OIFMUPQWDUVXCO-NRFANRHFSA-N 1 1 340.442 3.999 20 10 EHCDMO C[C@H]1CCCC[C@H]1OCC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000915360686 1121359102 /nfs/dbraw/zinc/35/91/02/1121359102.db2.gz JXAKUIXKYPFVON-GHTZIAJQSA-N 1 1 346.515 3.550 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H](C)C1 ZINC000282127329 1121865635 /nfs/dbraw/zinc/86/56/35/1121865635.db2.gz BFCVKGOJXZXKAU-APWZRJJASA-N 1 1 341.451 3.971 20 10 EHCDMO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000917500719 1122617200 /nfs/dbraw/zinc/61/72/00/1122617200.db2.gz ZVVOJRIBKXIHFQ-HZPDHXFCSA-N 1 1 343.496 3.512 20 10 EHCDMO Cc1[nH+]ccn1CCN1CCCc2cc(OC(F)(F)F)ccc21 ZINC000918756682 1122907489 /nfs/dbraw/zinc/90/74/89/1122907489.db2.gz QNPATPVPBDRYOF-UHFFFAOYSA-N 1 1 325.334 3.543 20 10 EHCDMO CC[C@@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1cc(OC)ccc1O ZINC000180636408 1124041853 /nfs/dbraw/zinc/04/18/53/1124041853.db2.gz CUNRJMBPPYWRIP-SFHVURJKSA-N 1 1 343.423 3.527 20 10 EHCDMO CC[C@@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1cc(OC)ccc1O ZINC000180636408 1124041857 /nfs/dbraw/zinc/04/18/57/1124041857.db2.gz CUNRJMBPPYWRIP-SFHVURJKSA-N 1 1 343.423 3.527 20 10 EHCDMO COc1ccc(N2CCC[N@H+](Cc3ncc(C(C)C)s3)CC2)cc1 ZINC000183013721 1125420232 /nfs/dbraw/zinc/42/02/32/1125420232.db2.gz YWTFZSMCCSNFTA-UHFFFAOYSA-N 1 1 345.512 3.987 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ncc(C(C)C)s3)CC2)cc1 ZINC000183013721 1125420235 /nfs/dbraw/zinc/42/02/35/1125420235.db2.gz YWTFZSMCCSNFTA-UHFFFAOYSA-N 1 1 345.512 3.987 20 10 EHCDMO CCC[N@@H+](CCCOc1ccc2c(c1)OCO2)Cc1ccccc1O ZINC000727830834 1130598817 /nfs/dbraw/zinc/59/88/17/1130598817.db2.gz QEMDFIPLBSOPTK-UHFFFAOYSA-N 1 1 343.423 3.802 20 10 EHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1C(C)C ZINC000730256812 1130691604 /nfs/dbraw/zinc/69/16/04/1130691604.db2.gz BJZCYYXQYFWTRP-MRXNPFEDSA-N 1 1 348.487 3.923 20 10 EHCDMO CCCN(CCC)C(=O)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731845737 1130849640 /nfs/dbraw/zinc/84/96/40/1130849640.db2.gz IVTCOHXPUBRPOL-UHFFFAOYSA-N 1 1 332.488 3.785 20 10 EHCDMO O=c1[nH]c(C[N@H+](Cc2ccccc2O)C2CCCC2)nc2ccccc21 ZINC000731848139 1130849835 /nfs/dbraw/zinc/84/98/35/1130849835.db2.gz UFBZGBQRPWLVCJ-UHFFFAOYSA-N 1 1 349.434 3.986 20 10 EHCDMO CCc1cc(C[N@@H+](C)[C@H]2CCN(C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190705 1130891820 /nfs/dbraw/zinc/89/18/20/1130891820.db2.gz ZFUHQGXSXFVLOO-SFHVURJKSA-N 1 1 330.516 3.921 20 10 EHCDMO CCc1cc(CN(C)[C@H]2CC[N@@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190705 1130891826 /nfs/dbraw/zinc/89/18/26/1130891826.db2.gz ZFUHQGXSXFVLOO-SFHVURJKSA-N 1 1 330.516 3.921 20 10 EHCDMO CCc1cc(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732190705 1130891831 /nfs/dbraw/zinc/89/18/31/1130891831.db2.gz ZFUHQGXSXFVLOO-SFHVURJKSA-N 1 1 330.516 3.921 20 10 EHCDMO C[N@@H+](CCOC1CCCCCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000740873524 1131551204 /nfs/dbraw/zinc/55/12/04/1131551204.db2.gz IJTZUQQZEDGXFA-UHFFFAOYSA-N 1 1 346.515 3.694 20 10 EHCDMO CCN(CC)c1ccc(C[N@H+](C)CC(=O)N[C@@H]2CCCC[C@H]2C)cc1 ZINC000741678142 1131635008 /nfs/dbraw/zinc/63/50/08/1131635008.db2.gz KOSYNYGKUQXMDF-YLJYHZDGSA-N 1 1 345.531 3.660 20 10 EHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)N[C@@H]2CCCC[C@H]2C)cc1 ZINC000741678142 1131635011 /nfs/dbraw/zinc/63/50/11/1131635011.db2.gz KOSYNYGKUQXMDF-YLJYHZDGSA-N 1 1 345.531 3.660 20 10 EHCDMO CCOC(=O)CC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC1CC1 ZINC000743356981 1131898788 /nfs/dbraw/zinc/89/87/88/1131898788.db2.gz GEBMTOFCPXALKU-UHFFFAOYSA-N 1 1 349.471 3.561 20 10 EHCDMO CCN(CC)[C@H]1CC[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000743395444 1131909982 /nfs/dbraw/zinc/90/99/82/1131909982.db2.gz SBFHVRRFVQALGE-HNNXBMFYSA-N 1 1 342.483 3.933 20 10 EHCDMO CCN(CC)[C@H]1CC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000743395444 1131909986 /nfs/dbraw/zinc/90/99/86/1131909986.db2.gz SBFHVRRFVQALGE-HNNXBMFYSA-N 1 1 342.483 3.933 20 10 EHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1CCCCO1 ZINC000743870822 1131995942 /nfs/dbraw/zinc/99/59/42/1131995942.db2.gz CDXJWEILMCXXIO-CQSZACIVSA-N 1 1 328.250 3.546 20 10 EHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)Cc1ccc(C(=O)OC)cc1 ZINC001173731136 1132143124 /nfs/dbraw/zinc/14/31/24/1132143124.db2.gz SREVTMMFICWZAY-HNNXBMFYSA-N 1 1 327.424 3.632 20 10 EHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CN1C(=O)OC(C)(C)C ZINC001168884966 1132597152 /nfs/dbraw/zinc/59/71/52/1132597152.db2.gz UIGVTGMLKNOEQW-YJBOKZPZSA-N 1 1 347.503 3.582 20 10 EHCDMO Cc1cc(C(=O)C[N@@H+](C)CC2CCOCC2)c(C)n1-c1ccccc1 ZINC000767708900 1133041355 /nfs/dbraw/zinc/04/13/55/1133041355.db2.gz KBDSQMIEHISBAH-UHFFFAOYSA-N 1 1 340.467 3.635 20 10 EHCDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000768199021 1133107056 /nfs/dbraw/zinc/10/70/56/1133107056.db2.gz SPKLMRFJBURSQR-INIZCTEOSA-N 1 1 328.431 3.855 20 10 EHCDMO CN(C)c1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1 ZINC000768234919 1133115990 /nfs/dbraw/zinc/11/59/90/1133115990.db2.gz SASGMKQCTDKORQ-UHFFFAOYSA-N 1 1 332.451 3.918 20 10 EHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OC[C@@H]3O)c1C ZINC000768448797 1133140564 /nfs/dbraw/zinc/14/05/64/1133140564.db2.gz XNRCWRFHTOBNLN-ICSRJNTNSA-N 1 1 339.435 3.772 20 10 EHCDMO CCOc1ccc(C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c(O)c1 ZINC000768886672 1133196314 /nfs/dbraw/zinc/19/63/14/1133196314.db2.gz SKBLZDJSZGWWGL-UHFFFAOYSA-N 1 1 349.434 3.535 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H](O)c1c(Cl)cccc1Cl ZINC001178810189 1133200903 /nfs/dbraw/zinc/20/09/03/1133200903.db2.gz GJTRFLREEJLWDU-CYBMUJFWSA-N 1 1 348.176 3.800 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3nccc4ccccc43)CC2)cc1 ZINC000768998028 1133219076 /nfs/dbraw/zinc/21/90/76/1133219076.db2.gz JWEXNHVMOWQPDR-UHFFFAOYSA-N 1 1 347.462 3.956 20 10 EHCDMO CCOc1ccc(O)c(CN2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000769149008 1133235321 /nfs/dbraw/zinc/23/53/21/1133235321.db2.gz WUTABHWLPLUVDB-SFHVURJKSA-N 1 1 346.515 3.735 20 10 EHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccc2c1OCCCO2 ZINC000769200639 1133243054 /nfs/dbraw/zinc/24/30/54/1133243054.db2.gz FHANWCWDAPVXNZ-UHFFFAOYSA-N 1 1 327.424 3.966 20 10 EHCDMO Cc1cccc2c1CC[N@@H+](Cc1ccc(N3CCOCC3)c(F)c1)C2 ZINC000769339571 1133267039 /nfs/dbraw/zinc/26/70/39/1133267039.db2.gz SHJRUBIVBFCYDV-UHFFFAOYSA-N 1 1 340.442 3.529 20 10 EHCDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769444751 1133285165 /nfs/dbraw/zinc/28/51/65/1133285165.db2.gz FIUYHGPVDBHNIQ-GHTZIAJQSA-N 1 1 336.479 3.901 20 10 EHCDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769444752 1133285361 /nfs/dbraw/zinc/28/53/61/1133285361.db2.gz FIUYHGPVDBHNIQ-NQIIRXRSSA-N 1 1 336.479 3.901 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000769483144 1133288075 /nfs/dbraw/zinc/28/80/75/1133288075.db2.gz GOAUDIKTJINYJU-IBGZPJMESA-N 1 1 329.827 3.720 20 10 EHCDMO Oc1c(Br)cccc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000769446090 1133290903 /nfs/dbraw/zinc/29/09/03/1133290903.db2.gz MGLDQXRQUCKIEZ-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO Oc1c(Br)cccc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000769446090 1133290910 /nfs/dbraw/zinc/29/09/10/1133290910.db2.gz MGLDQXRQUCKIEZ-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO COc1cc(Br)cc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)c1O ZINC000769450889 1133292318 /nfs/dbraw/zinc/29/23/18/1133292318.db2.gz JFHJNUMMTBEPMP-MNOVXSKESA-N 1 1 328.250 3.641 20 10 EHCDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769469414 1133298007 /nfs/dbraw/zinc/29/80/07/1133298007.db2.gz XZMGTXGGYWLXDI-MRXNPFEDSA-N 1 1 340.442 3.782 20 10 EHCDMO CCC[N@@H+](Cc1cccc(OCC)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000769469956 1133298098 /nfs/dbraw/zinc/29/80/98/1133298098.db2.gz ILBGLEYKOYDTLH-ATZDWAIDSA-N 1 1 333.472 3.816 20 10 EHCDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769504194 1133303693 /nfs/dbraw/zinc/30/36/93/1133303693.db2.gz PKTMDBXUHTUSAQ-SFHVURJKSA-N 1 1 344.499 3.841 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(OC)cc3F)CC2)cc1 ZINC001179969434 1133315594 /nfs/dbraw/zinc/31/55/94/1133315594.db2.gz DVZRJIGNPZMDCV-UHFFFAOYSA-N 1 1 344.430 3.555 20 10 EHCDMO CCN(C)c1ccc(CN[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000773840942 1133342944 /nfs/dbraw/zinc/34/29/44/1133342944.db2.gz VDLJKPITZRAPIZ-PKOBYXMFSA-N 1 1 329.532 3.885 20 10 EHCDMO CCN(C)c1ccc(CN[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000773840942 1133342950 /nfs/dbraw/zinc/34/29/50/1133342950.db2.gz VDLJKPITZRAPIZ-PKOBYXMFSA-N 1 1 329.532 3.885 20 10 EHCDMO Cn1cc([C@@H]2C[C@H]2C[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC001180288407 1133357440 /nfs/dbraw/zinc/35/74/40/1133357440.db2.gz GFSCTYZHPGFFQB-QFBILLFUSA-N 1 1 325.456 3.674 20 10 EHCDMO Cc1cccc(C[NH+]2CCN(Cc3ccc(N(C)C)cc3C)CC2)c1 ZINC001180413310 1133372640 /nfs/dbraw/zinc/37/26/40/1133372640.db2.gz SKMPAKGEOLJQEC-UHFFFAOYSA-N 1 1 337.511 3.687 20 10 EHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2nsnc21 ZINC001180478911 1133374649 /nfs/dbraw/zinc/37/46/49/1133374649.db2.gz DZKKNOPXEXGVBP-UHFFFAOYSA-N 1 1 326.469 3.779 20 10 EHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000770288867 1133405370 /nfs/dbraw/zinc/40/53/70/1133405370.db2.gz CFBXGJFVHSLHRQ-CJNGLKHVSA-N 1 1 333.453 3.550 20 10 EHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)c(O)c1 ZINC000770350936 1133418586 /nfs/dbraw/zinc/41/85/86/1133418586.db2.gz QRAMLNFVMSKUDN-VLIAUNLRSA-N 1 1 327.424 3.615 20 10 EHCDMO CCOC(=O)[C@H](Cc1ccccc1)[N@H+](Cc1ccccc1O)C1CC1 ZINC000770511026 1133436199 /nfs/dbraw/zinc/43/61/99/1133436199.db2.gz VVSIEJDTMRUISN-IBGZPJMESA-N 1 1 339.435 3.531 20 10 EHCDMO CCOC(=O)[C@H](Cc1ccccc1)[N@@H+](Cc1ccccc1O)C1CC1 ZINC000770511026 1133436202 /nfs/dbraw/zinc/43/62/02/1133436202.db2.gz VVSIEJDTMRUISN-IBGZPJMESA-N 1 1 339.435 3.531 20 10 EHCDMO COc1cc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c(O)c(C(C)(C)C)c1 ZINC001181391471 1133486860 /nfs/dbraw/zinc/48/68/60/1133486860.db2.gz YTOXFPZHDVQQID-GDBMZVCRSA-N 1 1 335.488 3.824 20 10 EHCDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000771866954 1133603324 /nfs/dbraw/zinc/60/33/24/1133603324.db2.gz GFXYIXBZMAMSNO-FCHUYYIVSA-N 1 1 349.522 3.864 20 10 EHCDMO C[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774172380 1133628030 /nfs/dbraw/zinc/62/80/30/1133628030.db2.gz BSZWGRWZUXEXAC-JQWIXIFHSA-N 1 1 329.271 3.834 20 10 EHCDMO C[C@@H]([NH2+][C@@H]1CCn2ccnc2C1)c1cc(Cl)c(Cl)cc1O ZINC000774361946 1133665020 /nfs/dbraw/zinc/66/50/20/1133665020.db2.gz YVGVLKSCXFLAPZ-NXEZZACHSA-N 1 1 326.227 3.561 20 10 EHCDMO CCO[C@H](C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O)c1ccccc1 ZINC000774495525 1133689638 /nfs/dbraw/zinc/68/96/38/1133689638.db2.gz JGRZROODFZKWTH-IFXJQAMLSA-N 1 1 343.423 3.607 20 10 EHCDMO Oc1ccc(Cl)cc1CN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000772597878 1133707241 /nfs/dbraw/zinc/70/72/41/1133707241.db2.gz CXKAEFMHNXMHAV-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCCN(Cc2ccccc2)CC1 ZINC000772597878 1133707244 /nfs/dbraw/zinc/70/72/44/1133707244.db2.gz CXKAEFMHNXMHAV-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCN(Cc2ccccc2)CC1 ZINC000772597878 1133707247 /nfs/dbraw/zinc/70/72/47/1133707247.db2.gz CXKAEFMHNXMHAV-UHFFFAOYSA-N 1 1 330.859 3.754 20 10 EHCDMO COCC[N@@H+](Cc1scnc1C)Cc1cc(Cl)cc(C)c1O ZINC000787310203 1133994555 /nfs/dbraw/zinc/99/45/55/1133994555.db2.gz NFAGOYYYGWDWPB-UHFFFAOYSA-N 1 1 340.876 3.768 20 10 EHCDMO COc1c(O)c(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000774841265 1134049448 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EHCDMO CC[N@H+](Cc1ccncc1F)Cc1cc(Br)ccc1O ZINC000823477785 1137101820 /nfs/dbraw/zinc/10/18/20/1137101820.db2.gz XGGSPEXASREMNO-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO CC[N@@H+](Cc1ccncc1F)Cc1cc(Br)ccc1O ZINC000823477785 1137101821 /nfs/dbraw/zinc/10/18/21/1137101821.db2.gz XGGSPEXASREMNO-UHFFFAOYSA-N 1 1 339.208 3.711 20 10 EHCDMO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000777219182 1137119967 /nfs/dbraw/zinc/11/99/67/1137119967.db2.gz HUKPVAUTCFSFAC-OAHLLOKOSA-N 1 1 340.467 3.794 20 10 EHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CC[C@H]1O ZINC000824214211 1137128403 /nfs/dbraw/zinc/12/84/03/1137128403.db2.gz BYOKBZDWXIMXJA-DNVCBOLYSA-N 1 1 330.497 3.587 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000862221956 1137133100 /nfs/dbraw/zinc/13/31/00/1137133100.db2.gz LAAUINZZGRVHLR-OAHLLOKOSA-N 1 1 333.229 3.887 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000862247224 1137134848 /nfs/dbraw/zinc/13/48/48/1137134848.db2.gz XYVIJLGGLYMKJY-UHFFFAOYSA-N 1 1 340.261 3.547 20 10 EHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000862293573 1137137346 /nfs/dbraw/zinc/13/73/46/1137137346.db2.gz YJIPMSPBDPLQFU-HNNXBMFYSA-N 1 1 340.261 3.546 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000862507069 1137147549 /nfs/dbraw/zinc/14/75/49/1137147549.db2.gz UDOIGJNCTPNVHU-UHFFFAOYSA-N 1 1 348.494 3.903 20 10 EHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000862507069 1137147550 /nfs/dbraw/zinc/14/75/50/1137147550.db2.gz UDOIGJNCTPNVHU-UHFFFAOYSA-N 1 1 348.494 3.903 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824695772 1137148925 /nfs/dbraw/zinc/14/89/25/1137148925.db2.gz CMKOYSFRCFEWPG-MAZHCROVSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824695772 1137148927 /nfs/dbraw/zinc/14/89/27/1137148927.db2.gz CMKOYSFRCFEWPG-MAZHCROVSA-N 1 1 327.827 3.700 20 10 EHCDMO Oc1ccccc1C[N@H+](Cc1ccnn1-c1ccncc1)C1CCCC1 ZINC000824778925 1137151589 /nfs/dbraw/zinc/15/15/89/1137151589.db2.gz VJPHWZHJHAOZLB-UHFFFAOYSA-N 1 1 348.450 3.918 20 10 EHCDMO Oc1ccccc1C[N@@H+](Cc1ccnn1-c1ccncc1)C1CCCC1 ZINC000824778925 1137151591 /nfs/dbraw/zinc/15/15/91/1137151591.db2.gz VJPHWZHJHAOZLB-UHFFFAOYSA-N 1 1 348.450 3.918 20 10 EHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@H]1C ZINC000824821057 1137153721 /nfs/dbraw/zinc/15/37/21/1137153721.db2.gz SSQFNDZHRCPZKR-WBMJQRKESA-N 1 1 330.394 3.628 20 10 EHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C[C@H]1C ZINC000824821056 1137153915 /nfs/dbraw/zinc/15/39/15/1137153915.db2.gz SSQFNDZHRCPZKR-MLGOLLRUSA-N 1 1 330.394 3.628 20 10 EHCDMO CCOc1cccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c1O ZINC000824893274 1137155993 /nfs/dbraw/zinc/15/59/93/1137155993.db2.gz OIWSQDPHMAYJPZ-SJORKVTESA-N 1 1 331.456 3.572 20 10 EHCDMO C[C@]1(O)CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1 ZINC000794672329 1137222942 /nfs/dbraw/zinc/22/29/42/1137222942.db2.gz LPTDPWSFYDZFRB-FQEVSTJZSA-N 1 1 329.440 3.754 20 10 EHCDMO Cc1cc(C[N@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000794695533 1137235509 /nfs/dbraw/zinc/23/55/09/1137235509.db2.gz RGNMIZLCBUXVDO-OAQYLSRUSA-N 1 1 347.499 3.768 20 10 EHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Br)cc1[O-] ZINC000844923070 1137263304 /nfs/dbraw/zinc/26/33/04/1137263304.db2.gz GJKOBDGHHQWBPP-LBPRGKRZSA-N 1 1 349.272 3.725 20 10 EHCDMO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000846167578 1137337330 /nfs/dbraw/zinc/33/73/30/1137337330.db2.gz KXYXHUFTZHJKAM-SJLPKXTDSA-N 1 1 340.467 3.574 20 10 EHCDMO C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1nccn1C)c1ccc(F)cc1O ZINC000846207396 1137339245 /nfs/dbraw/zinc/33/92/45/1137339245.db2.gz NVDPXKJOOHANDC-KDOFPFPSSA-N 1 1 339.414 3.899 20 10 EHCDMO C[C@@H]([NH2+][C@H](Cc1ccccc1)c1nccn1C)c1ccc(F)cc1O ZINC000846207398 1137339363 /nfs/dbraw/zinc/33/93/63/1137339363.db2.gz NVDPXKJOOHANDC-RDTXWAMCSA-N 1 1 339.414 3.899 20 10 EHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC[C@@]2(C)C[C@]2(F)Cl)c1 ZINC000846184843 1137340304 /nfs/dbraw/zinc/34/03/04/1137340304.db2.gz OFQHZBNSZZNRPP-CIISACIHSA-N 1 1 329.799 3.534 20 10 EHCDMO C[C@H]([NH2+]Cc1ncc(Br)s1)c1cc(F)ccc1O ZINC000714933398 1137474508 /nfs/dbraw/zinc/47/45/08/1137474508.db2.gz PASMEHCPSYENFX-ZETCQYMHSA-N 1 1 331.210 3.601 20 10 EHCDMO COc1ccccc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000123496493 1137523591 /nfs/dbraw/zinc/52/35/91/1137523591.db2.gz QJIXDNQYLRPPBZ-SFHVURJKSA-N 1 1 327.424 3.582 20 10 EHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(Br)cc1O ZINC000825738589 1137613892 /nfs/dbraw/zinc/61/38/92/1137613892.db2.gz PVKFOXVJDPCBGP-KCJUWKMLSA-N 1 1 338.167 3.927 20 10 EHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)cc1Cl ZINC000825752447 1137624846 /nfs/dbraw/zinc/62/48/46/1137624846.db2.gz AWLOQQVQACJIEM-DEYYWGMASA-N 1 1 339.863 3.512 20 10 EHCDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876551205 1137655302 /nfs/dbraw/zinc/65/53/02/1137655302.db2.gz RIWOWOGJWWJQJZ-OAHLLOKOSA-N 1 1 342.508 3.829 20 10 EHCDMO COc1ccc(N2CCC[N@H+](Cc3scnc3Cl)CC2)cc1 ZINC000877983488 1137698252 /nfs/dbraw/zinc/69/82/52/1137698252.db2.gz MSHHZMNLNBQSSS-UHFFFAOYSA-N 1 1 337.876 3.517 20 10 EHCDMO COc1ccc(N2CCC[N@@H+](Cc3scnc3Cl)CC2)cc1 ZINC000877983488 1137698253 /nfs/dbraw/zinc/69/82/53/1137698253.db2.gz MSHHZMNLNBQSSS-UHFFFAOYSA-N 1 1 337.876 3.517 20 10 EHCDMO CC(C)(C)c1cc[nH+]c(NCc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000882634780 1137830460 /nfs/dbraw/zinc/83/04/60/1137830460.db2.gz LSYWICPUEXSSDR-UHFFFAOYSA-N 1 1 339.483 3.952 20 10 EHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000883088232 1137844285 /nfs/dbraw/zinc/84/42/85/1137844285.db2.gz XLEMYWKYZQYQSG-WBVHZDCISA-N 1 1 337.341 3.819 20 10 EHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1OCCc2sccc21 ZINC000883127540 1137845615 /nfs/dbraw/zinc/84/56/15/1137845615.db2.gz XUYGECCHPIURSW-FVMDXXJSSA-N 1 1 325.380 3.524 20 10 EHCDMO OCC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(Cl)c(F)c1 ZINC000883193609 1137848106 /nfs/dbraw/zinc/84/81/06/1137848106.db2.gz ZXTQEAIUBYGOTO-OAHLLOKOSA-N 1 1 345.748 3.676 20 10 EHCDMO CC[C@@H]([NH2+]Cc1cc(C)cc(Br)c1O)[C@@H]1CCCOC1 ZINC000883353008 1137856956 /nfs/dbraw/zinc/85/69/56/1137856956.db2.gz MJDCROMAERHQJF-IUODEOHRSA-N 1 1 342.277 3.758 20 10 EHCDMO C[C@@H]([NH2+]Cc1ccnc(OCC(F)(F)F)c1)c1c(O)cccc1F ZINC000886502998 1138085412 /nfs/dbraw/zinc/08/54/12/1138085412.db2.gz XJDCNFQDJVMIQS-SNVBAGLBSA-N 1 1 344.308 3.718 20 10 EHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(N2CCOCC2)cc1 ZINC000886512627 1138087318 /nfs/dbraw/zinc/08/73/18/1138087318.db2.gz JUJZSGZUBSFCLA-CABCVRRESA-N 1 1 344.430 3.780 20 10 EHCDMO C[C@H]([NH2+]CCCC(=O)N1Cc2ccccc2C1)c1c(O)cccc1F ZINC000886548094 1138094249 /nfs/dbraw/zinc/09/42/49/1138094249.db2.gz XDBOGXXPVIKTCI-AWEZNQCLSA-N 1 1 342.414 3.505 20 10 EHCDMO C[C@H](c1ccncc1)N1CCC([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886553242 1138095088 /nfs/dbraw/zinc/09/50/88/1138095088.db2.gz HPIZDYQAPSAPJW-LSDHHAIUSA-N 1 1 343.446 3.803 20 10 EHCDMO C[C@@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1ccc(F)cc1O ZINC000886710841 1138122117 /nfs/dbraw/zinc/12/21/17/1138122117.db2.gz HKWYXTSFWPCYLM-GDBMZVCRSA-N 1 1 337.435 3.548 20 10 EHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(Br)ccc2O)s1 ZINC000093773433 1138241064 /nfs/dbraw/zinc/24/10/64/1138241064.db2.gz UWFRONLEBNPJIM-UHFFFAOYSA-N 1 1 341.274 3.594 20 10 EHCDMO Cc1ncsc1C[N@H+](C)Cc1cc(Br)ccc1O ZINC000179425229 1139756001 /nfs/dbraw/zinc/75/60/01/1139756001.db2.gz BZIFPSUUNWQLRZ-UHFFFAOYSA-N 1 1 327.247 3.552 20 10 EHCDMO C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000184913272 1140125657 /nfs/dbraw/zinc/12/56/57/1140125657.db2.gz VNOYMAVKXKHVOP-SNVBAGLBSA-N 1 1 329.271 3.976 20 10 EHCDMO COc1ccc(OC(F)F)c(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185700643 1140164718 /nfs/dbraw/zinc/16/47/18/1140164718.db2.gz GCRIZMXZJQQHLQ-SNVBAGLBSA-N 1 1 341.329 3.992 20 10 EHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000192657876 1140542183 /nfs/dbraw/zinc/54/21/83/1140542183.db2.gz NPXQGWNRBWELKJ-MNOVXSKESA-N 1 1 329.271 3.834 20 10 EHCDMO c1cc2[nH+]ccc(NCc3ccc(N4CCOCC4)cc3)c2s1 ZINC000266171608 1140650425 /nfs/dbraw/zinc/65/04/25/1140650425.db2.gz ZHLIWEHMDWAFAW-UHFFFAOYSA-N 1 1 325.437 3.745 20 10 EHCDMO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)[nH]1 ZINC000271543417 1141393434 /nfs/dbraw/zinc/39/34/34/1141393434.db2.gz RDANAQPIIGXKDR-KGLIPLIRSA-N 1 1 345.466 3.908 20 10 EHCDMO