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@](O)(C[NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1cccs1 ZINC000183157699 1125762099 /nfs/dbraw/zinc/76/20/99/1125762099.db2.gz GHLSGBBYRGSIJU-NRFANRHFSA-N 1 0 369.486 4.030 20 10 FICDRO COc1cc(C[N@@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c(O)cc1C ZINC000160213953 1079636433 /nfs/dbraw/zinc/63/64/33/1079636433.db2.gz NAJDZXVDGKCCNB-UHFFFAOYSA-N 1 0 357.294 4.026 20 10 FICDRO COc1ccc(N2CCC[N@H+](CCCOc3cccc(Cl)c3)CC2)cc1 ZINC001167107623 1080552193 /nfs/dbraw/zinc/55/21/93/1080552193.db2.gz FNAHEXDNSAITJU-UHFFFAOYSA-N 1 0 374.912 4.330 20 10 FICDRO Cc1cc(Br)cc([C@H](C)[NH2+]Cc2cn3ccsc3n2)c1O ZINC000275362263 1080833335 /nfs/dbraw/zinc/83/33/35/1080833335.db2.gz SZRDQQNKTFAUER-JTQLQIEISA-N 1 0 366.284 4.023 20 10 FICDRO CCc1nc(C)c([C@@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)s1 ZINC000157354002 1082747302 /nfs/dbraw/zinc/74/73/02/1082747302.db2.gz WWNGQHSGQQTNRZ-CQSZACIVSA-N 1 0 359.539 4.342 20 10 FICDRO O=C(C[N@@H+]1CC[C@@]2(CCOC2)C1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255343739 1082762661 /nfs/dbraw/zinc/76/26/61/1082762661.db2.gz KUKXPWWZKGMCBC-OAQYLSRUSA-N 1 0 364.449 4.153 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc2c(c1)CCO2 ZINC000178204425 1082980504 /nfs/dbraw/zinc/98/05/04/1082980504.db2.gz AFNWGKPRNXPSKU-INIZCTEOSA-N 1 0 354.519 4.026 20 10 FICDRO C[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178253989 1083024700 /nfs/dbraw/zinc/02/47/00/1083024700.db2.gz MWZGRCKRXPPWES-QGZVFWFLSA-N 1 0 359.533 4.341 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)c1O ZINC000179616114 1083575549 /nfs/dbraw/zinc/57/55/49/1083575549.db2.gz YHTNWTYSVVAXLV-SNVBAGLBSA-N 1 0 353.340 4.186 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)c2ccccc2)n1 ZINC000277152006 1083857847 /nfs/dbraw/zinc/85/78/47/1083857847.db2.gz QJNVTFRPUQPYQU-BEFAXECRSA-N 1 0 351.450 4.335 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000178089999 1084669040 /nfs/dbraw/zinc/66/90/40/1084669040.db2.gz UFDVYDCRTSVANT-VLIAUNLRSA-N 1 0 358.432 4.140 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(OC)c1O)c1ccccc1OC(F)F ZINC000892561716 1084837965 /nfs/dbraw/zinc/83/79/65/1084837965.db2.gz RQGFZZLRQJMHJI-AWEZNQCLSA-N 1 0 367.392 4.252 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H]3CCCOc4ccc(F)cc43)CC2)cc1 ZINC000161265891 1084984460 /nfs/dbraw/zinc/98/44/60/1084984460.db2.gz QZPNQYBUFLQOEQ-NRFANRHFSA-N 1 0 370.468 4.307 20 10 FICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(Br)cc2)c1O ZINC000049514836 1085074679 /nfs/dbraw/zinc/07/46/79/1085074679.db2.gz UAHVSOUGFULNCY-GFCCVEGCSA-N 1 0 350.256 4.404 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3=O)cc2)cc1 ZINC000178444517 1085785481 /nfs/dbraw/zinc/78/54/81/1085785481.db2.gz SNHPJLABLGVOLT-KRWDZBQOSA-N 1 0 351.494 4.120 20 10 FICDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000121945488 1085787162 /nfs/dbraw/zinc/78/71/62/1085787162.db2.gz JQNKEQKFXNQUOL-LSDHHAIUSA-N 1 0 354.922 4.031 20 10 FICDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000121945349 1085787979 /nfs/dbraw/zinc/78/79/79/1085787979.db2.gz JQNKEQKFXNQUOL-CABCVRRESA-N 1 0 354.922 4.031 20 10 FICDRO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1cc(Br)ccc1O ZINC000313919715 1085818687 /nfs/dbraw/zinc/81/86/87/1085818687.db2.gz WEYQRVIAGMZHDF-OAHLLOKOSA-N 1 0 356.304 4.402 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(OC)c1OC)c1ccc(N(C)C)cc1 ZINC000164561984 1085882949 /nfs/dbraw/zinc/88/29/49/1085882949.db2.gz NSSPMLNCFIDTJA-GOSISDBHSA-N 1 0 358.482 4.019 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(Br)ccc1O ZINC000314026081 1085955937 /nfs/dbraw/zinc/95/59/37/1085955937.db2.gz AWLIBDWPGBVYBA-QGZVFWFLSA-N 1 0 363.299 4.462 20 10 FICDRO CC(=O)N(C)C1CC[NH+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CC1 ZINC000052085546 1086163320 /nfs/dbraw/zinc/16/33/20/1086163320.db2.gz ZHBVNRDBSWSRCG-UHFFFAOYSA-N 1 0 374.569 4.430 20 10 FICDRO COc1c(C)cc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1Cl ZINC000796704126 1086329337 /nfs/dbraw/zinc/32/93/37/1086329337.db2.gz WPUSAWSAAYLPHY-MRXNPFEDSA-N 1 0 374.912 4.344 20 10 FICDRO COc1c(C)cc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1Cl ZINC000796704125 1086329630 /nfs/dbraw/zinc/32/96/30/1086329630.db2.gz WPUSAWSAAYLPHY-INIZCTEOSA-N 1 0 374.912 4.344 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3coc(-c4cccs4)n3)CC2)cc1 ZINC000155025040 1086470630 /nfs/dbraw/zinc/47/06/30/1086470630.db2.gz HQKMMJZLEUVLDU-UHFFFAOYSA-N 1 0 369.490 4.170 20 10 FICDRO Fc1cc(F)cc(C[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)c1 ZINC000161733370 1086728635 /nfs/dbraw/zinc/72/86/35/1086728635.db2.gz YNNTZKWJJUNVFM-UHFFFAOYSA-N 1 0 368.374 4.325 20 10 FICDRO C[C@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccc(N2CCCCC2)c(F)c1 ZINC000161731195 1086732356 /nfs/dbraw/zinc/73/23/56/1086732356.db2.gz VLNGBFUTMZQCFD-INIZCTEOSA-N 1 0 362.489 4.152 20 10 FICDRO COc1ccc(C[C@@H]([NH2+]Cc2ccccc2O)c2ccccc2)cc1OC ZINC000066995897 1086865470 /nfs/dbraw/zinc/86/54/70/1086865470.db2.gz XKBRCBHDRLMKPN-HXUWFJFHSA-N 1 0 363.457 4.483 20 10 FICDRO COc1ccc(C[C@H]([NH2+]Cc2ccccc2O)c2ccccc2)cc1OC ZINC000066995896 1086866387 /nfs/dbraw/zinc/86/63/87/1086866387.db2.gz XKBRCBHDRLMKPN-FQEVSTJZSA-N 1 0 363.457 4.483 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1C(C)(C)C ZINC001648921300 1087588132 /nfs/dbraw/zinc/58/81/32/1087588132.db2.gz VCDRSFFPPHGXRT-UHFFFAOYSA-N 1 0 368.521 4.119 20 10 FICDRO C[C@H](c1ccccc1)[N@H+](CC(=O)N1CCC[C@H](C)C1)Cc1ccccc1O ZINC000255953825 1088240160 /nfs/dbraw/zinc/24/01/60/1088240160.db2.gz ULFVBFAICOZRQD-RBUKOAKNSA-N 1 0 366.505 4.214 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2c(-c3ccccc3)nc3sccn23)cc1 ZINC000014267349 1090442867 /nfs/dbraw/zinc/44/28/67/1090442867.db2.gz UNOOZQZVSLSLPC-UHFFFAOYSA-N 1 0 362.502 4.419 20 10 FICDRO CCO[C@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000193433034 1091282402 /nfs/dbraw/zinc/28/24/02/1091282402.db2.gz DKOHNUBXGBOAGY-HTAPYJJXSA-N 1 0 372.484 4.091 20 10 FICDRO CCOc1cccc(C[NH2+][C@@H](C)Cc2ccccc2Br)c1O ZINC000759838329 1091284392 /nfs/dbraw/zinc/28/43/92/1091284392.db2.gz ZSYPDRBSRZDVJR-ZDUSSCGKSA-N 1 0 364.283 4.274 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311298390 1091301174 /nfs/dbraw/zinc/30/11/74/1091301174.db2.gz IGMGRAOYQLWIJG-YESZJQIVSA-N 1 0 362.514 4.387 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311305404 1091516306 /nfs/dbraw/zinc/51/63/06/1091516306.db2.gz PSCUNSGBUYIDMR-IIBYNOLFSA-N 1 0 362.514 4.388 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000279602468 1091937834 /nfs/dbraw/zinc/93/78/34/1091937834.db2.gz WKXFPHPGQSQWQF-SNVBAGLBSA-N 1 0 370.327 4.179 20 10 FICDRO COc1ccc(C[NH2+]C23CCC(C(F)(F)F)(CC2)CC3)c(O)c1OC ZINC000894081893 1092888534 /nfs/dbraw/zinc/88/85/34/1092888534.db2.gz ILUKLDIWMDZVKS-UHFFFAOYSA-N 1 0 359.388 4.154 20 10 FICDRO COC1(C[C@H](C)[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 ZINC000759997720 1093101431 /nfs/dbraw/zinc/10/14/31/1093101431.db2.gz AKLBJVJBJRKIMW-HOTGVXAUSA-N 1 0 368.468 4.194 20 10 FICDRO CCc1cccc(C[NH2+][C@@H]2CC3(CCOCC3)Oc3ccccc32)c1O ZINC000895699222 1093679870 /nfs/dbraw/zinc/67/98/70/1093679870.db2.gz JHUMGEJCMGWNPP-LJQANCHMSA-N 1 0 353.462 4.117 20 10 FICDRO CC[C@H]([NH2+]Cc1ccccc1CN1CCCC1=O)c1ccc(C)cc1O ZINC000279973954 1093980707 /nfs/dbraw/zinc/98/07/07/1093980707.db2.gz DESJCLXISYROTI-FQEVSTJZSA-N 1 0 352.478 4.064 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cnc(-c3ccccc3F)s2)cc1F ZINC001648964671 1094293161 /nfs/dbraw/zinc/29/31/61/1094293161.db2.gz CAKNICMLEDYURV-UHFFFAOYSA-N 1 0 359.445 4.444 20 10 FICDRO CSCC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1nnc2ccccn21 ZINC000273367354 1096256369 /nfs/dbraw/zinc/25/63/69/1096256369.db2.gz FKCHFHAXOLZEHL-DOTOQJQBSA-N 1 0 370.522 4.197 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccc2c(c1)CC(=O)N2C ZINC000273599645 1096277582 /nfs/dbraw/zinc/27/75/82/1096277582.db2.gz RQRLPDJKNZHLBW-CABCVRRESA-N 1 0 360.457 4.476 20 10 FICDRO CN(Cc1cccs1)c1ccc(C[N@H+](C)Cc2cccc(=O)[nH]2)cc1 ZINC000897391364 1101591204 /nfs/dbraw/zinc/59/12/04/1101591204.db2.gz NATFXADLBLDCKA-UHFFFAOYSA-N 1 0 353.491 4.117 20 10 FICDRO Fc1ccc(Br)c2c1CC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000760327793 1101916665 /nfs/dbraw/zinc/91/66/65/1101916665.db2.gz VDDTZPBXMMNMNG-MRXNPFEDSA-N 1 0 362.242 4.300 20 10 FICDRO Cc1ccc([C@@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)N2CCCC2)cc1 ZINC001648986048 1102584692 /nfs/dbraw/zinc/58/46/92/1102584692.db2.gz MVECWLWTXNJVDZ-JOCHJYFZSA-N 1 0 355.501 4.127 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1CCC[C@H](C(F)(F)F)O1 ZINC001167982233 1102786090 /nfs/dbraw/zinc/78/60/90/1102786090.db2.gz ALSSIUKBCVAUQW-SJLPKXTDSA-N 1 0 369.383 4.487 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cccc(C(N)=O)c2)cc1 ZINC000028926568 1104454630 /nfs/dbraw/zinc/45/46/30/1104454630.db2.gz YNAMIYIGPDYWIF-UHFFFAOYSA-N 1 0 373.500 4.102 20 10 FICDRO COc1ccc(N2CCCN(c3cc[nH+]c4cc(F)ccc43)CC2)cc1 ZINC000301252916 1106972257 /nfs/dbraw/zinc/97/22/57/1106972257.db2.gz JTRZOQRHNSHGDB-UHFFFAOYSA-N 1 0 351.425 4.099 20 10 FICDRO COc1ccc(N2CC[NH+](CCSC3CCCCC3)CC2)cc1F ZINC001168066669 1107180090 /nfs/dbraw/zinc/18/00/90/1107180090.db2.gz BWCOEISEGDCOPZ-UHFFFAOYSA-N 1 0 352.519 4.022 20 10 FICDRO CCc1noc(C2CCC([NH2+]Cc3c(C)c4ccccc4n3C)CC2)n1 ZINC000527528408 1109775298 /nfs/dbraw/zinc/77/52/98/1109775298.db2.gz OSRNYCAQDUHPNX-UHFFFAOYSA-N 1 0 352.482 4.248 20 10 FICDRO COc1ccc([C@H]([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C2CC2)cn1 ZINC000528044856 1109897475 /nfs/dbraw/zinc/89/74/75/1109897475.db2.gz VYHGFJRVHJLEPZ-JLCFBVMHSA-N 1 0 352.478 4.477 20 10 FICDRO Cc1cccc(C[NH2+][C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1O ZINC000529671059 1110303739 /nfs/dbraw/zinc/30/37/39/1110303739.db2.gz YIOIPENSCZJZBZ-KRWDZBQOSA-N 1 0 353.293 4.400 20 10 FICDRO CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc2c(c1)OCCO2 ZINC000479463227 1112033507 /nfs/dbraw/zinc/03/35/07/1112033507.db2.gz RQWXTASOYMXZRC-SFHVURJKSA-N 1 0 350.462 4.499 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CCSC[C@H]3C3CCC3)cc2)CC1 ZINC000842170526 1112423209 /nfs/dbraw/zinc/42/32/09/1112423209.db2.gz HVRNMFKGCRUBSQ-NRFANRHFSA-N 1 0 360.567 4.019 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H](O)c1ccc(Cl)cc1 ZINC000111232808 1112890159 /nfs/dbraw/zinc/89/01/59/1112890159.db2.gz ZSZUJNJXKUDNDG-HXUWFJFHSA-N 1 0 357.837 4.374 20 10 FICDRO CSc1cc(Br)ccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001649009536 1113881863 /nfs/dbraw/zinc/88/18/63/1113881863.db2.gz CNBPMEWLBVKZMW-UHFFFAOYSA-N 1 0 364.308 4.396 20 10 FICDRO CC[C@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1O ZINC000155875971 1113927869 /nfs/dbraw/zinc/92/78/69/1113927869.db2.gz GCWSFTPOLLYZGP-ZBFHGGJFSA-N 1 0 362.420 4.313 20 10 FICDRO Cc1cc(C[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)c(C)o1 ZINC000163622090 1114241319 /nfs/dbraw/zinc/24/13/19/1114241319.db2.gz TVBQMQLDTYCYFG-UHFFFAOYSA-N 1 0 368.399 4.042 20 10 FICDRO CNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)cc1 ZINC000151028252 1114271462 /nfs/dbraw/zinc/27/14/62/1114271462.db2.gz LWAXOJSDPDBVNI-GOSISDBHSA-N 1 0 365.521 4.277 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OC[C@H]1CCOC1)c1ccccc1O ZINC000156309636 1114382993 /nfs/dbraw/zinc/38/29/93/1114382993.db2.gz DIQYFMXRPJUTPI-PXNSSMCTSA-N 1 0 355.478 4.357 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)[C@@]12CCCO2 ZINC000760881430 1115119938 /nfs/dbraw/zinc/11/99/38/1115119938.db2.gz ORCVRSRAQMBHQQ-YCZSINBZSA-N 1 0 358.526 4.054 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cn3cc(Br)cc(C)c3n2)c1 ZINC000760882695 1115121184 /nfs/dbraw/zinc/12/11/84/1115121184.db2.gz ZENYLFRVGAHRTC-CYBMUJFWSA-N 1 0 374.282 4.270 20 10 FICDRO CC[C@H](Nc1cccc(N2CC[NH+](C(C)C)CC2)c1)c1ccccc1O ZINC000157483090 1115143318 /nfs/dbraw/zinc/14/33/18/1115143318.db2.gz JKHBJGGNSSABSF-NRFANRHFSA-N 1 0 353.510 4.486 20 10 FICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000157662587 1115231106 /nfs/dbraw/zinc/23/11/06/1115231106.db2.gz HPQNWAWZIKWMIX-VGSWGCGISA-N 1 0 354.494 4.334 20 10 FICDRO CC[C@@H]([NH2+]C[C@H]1CSCCS1)c1cc(Br)ccc1O ZINC000229583414 1115857599 /nfs/dbraw/zinc/85/75/99/1115857599.db2.gz GITVQIIJEJGGFF-WCQYABFASA-N 1 0 362.358 4.044 20 10 FICDRO CCOCc1cc(C[NH2+]C[C@H](c2ccc(C)o2)N2CCCC2)ccc1OC ZINC000171133914 1115840517 /nfs/dbraw/zinc/84/05/17/1115840517.db2.gz RXEGCDUNEYJYLE-HXUWFJFHSA-N 1 0 372.509 4.060 20 10 FICDRO C[NH+]1CCC(N2C(=O)/C(=C/c3ccc(C(C)(C)C)cc3)SC2=S)CC1 ZINC000063824248 1116115025 /nfs/dbraw/zinc/11/50/25/1116115025.db2.gz YWSBKUKIQQEHFO-LGMDPLHJSA-N 1 0 374.575 4.280 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)cc1 ZINC000174403012 1116132712 /nfs/dbraw/zinc/13/27/12/1116132712.db2.gz JFTDYNQRMBVLJB-FQEVSTJZSA-N 1 0 374.912 4.254 20 10 FICDRO CC(C)(C)CCCC(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC001127267791 1119385631 /nfs/dbraw/zinc/38/56/31/1119385631.db2.gz MMCUWKLHAKFTOG-UHFFFAOYSA-N 1 0 371.569 4.051 20 10 FICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1[N+](=O)[O-] ZINC000153389360 1120606302 /nfs/dbraw/zinc/60/63/02/1120606302.db2.gz XQMIYEAKYUQKOC-CYBMUJFWSA-N 1 0 361.417 4.049 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](CC(C)C)CC2)c(C)n1-c1cccc(C)c1 ZINC000914880230 1120621382 /nfs/dbraw/zinc/62/13/82/1120621382.db2.gz YGEFMYVNWCFQPL-UHFFFAOYSA-N 1 0 367.537 4.253 20 10 FICDRO CCCn1ccnc1CCC[N@H+](C)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000762073333 1120695111 /nfs/dbraw/zinc/69/51/11/1120695111.db2.gz IOMOAPGSHSOFDX-UHFFFAOYSA-N 1 0 373.541 4.369 20 10 FICDRO Clc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CCC2 ZINC000762476266 1120913595 /nfs/dbraw/zinc/91/35/95/1120913595.db2.gz OSKWFUASPWMIQF-OAQYLSRUSA-N 1 0 356.897 4.344 20 10 FICDRO OC1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(Cl)cc43)cc2F)CC1 ZINC000763397062 1121571963 /nfs/dbraw/zinc/57/19/63/1121571963.db2.gz UZZVWFLOPMJJTJ-HXUWFJFHSA-N 1 0 374.887 4.217 20 10 FICDRO CN(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001649091532 1121729358 /nfs/dbraw/zinc/72/93/58/1121729358.db2.gz QUAYYGJBOFHORH-UPVQGACJSA-N 1 0 363.549 4.212 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCCn2ccnc2C)cc1 ZINC000916836208 1121877601 /nfs/dbraw/zinc/87/76/01/1121877601.db2.gz FWHXSGHDLHOZGR-UHFFFAOYSA-N 1 0 362.521 4.398 20 10 FICDRO C[N@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccc(N2CCCCC2)cc1 ZINC000917020957 1122007900 /nfs/dbraw/zinc/00/79/00/1122007900.db2.gz XDCSKRFIARCEOX-UHFFFAOYSA-N 1 0 369.484 4.277 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](OC(C)C)c2ccccc2OC)c1 ZINC000186384038 1122077716 /nfs/dbraw/zinc/07/77/16/1122077716.db2.gz YEHMYBFEUZILBM-VFNWGFHPSA-N 1 0 359.466 4.226 20 10 FICDRO Fc1cccc(Cl)c1[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCC1 ZINC000917394691 1122286593 /nfs/dbraw/zinc/28/65/93/1122286593.db2.gz OJYWWDOCPFWAPA-LJQANCHMSA-N 1 0 374.887 4.341 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](C(C)(C)C)CC2)c(C)n1-c1ccc(F)cc1 ZINC000917406447 1122298219 /nfs/dbraw/zinc/29/82/19/1122298219.db2.gz IWTUYJQGTHXWGT-UHFFFAOYSA-N 1 0 371.500 4.226 20 10 FICDRO Cc1cc(O)c(CN(C)Cc2cnn(-c3ccccc3)n2)cc1C(C)C ZINC000917453976 1122319682 /nfs/dbraw/zinc/31/96/82/1122319682.db2.gz ZQZXMSQWQYIXCR-UHFFFAOYSA-N 1 0 350.466 4.037 20 10 FICDRO Oc1cc2c(cc1C[N@H+](Cc1ccccc1C(F)(F)F)C1CC1)OCO2 ZINC000917473528 1122321312 /nfs/dbraw/zinc/32/13/12/1122321312.db2.gz DAHDVRCAWVXGIP-UHFFFAOYSA-N 1 0 365.351 4.304 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCCN(C(=O)c3ccsc3)CC2)cc1C(C)C ZINC000917487655 1122332761 /nfs/dbraw/zinc/33/27/61/1122332761.db2.gz JORGTNZUEYTIEW-UHFFFAOYSA-N 1 0 372.534 4.234 20 10 FICDRO Cc1cc(CC[NH2+]Cc2c[nH]nc2-c2cccnc2)c(C)n1-c1ccccc1 ZINC000918199138 1122589194 /nfs/dbraw/zinc/58/91/94/1122589194.db2.gz UNPUXOHSJCGHSU-UHFFFAOYSA-N 1 0 371.488 4.212 20 10 FICDRO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H](c2ccccc2)O1 ZINC000920306514 1123437622 /nfs/dbraw/zinc/43/76/22/1123437622.db2.gz VZGOLZIMOSFEQG-QRWLVFNGSA-N 1 0 355.478 4.357 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)c(C)n1-c1ccccc1C ZINC000921208176 1123583622 /nfs/dbraw/zinc/58/36/22/1123583622.db2.gz WRNFCABGWAFEAW-FQEVSTJZSA-N 1 0 365.521 4.103 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)c(C)n1-c1cccc(C)c1 ZINC000921207514 1123584073 /nfs/dbraw/zinc/58/40/73/1123584073.db2.gz KFKBDINNDQLRLD-NRFANRHFSA-N 1 0 365.521 4.103 20 10 FICDRO Cc1ccc(CNC(=O)c2cccc(C[NH2+]Cc3cccc(C)c3O)c2)cc1 ZINC000179671216 1124023611 /nfs/dbraw/zinc/02/36/11/1124023611.db2.gz WGCADWZOLXZMLS-UHFFFAOYSA-N 1 0 374.484 4.229 20 10 FICDRO COc1ccc(O)c(C[N@H+](C)CCCc2cc(-c3ccccc3)no2)c1 ZINC000179909299 1124139125 /nfs/dbraw/zinc/13/91/25/1124139125.db2.gz KCLIBGAMHSAHEG-UHFFFAOYSA-N 1 0 352.434 4.120 20 10 FICDRO CCC(CC)(C[NH2+]Cc1cccc(OC)c1O)c1ccc(OC)c(OC)c1 ZINC000763472512 1124218032 /nfs/dbraw/zinc/21/80/32/1124218032.db2.gz VYKLLSCUSSUTMM-UHFFFAOYSA-N 1 0 373.493 4.266 20 10 FICDRO COc1ccc([C@@H](CCO)[NH2+]Cc2cc(-c3ccccc3)ccc2O)cc1 ZINC000763495306 1124937346 /nfs/dbraw/zinc/93/73/46/1124937346.db2.gz BWMXMZAYXROLBI-JOCHJYFZSA-N 1 0 363.457 4.281 20 10 FICDRO CCOc1cccc(C[NH+]2CCC(OCc3ccc(F)cc3)CC2)c1O ZINC000181532162 1125002703 /nfs/dbraw/zinc/00/27/03/1125002703.db2.gz ADLCXMRICGIWQK-UHFFFAOYSA-N 1 0 359.441 4.111 20 10 FICDRO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143104226 1125265157 /nfs/dbraw/zinc/26/51/57/1125265157.db2.gz QYJXYHRGVJRLBM-YJBOKZPZSA-N 1 0 374.525 4.131 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1c[nH]nc1-c1cccs1)C[C@H]1CCCO1 ZINC000160178374 1079548071 /nfs/dbraw/zinc/54/80/71/1079548071.db2.gz UISAYVIOLHFXFN-QGZVFWFLSA-N 1 0 369.490 4.025 20 10 FICDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(N2CCOCC2)cc1Cl ZINC000120414202 1080040715 /nfs/dbraw/zinc/04/07/15/1080040715.db2.gz IFWYXFFXTHANJP-KDOFPFPSSA-N 1 0 354.947 4.113 20 10 FICDRO C[C@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(N2CCOCC2)cc1 ZINC000155392518 1080888291 /nfs/dbraw/zinc/88/82/91/1080888291.db2.gz BKSYULQYMYJQHH-JXFKEZNVSA-N 1 0 354.519 4.411 20 10 FICDRO CCC[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc(F)cc1F ZINC001167237762 1080890818 /nfs/dbraw/zinc/89/08/18/1080890818.db2.gz RXVQRZWULGJNKT-UHFFFAOYSA-N 1 0 360.448 4.214 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(N3CCCC3=O)c2)cc1F ZINC001648802884 1080960119 /nfs/dbraw/zinc/96/01/19/1080960119.db2.gz WAMANDIHOLBCCH-UHFFFAOYSA-N 1 0 369.484 4.089 20 10 FICDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H]1C ZINC001648826648 1081262485 /nfs/dbraw/zinc/26/24/85/1081262485.db2.gz NEWDHQYABXXZFU-BFYDXBDKSA-N 1 0 370.459 4.456 20 10 FICDRO Cc1ccc(C)c(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)c1 ZINC001648835316 1081276604 /nfs/dbraw/zinc/27/66/04/1081276604.db2.gz IRIQWXGAACPFOA-HDICACEKSA-N 1 0 356.485 4.346 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2coc3ccccc23)SC1=S ZINC000160320981 1081333935 /nfs/dbraw/zinc/33/39/35/1081333935.db2.gz UFZOWDZPEPQHQL-SXGWCWSVSA-N 1 0 374.531 4.222 20 10 FICDRO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000048747234 1081834677 /nfs/dbraw/zinc/83/46/77/1081834677.db2.gz UACMZHALDQYITD-KRWDZBQOSA-N 1 0 350.462 4.429 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)c1ccc(N(C)C)cc1 ZINC000160477689 1081905843 /nfs/dbraw/zinc/90/58/43/1081905843.db2.gz BLWMGQFQCUEQMB-GOSISDBHSA-N 1 0 352.526 4.235 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccnc(Oc4ccccc4)c3)cc2)CC1 ZINC001167431312 1082095325 /nfs/dbraw/zinc/09/53/25/1082095325.db2.gz RWGZVFBNYUEAMM-UHFFFAOYSA-N 1 0 374.488 4.238 20 10 FICDRO CC[C@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000160721790 1082274393 /nfs/dbraw/zinc/27/43/93/1082274393.db2.gz ZHIYLXPVRKTBNX-FCHUYYIVSA-N 1 0 365.521 4.157 20 10 FICDRO COc1ccc(Cl)cc1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000096971092 1082657552 /nfs/dbraw/zinc/65/75/52/1082657552.db2.gz ZEROMZMFQYDOMR-GOSISDBHSA-N 1 0 361.869 4.235 20 10 FICDRO C[C@@H]([NH2+]CCCOCC1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000157409908 1082803104 /nfs/dbraw/zinc/80/31/04/1082803104.db2.gz MNTKXYITSGMQSE-LJQANCHMSA-N 1 0 360.542 4.161 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc2c(c1)CCO2 ZINC000178204437 1082980739 /nfs/dbraw/zinc/98/07/39/1082980739.db2.gz AFNWGKPRNXPSKU-MRXNPFEDSA-N 1 0 354.519 4.026 20 10 FICDRO CC[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H](C)c1cccc(OC)c1 ZINC000179470088 1083471678 /nfs/dbraw/zinc/47/16/78/1083471678.db2.gz FVECRKGGPWRFSN-SFHVURJKSA-N 1 0 354.494 4.115 20 10 FICDRO Cc1c(O)ccc(C[N@@H+](C)[C@H](C)c2cccc(Br)c2)c1O ZINC001140749775 1083906032 /nfs/dbraw/zinc/90/60/32/1083906032.db2.gz MKWWPZKUQNETQY-GFCCVEGCSA-N 1 0 350.256 4.362 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1ccc(N(C)C)cc1 ZINC000177837328 1084367517 /nfs/dbraw/zinc/36/75/17/1084367517.db2.gz LYVIYOIEFMGKMT-INIZCTEOSA-N 1 0 363.461 4.449 20 10 FICDRO C[C@H]([NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(N(C)C)cc1 ZINC000177937624 1084480664 /nfs/dbraw/zinc/48/06/64/1084480664.db2.gz RBJKAJNIYQKWHJ-OYHNWAKOSA-N 1 0 352.478 4.326 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1)c1ccc(N2CCCCCC2)cc1 ZINC000178182766 1084815966 /nfs/dbraw/zinc/81/59/66/1084815966.db2.gz AVCFLCDRSDYIIP-QGZVFWFLSA-N 1 0 351.494 4.017 20 10 FICDRO C[C@@H](c1ccccc1)[N@H+](CC(=O)NC1CCCC1)Cc1ccccc1O ZINC000176674314 1085054676 /nfs/dbraw/zinc/05/46/76/1085054676.db2.gz VJIOELQKHUAUTC-KRWDZBQOSA-N 1 0 352.478 4.014 20 10 FICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)c1O ZINC000049514833 1085074040 /nfs/dbraw/zinc/07/40/40/1085074040.db2.gz UAHVSOUGFULNCY-LBPRGKRZSA-N 1 0 350.256 4.404 20 10 FICDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000125245286 1085370182 /nfs/dbraw/zinc/37/01/82/1085370182.db2.gz VEGBLNWCXIKGLW-MRXNPFEDSA-N 1 0 366.933 4.177 20 10 FICDRO C[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000178643580 1085603360 /nfs/dbraw/zinc/60/33/60/1085603360.db2.gz YONSXOGLESLNBT-DENIHFKCSA-N 1 0 352.522 4.494 20 10 FICDRO COc1ccccc1[C@@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178443409 1085774561 /nfs/dbraw/zinc/77/45/61/1085774561.db2.gz HOYAQIBQJJWEGR-UWJYYQICSA-N 1 0 354.494 4.070 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3=O)cc2)cc1 ZINC000178444507 1085785200 /nfs/dbraw/zinc/78/52/00/1085785200.db2.gz SNHPJLABLGVOLT-QGZVFWFLSA-N 1 0 351.494 4.120 20 10 FICDRO C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000166609610 1086003989 /nfs/dbraw/zinc/00/39/89/1086003989.db2.gz HVAIEANQOQZMON-RTFZILSDSA-N 1 0 350.506 4.376 20 10 FICDRO C[C@H]([NH2+]CCCn1cc(Br)cn1)c1ccc2ccccc2c1O ZINC000323349989 1088311663 /nfs/dbraw/zinc/31/16/63/1088311663.db2.gz SIICPXJLKWGFHE-ZDUSSCGKSA-N 1 0 374.282 4.245 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)CC[C@H]2C)C1 ZINC001126429928 1089139200 /nfs/dbraw/zinc/13/92/00/1089139200.db2.gz YJZBCYDYCJSOAB-QZTJIDSGSA-N 1 0 367.537 4.055 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)[C@@H](C)C2(C)CC2)C1 ZINC000435806270 1089954181 /nfs/dbraw/zinc/95/41/81/1089954181.db2.gz CKYBIODRRJKYMP-KRWDZBQOSA-N 1 0 367.537 4.055 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000185401919 1090540028 /nfs/dbraw/zinc/54/00/28/1090540028.db2.gz FPVXNBIHJNHOBP-QGZVFWFLSA-N 1 0 354.494 4.488 20 10 FICDRO COc1ccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)c(O)c1OC ZINC000893305035 1090869940 /nfs/dbraw/zinc/86/99/40/1090869940.db2.gz QWVWZYGLJNAXHR-HNNXBMFYSA-N 1 0 363.841 4.066 20 10 FICDRO Cc1cc(C(=O)N(C)C2CC[NH2+]CC2)c(C)n1-c1ccc(C(C)C)cc1 ZINC000236857614 1092069118 /nfs/dbraw/zinc/06/91/18/1092069118.db2.gz NWRNMZSLIKEPPN-UHFFFAOYSA-N 1 0 353.510 4.042 20 10 FICDRO COC1(C[C@@H](C)[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 ZINC000759997719 1093101822 /nfs/dbraw/zinc/10/18/22/1093101822.db2.gz AKLBJVJBJRKIMW-CVEARBPZSA-N 1 0 368.468 4.194 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cccc(CO)c2)cc1 ZINC000236966479 1093237950 /nfs/dbraw/zinc/23/79/50/1093237950.db2.gz UZONHOLSYSBJQA-UHFFFAOYSA-N 1 0 360.501 4.495 20 10 FICDRO OC1CCN(c2ccc(C[NH2+]Cc3ccc(C(F)F)c(F)c3)cc2)CC1 ZINC000895451902 1093542505 /nfs/dbraw/zinc/54/25/05/1093542505.db2.gz USHFELQOSDLSKM-UHFFFAOYSA-N 1 0 364.411 4.014 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3ccc(OC(F)F)cc3)CC2)cc1 ZINC000108722663 1093711404 /nfs/dbraw/zinc/71/14/04/1093711404.db2.gz YBHFNIPMXSGNGW-UHFFFAOYSA-N 1 0 362.420 4.009 20 10 FICDRO CC[C@@H]([NH2+]Cc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(C)cc1O ZINC000279969973 1093896643 /nfs/dbraw/zinc/89/66/43/1093896643.db2.gz CVTRGCDGKRDCND-TZIWHRDSSA-N 1 0 368.477 4.059 20 10 FICDRO CC[C@H]([NH2+][C@H](Cc1nc(C)no1)c1ccccc1)c1ccc(C)cc1O ZINC000280012995 1094282440 /nfs/dbraw/zinc/28/24/40/1094282440.db2.gz GTLRAYSFQMHIOM-RBUKOAKNSA-N 1 0 351.450 4.417 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)c(O)c1C ZINC000281151690 1095496477 /nfs/dbraw/zinc/49/64/77/1095496477.db2.gz AXPGLBYSCXNTPO-CYBMUJFWSA-N 1 0 354.372 4.196 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)N3CCCCC3)cc2)c(O)c1C ZINC000273357077 1096254488 /nfs/dbraw/zinc/25/44/88/1096254488.db2.gz CYOXPQSBCHVYFL-GOSISDBHSA-N 1 0 366.505 4.486 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)c(O)c1C ZINC000273359464 1096255577 /nfs/dbraw/zinc/25/55/77/1096255577.db2.gz DHYVTCAGRLMNRM-ROUUACIJSA-N 1 0 353.510 4.280 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc2ccccc2c1O ZINC000273409096 1096259871 /nfs/dbraw/zinc/25/98/71/1096259871.db2.gz PGIKBJPOXGVGBE-KRWDZBQOSA-N 1 0 362.473 4.233 20 10 FICDRO CCc1ccc(C(C)(C)[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000237131822 1096685863 /nfs/dbraw/zinc/68/58/63/1096685863.db2.gz AQPOQLZYYGFTBF-UHFFFAOYSA-N 1 0 356.485 4.250 20 10 FICDRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000237382895 1099455821 /nfs/dbraw/zinc/45/58/21/1099455821.db2.gz MEYWTAAXSWLGSI-GFCCVEGCSA-N 1 0 368.458 4.404 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)CCCC2 ZINC000237390712 1099467180 /nfs/dbraw/zinc/46/71/80/1099467180.db2.gz ANUAFHGTEPXQQJ-QGZVFWFLSA-N 1 0 368.496 4.392 20 10 FICDRO CCc1cccc(C[NH2+]Cc2csc(=NC(=O)OC(C)(C)C)[nH]2)c1O ZINC000898104039 1102176828 /nfs/dbraw/zinc/17/68/28/1102176828.db2.gz WWUUXRNMZJGDJK-UHFFFAOYSA-N 1 0 363.483 4.048 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000785414297 1102340486 /nfs/dbraw/zinc/34/04/86/1102340486.db2.gz XLBLSNLDJOMSIY-UHFFFAOYSA-N 1 0 374.410 4.451 20 10 FICDRO C[C@@H]([NH2+]CCCn1cc(Br)cn1)c1ccc2ccccc2c1O ZINC000323349987 1102525722 /nfs/dbraw/zinc/52/57/22/1102525722.db2.gz SIICPXJLKWGFHE-CYBMUJFWSA-N 1 0 374.282 4.245 20 10 FICDRO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648985223 1102571005 /nfs/dbraw/zinc/57/10/05/1102571005.db2.gz BGGQUWLCUUKIDA-XQFWAAQXSA-N 1 0 358.570 4.446 20 10 FICDRO C[C@H](CC[NH2+][C@@H](C)c1cc(Br)cc(F)c1[O-])[NH+]1CCCCC1 ZINC000757659036 1102823035 /nfs/dbraw/zinc/82/30/35/1102823035.db2.gz VCTLVDRRLKSXRF-OLZOCXBDSA-N 1 0 373.310 4.209 20 10 FICDRO CC(C)(C)C(=O)NCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000729684465 1103047162 /nfs/dbraw/zinc/04/71/62/1103047162.db2.gz UKRVLCHFBLWUBT-UHFFFAOYSA-N 1 0 362.558 4.239 20 10 FICDRO Cc1ccccc1CC(C)(C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000729685806 1103193995 /nfs/dbraw/zinc/19/39/95/1103193995.db2.gz QKTIFKXEJDUELY-UHFFFAOYSA-N 1 0 356.485 4.082 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC001648956659 1104393260 /nfs/dbraw/zinc/39/32/60/1104393260.db2.gz RBMSKBYMGXRJHQ-GOSISDBHSA-N 1 0 363.505 4.174 20 10 FICDRO Cc1ccc2[nH+]ccc(NCc3ccc(N4CCC(CO)CC4)cc3)c2c1 ZINC000302159520 1107322180 /nfs/dbraw/zinc/32/21/80/1107322180.db2.gz OMJCLDOGCLPDMS-UHFFFAOYSA-N 1 0 361.489 4.364 20 10 FICDRO COc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)cc(OC)c2O)cc1F ZINC000529649805 1110299894 /nfs/dbraw/zinc/29/98/94/1110299894.db2.gz AWGLJMGSOCIUKY-UHFFFAOYSA-N 1 0 353.821 4.227 20 10 FICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1c(C)c3ccccc3n1C)CCCO2 ZINC000479436136 1112022191 /nfs/dbraw/zinc/02/21/91/1112022191.db2.gz ISQUHMSIROMAOY-IBGZPJMESA-N 1 0 350.462 4.499 20 10 FICDRO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000155314958 1113556236 /nfs/dbraw/zinc/55/62/36/1113556236.db2.gz VZQMAENKDGYEIC-QZTJIDSGSA-N 1 0 354.494 4.334 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc2c(c1)CCO2 ZINC000163605023 1113991975 /nfs/dbraw/zinc/99/19/75/1113991975.db2.gz CCKQXFMJSBFBDH-OAQYLSRUSA-N 1 0 368.546 4.416 20 10 FICDRO C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000151329776 1114344124 /nfs/dbraw/zinc/34/41/24/1114344124.db2.gz HAZFXGNNMCHFOX-KKSFZXQISA-N 1 0 354.469 4.391 20 10 FICDRO CCNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)cc1 ZINC000156555550 1114460042 /nfs/dbraw/zinc/46/00/42/1114460042.db2.gz XXIQOEVEHSEXFT-SFHVURJKSA-N 1 0 365.521 4.277 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c(C)n1-c1ccc(Cl)cc1 ZINC000760763965 1114902648 /nfs/dbraw/zinc/90/26/48/1114902648.db2.gz QTFYZGROBGLHME-SFHVURJKSA-N 1 0 373.928 4.304 20 10 FICDRO COc1ccc([C@H](C)[C@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000157417063 1115103264 /nfs/dbraw/zinc/10/32/64/1115103264.db2.gz DMQXTXSXELFHOU-MSOLQXFVSA-N 1 0 368.521 4.454 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)[C@@]12CCCO2 ZINC000760882475 1115121935 /nfs/dbraw/zinc/12/19/35/1115121935.db2.gz XENWNYNZAYHCHM-IITNATTFSA-N 1 0 372.553 4.444 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000157662480 1115231122 /nfs/dbraw/zinc/23/11/22/1115231122.db2.gz HPQNWAWZIKWMIX-HTAPYJJXSA-N 1 0 354.494 4.334 20 10 FICDRO Clc1oc2ccccc2c1C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000761295601 1115769125 /nfs/dbraw/zinc/76/91/25/1115769125.db2.gz YXRKRPVFVRPZSK-UHFFFAOYSA-N 1 0 356.853 4.213 20 10 FICDRO Cc1nc(C)c(C[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 ZINC000174622502 1116231423 /nfs/dbraw/zinc/23/14/23/1116231423.db2.gz PADOHMYOJWLZRK-CQSZACIVSA-N 1 0 367.465 4.120 20 10 FICDRO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151558428 1118360222 /nfs/dbraw/zinc/36/02/22/1118360222.db2.gz NXXDMIFKBRVRMW-LJQANCHMSA-N 1 0 352.522 4.363 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000151560156 1118500256 /nfs/dbraw/zinc/50/02/56/1118500256.db2.gz ODYKISZGKKEGNH-DEOSSOPVSA-N 1 0 364.533 4.006 20 10 FICDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1 ZINC000151561927 1118527859 /nfs/dbraw/zinc/52/78/59/1118527859.db2.gz QSJRNJZVPLFUTK-GOSISDBHSA-N 1 0 352.522 4.309 20 10 FICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151575862 1118829777 /nfs/dbraw/zinc/82/97/77/1118829777.db2.gz UBLZUHDPSKZJJV-GOSISDBHSA-N 1 0 368.521 4.145 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cccc(Cl)c1 ZINC000151578528 1118863820 /nfs/dbraw/zinc/86/38/20/1118863820.db2.gz CPPWPIAZNMVJJJ-MRXNPFEDSA-N 1 0 358.913 4.400 20 10 FICDRO COc1ccccc1-c1ncc(C[NH2+]Cc2c(C)c3ccccc3n2C)cn1 ZINC000491363767 1118941013 /nfs/dbraw/zinc/94/10/13/1118941013.db2.gz XRHLAWLBPUTEDH-UHFFFAOYSA-N 1 0 372.472 4.242 20 10 FICDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)s1 ZINC000151592891 1118942355 /nfs/dbraw/zinc/94/23/55/1118942355.db2.gz QLUQMSMTRMWENV-INIZCTEOSA-N 1 0 358.551 4.370 20 10 FICDRO C[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000152811304 1119511011 /nfs/dbraw/zinc/51/10/11/1119511011.db2.gz HBSKFEUQJOTRPJ-GOSISDBHSA-N 1 0 352.526 4.103 20 10 FICDRO CC(C)(C)c1cc(C[NH2+]C2(CCO)CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000761994286 1120638840 /nfs/dbraw/zinc/63/88/40/1120638840.db2.gz OZYVOWLQEGTNNW-UHFFFAOYSA-N 1 0 363.542 4.008 20 10 FICDRO CCN(CC)c1ccc(CN(C)C(=O)Nc2cccc(C[NH+](C)C)c2)cc1 ZINC000915345436 1120926229 /nfs/dbraw/zinc/92/62/29/1120926229.db2.gz GAJAWGWMVBDZSW-UHFFFAOYSA-N 1 0 368.525 4.258 20 10 FICDRO CCc1nnc([C@@H](C)NCc2ccc(N(CC)Cc3ccccc3)cc2)[nH]1 ZINC000762626747 1120940942 /nfs/dbraw/zinc/94/09/42/1120940942.db2.gz HXINRAYQEFTBOJ-QGZVFWFLSA-N 1 0 363.509 4.244 20 10 FICDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc(N2CCOCC2)cc1Cl ZINC000765756552 1121058731 /nfs/dbraw/zinc/05/87/31/1121058731.db2.gz XNASRJPOSOQWMN-NVXWUHKLSA-N 1 0 356.897 4.167 20 10 FICDRO CC[C@@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000763388814 1121569044 /nfs/dbraw/zinc/56/90/44/1121569044.db2.gz AEKKZRAQTVIUQA-FQEVSTJZSA-N 1 0 368.521 4.415 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2CCN(Cc3ccc(F)cc3)CC2)cc1 ZINC000916836606 1121876749 /nfs/dbraw/zinc/87/67/49/1121876749.db2.gz MBBXACMOSXBLEK-UHFFFAOYSA-N 1 0 369.528 4.426 20 10 FICDRO C[NH+](C)Cc1cccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 ZINC000916842602 1121884310 /nfs/dbraw/zinc/88/43/10/1121884310.db2.gz NSBCZLOFPJDYFZ-UHFFFAOYSA-N 1 0 368.481 4.259 20 10 FICDRO Oc1c(CNc2cc[nH+]cc2C(F)(F)F)cc(Cl)c2cccnc12 ZINC001168522585 1122061975 /nfs/dbraw/zinc/06/19/75/1122061975.db2.gz FZRRAYYVLHWWFY-UHFFFAOYSA-N 1 0 353.731 4.042 20 10 FICDRO CC(C)[N@H+](CC(=O)N1CCC[C@H]2CCCC[C@@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074943 1122068410 /nfs/dbraw/zinc/06/84/10/1122068410.db2.gz MHGKLPCEHOLNBB-IRLDBZIGSA-N 1 0 371.569 4.144 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(CCOCc3ccccc3)CC2)c1 ZINC000186374806 1122071115 /nfs/dbraw/zinc/07/11/15/1122071115.db2.gz ULENZWFNIOYCKH-QGZVFWFLSA-N 1 0 355.478 4.439 20 10 FICDRO FC(F)(F)c1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000785446473 1122202745 /nfs/dbraw/zinc/20/27/45/1122202745.db2.gz AFAGOPLSUHBFPZ-UHFFFAOYSA-N 1 0 373.378 4.320 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](C)CC2)c(C)n1-c1cccc(C(C)C)c1 ZINC000917392536 1122285723 /nfs/dbraw/zinc/28/57/23/1122285723.db2.gz HCCASKLZUPFBSI-UHFFFAOYSA-N 1 0 353.510 4.042 20 10 FICDRO Clc1cccc([C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)N2CCCC2)c1 ZINC000917394637 1122286642 /nfs/dbraw/zinc/28/66/42/1122286642.db2.gz KZIJSNOEPIOOFW-HXUWFJFHSA-N 1 0 356.897 4.202 20 10 FICDRO Oc1cc2c(cc1C[NH+]1CCC(Oc3ccc(F)cc3F)CC1)CCC2 ZINC000917467881 1122328534 /nfs/dbraw/zinc/32/85/34/1122328534.db2.gz PDZOSYDHWCIGKG-UHFFFAOYSA-N 1 0 359.416 4.203 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601897 1122723360 /nfs/dbraw/zinc/72/33/60/1122723360.db2.gz LLDUUOVYSBMEMI-IEBWSBKVSA-N 1 0 371.912 4.104 20 10 FICDRO C[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@H]1CCCCO1 ZINC000918735304 1122765935 /nfs/dbraw/zinc/76/59/35/1122765935.db2.gz JFASWXLCCGYLCU-OAHLLOKOSA-N 1 0 364.283 4.309 20 10 FICDRO c1ccc(-c2ccccc2C[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000920181137 1123398441 /nfs/dbraw/zinc/39/84/41/1123398441.db2.gz ZZJVTPKJLFDKAO-UHFFFAOYSA-N 1 0 358.485 4.480 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]CCCn2c(C)nc3ccccc32)cc1 ZINC000920956649 1123542228 /nfs/dbraw/zinc/54/22/28/1123542228.db2.gz IXLYAYPHMIMMMQ-UHFFFAOYSA-N 1 0 350.510 4.371 20 10 FICDRO COc1ccc(O)c(C[NH+]2CCC(c3nc4ccccc4s3)CC2)c1 ZINC000179583150 1124009088 /nfs/dbraw/zinc/00/90/88/1124009088.db2.gz VNIRYWXBUVCMBD-UHFFFAOYSA-N 1 0 354.475 4.390 20 10 FICDRO Cc1cc(O)c(C[NH2+]C2(c3ccc4c(c3)OCCO4)CCCC2)cc1C ZINC000237824215 1124118830 /nfs/dbraw/zinc/11/88/30/1124118830.db2.gz PARQDVFWPBMJAZ-UHFFFAOYSA-N 1 0 353.462 4.339 20 10 FICDRO C[C@H]([NH2+]CCCc1cccc(F)c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000765899627 1124342935 /nfs/dbraw/zinc/34/29/35/1124342935.db2.gz XOWVOMXYDMUBOU-INIZCTEOSA-N 1 0 360.448 4.085 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1C ZINC000181467193 1124959434 /nfs/dbraw/zinc/95/94/34/1124959434.db2.gz SBXHGZHQNYRRRQ-HNNXBMFYSA-N 1 0 353.388 4.061 20 10 FICDRO COc1ccc(N2CC[NH+](Cc3cccc(C(C)(C)C)c3O)CC2)cc1 ZINC001143104210 1125265474 /nfs/dbraw/zinc/26/54/74/1125265474.db2.gz QPVQBQGHHRPWTO-UHFFFAOYSA-N 1 0 354.494 4.021 20 10 FICDRO CCOc1ccccc1C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000132202956 1125401316 /nfs/dbraw/zinc/40/13/16/1125401316.db2.gz DNUZPKLDMONHRZ-MRXNPFEDSA-N 1 0 374.912 4.426 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(Br)c1 ZINC001237064745 1125414085 /nfs/dbraw/zinc/41/40/85/1125414085.db2.gz ICXAWHHGQOHSKJ-UHFFFAOYSA-N 1 0 364.230 4.031 20 10 FICDRO COC[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccco1 ZINC000183159132 1125763191 /nfs/dbraw/zinc/76/31/91/1125763191.db2.gz XMHLDMCGSBMVBL-IBGZPJMESA-N 1 0 353.418 4.042 20 10 FICDRO COc1ccc(N2CCC[N@H+](C[C@H]3CC[C@@H](c4ccccc4)O3)CC2)cc1 ZINC001167107680 1080552653 /nfs/dbraw/zinc/55/26/53/1080552653.db2.gz GIJKPJSBNSJBSQ-PKTZIBPZSA-N 1 0 366.505 4.128 20 10 FICDRO CCCOc1ccc(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)cn1 ZINC001648824399 1081252313 /nfs/dbraw/zinc/25/23/13/1081252313.db2.gz COROGIZNRFLFTM-UHFFFAOYSA-N 1 0 358.482 4.172 20 10 FICDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H]1C ZINC001648826652 1081262380 /nfs/dbraw/zinc/26/23/80/1081262380.db2.gz NEWDHQYABXXZFU-VYDXJSESSA-N 1 0 370.459 4.456 20 10 FICDRO Cc1ccc(C)c(C[NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 ZINC001648835318 1081276794 /nfs/dbraw/zinc/27/67/94/1081276794.db2.gz IRIQWXGAACPFOA-ROUUACIJSA-N 1 0 356.485 4.346 20 10 FICDRO C[C@@H]1CN(c2ccc(C[NH2+]Cc3cc(F)cc(F)c3)cc2F)C[C@H](C)O1 ZINC001648835419 1081276805 /nfs/dbraw/zinc/27/68/05/1081276805.db2.gz NSHVTPYPXASZSM-OKILXGFUSA-N 1 0 364.411 4.007 20 10 FICDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CCOCC1 ZINC000588382676 1082023550 /nfs/dbraw/zinc/02/35/50/1082023550.db2.gz YKTVDQUEZOEHND-MRXNPFEDSA-N 1 0 366.465 4.445 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3cncc(Oc4ccccc4)c3)cc2)CC1 ZINC001167437106 1082198647 /nfs/dbraw/zinc/19/86/47/1082198647.db2.gz KXBYFSOZTOJDLT-UHFFFAOYSA-N 1 0 374.488 4.238 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(N(C)C)cc3)CC2)cc1 ZINC000157377029 1082756528 /nfs/dbraw/zinc/75/65/28/1082756528.db2.gz MJZLEZBDNAMVFE-QGZVFWFLSA-N 1 0 353.510 4.081 20 10 FICDRO CC(C)COC[C@@H]([NH2+]Cc1cccc(Br)c1[O-])c1ccco1 ZINC000101596931 1083017890 /nfs/dbraw/zinc/01/78/90/1083017890.db2.gz OGSQGHXHAZVYIE-OAHLLOKOSA-N 1 0 368.271 4.251 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)c2ccccc2)n1 ZINC000277004751 1083707380 /nfs/dbraw/zinc/70/73/80/1083707380.db2.gz BARNQKUENKEZER-FOIQADDNSA-N 1 0 350.466 4.079 20 10 FICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000176210964 1083744014 /nfs/dbraw/zinc/74/40/14/1083744014.db2.gz PKUNHPZOLXJUGN-IBGZPJMESA-N 1 0 355.478 4.096 20 10 FICDRO COc1cccc([C@@H]([NH2+]Cc2ccccc2O)c2cc(F)ccc2OC)c1 ZINC000177562677 1084081716 /nfs/dbraw/zinc/08/17/16/1084081716.db2.gz OCMDJAJWOLEUCA-JOCHJYFZSA-N 1 0 367.420 4.428 20 10 FICDRO COc1ccc([C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C(C)C)cc1 ZINC000066236464 1084204737 /nfs/dbraw/zinc/20/47/37/1084204737.db2.gz JAUZJSQHYMTVTL-JOCHJYFZSA-N 1 0 354.494 4.019 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)C(=O)NCc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000161178424 1084753703 /nfs/dbraw/zinc/75/37/03/1084753703.db2.gz JENSFZKKVDLPQR-MOPGFXCFSA-N 1 0 365.521 4.032 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000159057113 1085087574 /nfs/dbraw/zinc/08/75/74/1085087574.db2.gz XQCKTOPRJWLSIM-HZPDHXFCSA-N 1 0 366.509 4.448 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)CC12CCC2 ZINC000313234567 1085290418 /nfs/dbraw/zinc/29/04/18/1085290418.db2.gz TWPXTSYJNSPWJK-SJORKVTESA-N 1 0 372.509 4.291 20 10 FICDRO COc1cccc(F)c1CNc1ccc2c(c1)ncn2[C@H]1CCC[NH2+]CC1 ZINC001167606973 1085539194 /nfs/dbraw/zinc/53/91/94/1085539194.db2.gz LTYJBFYMACLTFA-INIZCTEOSA-N 1 0 368.456 4.111 20 10 FICDRO COc1ccccc1[C@@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178444225 1085780984 /nfs/dbraw/zinc/78/09/84/1085780984.db2.gz IEYIVQBPCKCQHH-IERDGZPVSA-N 1 0 372.484 4.209 20 10 FICDRO [O-]c1c(Br)cc(Cl)cc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001141373101 1086452126 /nfs/dbraw/zinc/45/21/26/1086452126.db2.gz NFOAGJQQEATBLB-GFCCVEGCSA-N 1 0 352.606 4.039 20 10 FICDRO COc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cc1OC ZINC000161612399 1086476868 /nfs/dbraw/zinc/47/68/68/1086476868.db2.gz VKTWAFNJUDIYDP-UHFFFAOYSA-N 1 0 353.418 4.205 20 10 FICDRO CC1(C)C[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c2ccccc21 ZINC000178538363 1086783496 /nfs/dbraw/zinc/78/34/96/1086783496.db2.gz NYRZIIDERMLBSF-QHCPKHFHSA-N 1 0 364.533 4.408 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000728594311 1087531597 /nfs/dbraw/zinc/53/15/97/1087531597.db2.gz PJRBRDCKVWAROI-HSZRJFAPSA-N 1 0 365.565 4.187 20 10 FICDRO CCCOCc1ccccc1C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000163658043 1088167923 /nfs/dbraw/zinc/16/79/23/1088167923.db2.gz TVXDXWOHWOLUQU-UHFFFAOYSA-N 1 0 368.521 4.380 20 10 FICDRO CC(C)[C@H](C)NC(=O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000255953982 1088243502 /nfs/dbraw/zinc/24/35/02/1088243502.db2.gz ZTUOPFWBSHUNAD-ZWKOTPCHSA-N 1 0 354.494 4.116 20 10 FICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc(Br)cc2c1OCC2 ZINC000122365382 1089334712 /nfs/dbraw/zinc/33/47/12/1089334712.db2.gz KKFQXKXPEQEPGH-UHFFFAOYSA-N 1 0 368.658 4.033 20 10 FICDRO CC(C)(C)OC(=O)N1CCC(C)(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000312038668 1090131859 /nfs/dbraw/zinc/13/18/59/1090131859.db2.gz QBCOFUTYDYEQEC-MRXNPFEDSA-N 1 0 360.498 4.006 20 10 FICDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1 ZINC000180937864 1090244921 /nfs/dbraw/zinc/24/49/21/1090244921.db2.gz JARGEPDPPCEHKM-OQRGYWNNSA-N 1 0 366.461 4.124 20 10 FICDRO CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000185046752 1090499491 /nfs/dbraw/zinc/49/94/91/1090499491.db2.gz PTKHWLPNEYGGNQ-INIZCTEOSA-N 1 0 360.473 4.103 20 10 FICDRO C[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1cc(Br)ccc1O ZINC000756552513 1091014172 /nfs/dbraw/zinc/01/41/72/1091014172.db2.gz MIEYWSRFNVEWHZ-CHWSQXEVSA-N 1 0 362.267 4.372 20 10 FICDRO CC[C@@H](Cc1ccccc1Br)[NH2+]Cc1cccc(OC)c1O ZINC000759834947 1091279912 /nfs/dbraw/zinc/27/99/12/1091279912.db2.gz NOJYFVZBFWPYLJ-HNNXBMFYSA-N 1 0 364.283 4.274 20 10 FICDRO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 ZINC000709435146 1091357122 /nfs/dbraw/zinc/35/71/22/1091357122.db2.gz CAPUSLUFPXEQNI-YTXYEVPYSA-N 1 0 373.541 4.191 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]CCc2nc(-c3ccccn3)cs2)cc1 ZINC000236960661 1093142099 /nfs/dbraw/zinc/14/20/99/1093142099.db2.gz KBUULOKHJRRZJI-UHFFFAOYSA-N 1 0 366.534 4.384 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3ccc(OC(F)F)cc3)CC2)cc1 ZINC000237261629 1093453294 /nfs/dbraw/zinc/45/32/94/1093453294.db2.gz AGKBQUSVGOAKTI-UHFFFAOYSA-N 1 0 362.420 4.055 20 10 FICDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001648951615 1094096494 /nfs/dbraw/zinc/09/64/94/1094096494.db2.gz ZNGUIBVFQIBFFZ-QGOAFFKASA-N 1 0 350.506 4.409 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)cc1O ZINC000280221081 1094310599 /nfs/dbraw/zinc/31/05/99/1094310599.db2.gz UTJDXWKWXUZPPH-FQEVSTJZSA-N 1 0 372.484 4.042 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H](CN2CCCC2=O)c2ccccc2)c(O)c1C ZINC000273362678 1096255249 /nfs/dbraw/zinc/25/52/49/1096255249.db2.gz DHNFEVFNYKDARX-PXNSSMCTSA-N 1 0 352.478 4.023 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273517911 1096269816 /nfs/dbraw/zinc/26/98/16/1096269816.db2.gz SXBIEZUKXYSVTC-MAUKXSAKSA-N 1 0 361.551 4.366 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1nnc2n1CCCCC2 ZINC000273613416 1096278909 /nfs/dbraw/zinc/27/89/09/1096278909.db2.gz WTMHLEGGZIEHMA-KXBFYZLASA-N 1 0 368.525 4.391 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCCNC3=O)cc2)c(O)c1C ZINC000291139392 1100242105 /nfs/dbraw/zinc/24/21/05/1100242105.db2.gz FUOANPVVDYJLKA-DLBZAZTESA-N 1 0 367.493 4.341 20 10 FICDRO CC(C)(C)c1cc(C[NH2+]CCSCCCO)c(O)c(C(C)(C)C)c1 ZINC000729854925 1102939713 /nfs/dbraw/zinc/93/97/13/1102939713.db2.gz IPQHXXNWVQLDCB-UHFFFAOYSA-N 1 0 353.572 4.192 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(Br)cc2)c1 ZINC000314953016 1103071668 /nfs/dbraw/zinc/07/16/68/1103071668.db2.gz UKGMFANTNRIPGU-GFCCVEGCSA-N 1 0 350.256 4.057 20 10 FICDRO Oc1ccccc1C[N@@H+](C[C@H]1CC[C@@H](c2ccccc2)O1)C[C@@H]1CCCO1 ZINC001167984670 1103214444 /nfs/dbraw/zinc/21/44/44/1103214444.db2.gz VNSRXORLRPDMST-XJUOHMSHSA-N 1 0 367.489 4.294 20 10 FICDRO CN(C)c1ccc(C[NH2+]C2(c3ccc4c(c3)OCCO4)CCCC2)cc1 ZINC000237174082 1104833346 /nfs/dbraw/zinc/83/33/46/1104833346.db2.gz XMUYDFAXZFDRBE-UHFFFAOYSA-N 1 0 352.478 4.083 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1ccccc1O ZINC000760040628 1104996253 /nfs/dbraw/zinc/99/62/53/1104996253.db2.gz UESBLLQDOHKSHB-ILWGZMRPSA-N 1 0 357.469 4.346 20 10 FICDRO CCN(CC)c1ccc(CN(C)C(=O)[C@H](c2ccccc2)[N@H+](C)CC)cc1 ZINC000729512911 1105025025 /nfs/dbraw/zinc/02/50/25/1105025025.db2.gz WMWOOXLGGTVCJQ-QFIPXVFZSA-N 1 0 367.537 4.184 20 10 FICDRO Cc1cc(NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2[nH+]1 ZINC000301088061 1106929444 /nfs/dbraw/zinc/92/94/44/1106929444.db2.gz MFAWJEUZKSENHC-UHFFFAOYSA-N 1 0 351.425 4.131 20 10 FICDRO C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000840962430 1108043429 /nfs/dbraw/zinc/04/34/29/1108043429.db2.gz BRHWFULIPVURSO-ZDUSSCGKSA-N 1 0 359.392 4.263 20 10 FICDRO CC(C)[N@H+](C)CC(=O)Nc1ccc(/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001142588158 1112389660 /nfs/dbraw/zinc/38/96/60/1112389660.db2.gz NFBWWTWILBPJIW-VOTSOKGWSA-N 1 0 351.494 4.202 20 10 FICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)N2CCc3ccccc3C2)cc1C ZINC001649004099 1112657415 /nfs/dbraw/zinc/65/74/15/1112657415.db2.gz ATKCCLVTLYYLCS-LJQANCHMSA-N 1 0 352.522 4.320 20 10 FICDRO CC[C@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1O ZINC000155876206 1113927905 /nfs/dbraw/zinc/92/79/05/1113927905.db2.gz GCWSFTPOLLYZGP-HOCLYGCPSA-N 1 0 362.420 4.313 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000151076960 1114289862 /nfs/dbraw/zinc/28/98/62/1114289862.db2.gz UUCVYARCRNPOPQ-IBGZPJMESA-N 1 0 373.500 4.436 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccnc2OCC(F)(F)F)cc1 ZINC000151109136 1114297440 /nfs/dbraw/zinc/29/74/40/1114297440.db2.gz DYYAPBHCIDDQLE-AWEZNQCLSA-N 1 0 367.415 4.330 20 10 FICDRO COc1cc(C)cc(C[N@@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)c1O ZINC000164344156 1114474722 /nfs/dbraw/zinc/47/47/22/1114474722.db2.gz SZSNCUWJGXIJGV-UHFFFAOYSA-N 1 0 357.294 4.026 20 10 FICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)nc(-c2ccc(Cl)cc2)n1 ZINC000157252469 1115046510 /nfs/dbraw/zinc/04/65/10/1115046510.db2.gz AOPRTOTUNRIVEE-UHFFFAOYSA-N 1 0 353.853 4.443 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cn(C(C)(C)C)nc3C)CC2)cc1 ZINC000157414392 1115102888 /nfs/dbraw/zinc/10/28/88/1115102888.db2.gz PBKMYVQZVXFGQC-MRXNPFEDSA-N 1 0 370.541 4.275 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)[C@@]12CCCO2 ZINC000760882477 1115121563 /nfs/dbraw/zinc/12/15/63/1115121563.db2.gz XENWNYNZAYHCHM-MSYGRNIXSA-N 1 0 372.553 4.444 20 10 FICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)cc1 ZINC000157677831 1115229027 /nfs/dbraw/zinc/22/90/27/1115229027.db2.gz XMWZILYVBNMIGO-IERDGZPVSA-N 1 0 372.484 4.473 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1O ZINC000761191840 1115613922 /nfs/dbraw/zinc/61/39/22/1115613922.db2.gz XQQVLUUEDYGCNX-UHFFFAOYSA-N 1 0 362.813 4.127 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]CCCOc2cccc3cccnc32)c1O ZINC000761206663 1115622138 /nfs/dbraw/zinc/62/21/38/1115622138.db2.gz MRVBSBUGBLIBQO-UHFFFAOYSA-N 1 0 372.852 4.161 20 10 FICDRO CCC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000761203580 1115622958 /nfs/dbraw/zinc/62/29/58/1115622958.db2.gz WOAFCFAOGGGRSY-BMGDILEWSA-N 1 0 353.890 4.080 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc(Br)cc2F)c1O ZINC000761207626 1115626026 /nfs/dbraw/zinc/62/60/26/1115626026.db2.gz RDFKCDBWVVFVOY-UHFFFAOYSA-N 1 0 374.637 4.246 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(F)ccc1Br ZINC000761314752 1115778422 /nfs/dbraw/zinc/77/84/22/1115778422.db2.gz WFFRLSHULMYDMP-UHFFFAOYSA-N 1 0 351.263 4.252 20 10 FICDRO CC[C@@H]([NH2+]C[C@@H]1CSCCS1)c1cc(Br)ccc1O ZINC000229583398 1115857575 /nfs/dbraw/zinc/85/75/75/1115857575.db2.gz GITVQIIJEJGGFF-DGCLKSJQSA-N 1 0 362.358 4.044 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(N2CCCC2=O)cc1 ZINC000171380889 1115863320 /nfs/dbraw/zinc/86/33/20/1115863320.db2.gz OCJYINLWICYSSL-QGZVFWFLSA-N 1 0 363.505 4.047 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000174547240 1116141257 /nfs/dbraw/zinc/14/12/57/1116141257.db2.gz IHQSPBGQVXJNTR-GOSISDBHSA-N 1 0 371.550 4.104 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)c1ccccc1 ZINC000151513456 1116265067 /nfs/dbraw/zinc/26/50/67/1116265067.db2.gz VWIJOPDRZVSBTI-QGZVFWFLSA-N 1 0 370.512 4.243 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)cc1 ZINC000151517121 1116279115 /nfs/dbraw/zinc/27/91/15/1116279115.db2.gz IUGOGRLMRXOTSZ-NRFANRHFSA-N 1 0 356.485 4.336 20 10 FICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151533031 1116356560 /nfs/dbraw/zinc/35/65/60/1116356560.db2.gz VNQCPMUZXQWCAB-MRXNPFEDSA-N 1 0 372.484 4.036 20 10 FICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000151545493 1117945556 /nfs/dbraw/zinc/94/55/56/1117945556.db2.gz QCBOZSAOVUMLOQ-INIZCTEOSA-N 1 0 372.484 4.036 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c(C)c1 ZINC000151583651 1118939103 /nfs/dbraw/zinc/93/91/03/1118939103.db2.gz MXHUPPWNELTACD-LJQANCHMSA-N 1 0 352.522 4.363 20 10 FICDRO C[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000152743966 1119493449 /nfs/dbraw/zinc/49/34/49/1119493449.db2.gz PGAWVAILRXZVLD-KRWDZBQOSA-N 1 0 370.516 4.242 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](CC(C)C)CC2)c(C)n1-c1ccc(F)cc1 ZINC000914687351 1120465557 /nfs/dbraw/zinc/46/55/57/1120465557.db2.gz KZPXUENWRHJJNE-UHFFFAOYSA-N 1 0 371.500 4.083 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+]CCc2cn3ccccc3n2)cc1 ZINC000915227212 1120883011 /nfs/dbraw/zinc/88/30/11/1120883011.db2.gz YDECMKCZHXDDDX-UHFFFAOYSA-N 1 0 350.510 4.293 20 10 FICDRO C[C@@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cc(F)ccc1O ZINC000186289054 1122009378 /nfs/dbraw/zinc/00/93/78/1122009378.db2.gz UPUKLSIZXLRHEE-MRXNPFEDSA-N 1 0 369.484 4.236 20 10 FICDRO Cc1cccc(C)c1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917417991 1122294411 /nfs/dbraw/zinc/29/44/11/1122294411.db2.gz RISFZDKUFAUKOF-UHFFFAOYSA-N 1 0 353.510 4.219 20 10 FICDRO Cc1ccccc1OCC[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000917520900 1122336944 /nfs/dbraw/zinc/33/69/44/1122336944.db2.gz ZTNCSKQDLDLWOX-UHFFFAOYSA-N 1 0 369.465 4.062 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1C(C)C ZINC000918182622 1122583924 /nfs/dbraw/zinc/58/39/24/1122583924.db2.gz BSVIWPWCNPNWEF-QGZVFWFLSA-N 1 0 362.514 4.313 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)C2)c(C)n1-c1ccccc1C ZINC000918696471 1122749545 /nfs/dbraw/zinc/74/95/45/1122749545.db2.gz UZUOAVOAGMEBJF-HXUWFJFHSA-N 1 0 365.521 4.103 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1ccc(N(C)C)cc1 ZINC000154973889 1122992014 /nfs/dbraw/zinc/99/20/14/1122992014.db2.gz IAELRGXERDUGTP-QGZVFWFLSA-N 1 0 367.415 4.330 20 10 FICDRO CC[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@H]1CCCO1 ZINC000919946287 1123277263 /nfs/dbraw/zinc/27/72/63/1123277263.db2.gz ZPJZALRFSZZDSW-OAHLLOKOSA-N 1 0 364.283 4.309 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)c(C)n1-c1ccccc1C ZINC000921208177 1123584019 /nfs/dbraw/zinc/58/40/19/1123584019.db2.gz WRNFCABGWAFEAW-HXUWFJFHSA-N 1 0 365.521 4.103 20 10 FICDRO Cc1ccc(NC(=O)NC[C@@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179932580 1124144658 /nfs/dbraw/zinc/14/46/58/1124144658.db2.gz PBYMGHALTBIAAW-SFHVURJKSA-N 1 0 367.493 4.043 20 10 FICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000179993633 1124187400 /nfs/dbraw/zinc/18/74/00/1124187400.db2.gz ZDKWMQGOWSUXQI-QGZVFWFLSA-N 1 0 371.500 4.205 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1F ZINC000180215016 1124266182 /nfs/dbraw/zinc/26/61/82/1124266182.db2.gz AHMMZKACLDQYRJ-QFIPXVFZSA-N 1 0 356.485 4.275 20 10 FICDRO CC[C@@H]([NH2+]CC1(N2CCC(OC)CC2)CCCC1)c1ccc(N(C)C)cc1 ZINC000765859297 1124282444 /nfs/dbraw/zinc/28/24/44/1124282444.db2.gz JZGFUEJMJGTHMW-JOCHJYFZSA-N 1 0 373.585 4.217 20 10 FICDRO C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000180351777 1124298205 /nfs/dbraw/zinc/29/82/05/1124298205.db2.gz GONUSWWZPSAPGI-QGZVFWFLSA-N 1 0 354.469 4.392 20 10 FICDRO O=C(Nc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1)c1cccc(F)c1 ZINC000180493729 1124347459 /nfs/dbraw/zinc/34/74/59/1124347459.db2.gz WSSJFWBKRLNYQV-UHFFFAOYSA-N 1 0 368.383 4.213 20 10 FICDRO Cc1ccccc1[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)C(C)(C)C ZINC001168656456 1124528512 /nfs/dbraw/zinc/52/85/12/1124528512.db2.gz BZNHWBJUUVIQST-QFIPXVFZSA-N 1 0 367.537 4.054 20 10 FICDRO Cc1cccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1O ZINC000181200475 1124727960 /nfs/dbraw/zinc/72/79/60/1124727960.db2.gz BKKQNZGXSOSQBF-UHFFFAOYSA-N 1 0 361.367 4.195 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(-c3ccccc3OC)n2)c1 ZINC000182410548 1125473290 /nfs/dbraw/zinc/47/32/90/1125473290.db2.gz SXWGDCUDOBOJOH-ZDUSSCGKSA-N 1 0 370.474 4.384 20 10 FICDRO CC(C)(C)OC(=O)NC[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000382416785 1125574737 /nfs/dbraw/zinc/57/47/37/1125574737.db2.gz HTEXUXZQTOTMEM-MOPGFXCFSA-N 1 0 373.541 4.070 20 10 FICDRO CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000382416791 1125577267 /nfs/dbraw/zinc/57/72/67/1125577267.db2.gz HTEXUXZQTOTMEM-RTBURBONSA-N 1 0 373.541 4.070 20 10 FICDRO CCN(C)c1ccc([C@@H](C)Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000182637500 1125590799 /nfs/dbraw/zinc/59/07/99/1125590799.db2.gz VWUNXZGIAKVWRU-GOSISDBHSA-N 1 0 352.526 4.068 20 10 FICDRO C[C@](O)(C[NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccsc1 ZINC000183157834 1125762026 /nfs/dbraw/zinc/76/20/26/1125762026.db2.gz UUCIHPNNBNPXIK-NRFANRHFSA-N 1 0 369.486 4.030 20 10 FICDRO CC[C@@H]([NH2+]Cc1cn2ccsc2n1)c1cc(Br)ccc1O ZINC000274820918 1080194242 /nfs/dbraw/zinc/19/42/42/1080194242.db2.gz BQWPSBLONYMWCP-CYBMUJFWSA-N 1 0 366.284 4.105 20 10 FICDRO CC(C)[NH+]1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000255008646 1080272895 /nfs/dbraw/zinc/27/28/95/1080272895.db2.gz DYMIUORORVEFFG-UHFFFAOYSA-N 1 0 365.481 4.067 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160272829 1080700790 /nfs/dbraw/zinc/70/07/90/1080700790.db2.gz KVJWYAZLCOZTPI-VLIAUNLRSA-N 1 0 359.491 4.088 20 10 FICDRO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000155495823 1081398394 /nfs/dbraw/zinc/39/83/94/1081398394.db2.gz WATCDVZMBIBZOY-QGZVFWFLSA-N 1 0 351.494 4.486 20 10 FICDRO O=C1O[C@@H](C[N@@H+](Cc2ccccc2O)C2CCCC2)CN1C1CCCCC1 ZINC001167353868 1081595014 /nfs/dbraw/zinc/59/50/14/1081595014.db2.gz QQMDXIIGZCITGM-FQEVSTJZSA-N 1 0 372.509 4.290 20 10 FICDRO Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000177746855 1081892497 /nfs/dbraw/zinc/89/24/97/1081892497.db2.gz MGRCOAUKBPCDOI-KRWDZBQOSA-N 1 0 354.542 4.311 20 10 FICDRO CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000247258875 1081906047 /nfs/dbraw/zinc/90/60/47/1081906047.db2.gz ZBVHOWWZBARMEZ-VMMOAZFZSA-N 1 0 362.583 4.407 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)c1ccc(N(C)C)cc1 ZINC000160477554 1081906065 /nfs/dbraw/zinc/90/60/65/1081906065.db2.gz BLWMGQFQCUEQMB-SFHVURJKSA-N 1 0 352.526 4.235 20 10 FICDRO CCOc1ccc(C2=CC[N@H+](Cc3cc(OC)c(OC)cc3O)CC2)cc1 ZINC000160668221 1082195289 /nfs/dbraw/zinc/19/52/89/1082195289.db2.gz IFUPTGDYXDXTAL-UHFFFAOYSA-N 1 0 369.461 4.097 20 10 FICDRO CC(C)([NH2+]Cc1cccc(Br)c1[O-])c1ccc([N+](=O)[O-])cc1 ZINC000175985565 1082391665 /nfs/dbraw/zinc/39/16/65/1082391665.db2.gz VNOUPWCQWQKRED-UHFFFAOYSA-N 1 0 365.227 4.088 20 10 FICDRO COc1cc(Br)cc(C[N@H+](C)[C@@H](C)c2cccs2)c1O ZINC000157804513 1082407461 /nfs/dbraw/zinc/40/74/61/1082407461.db2.gz LFJWOCNTERNLAN-JTQLQIEISA-N 1 0 356.285 4.418 20 10 FICDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161068481 1083036672 /nfs/dbraw/zinc/03/66/72/1083036672.db2.gz QGBPHENRXYHINL-IAGOWNOFSA-N 1 0 353.510 4.132 20 10 FICDRO CC[C@@H]([NH2+][C@H](Cc1nc(C)no1)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000277028512 1083723241 /nfs/dbraw/zinc/72/32/41/1083723241.db2.gz FAUVPNDKWLTRBR-NHCUHLMSSA-N 1 0 364.493 4.469 20 10 FICDRO CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000177880238 1084409053 /nfs/dbraw/zinc/40/90/53/1084409053.db2.gz YEBMXDHAAIAJAY-SFHVURJKSA-N 1 0 365.521 4.277 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CC[C@H](C)CC2)C1 ZINC001125970105 1085146529 /nfs/dbraw/zinc/14/65/29/1085146529.db2.gz IQUADGYSVYJKKP-IYARVYRRSA-N 1 0 367.537 4.103 20 10 FICDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccc(C(=O)N(C)C)cc2)cc1 ZINC000093084103 1085289800 /nfs/dbraw/zinc/28/98/00/1085289800.db2.gz ZNKOILILIOJMBR-UHFFFAOYSA-N 1 0 367.537 4.257 20 10 FICDRO CC1(C)CC([NH3+])CC(C)(C)N1c1cc(F)c(OC(F)(F)F)c(F)c1 ZINC001167625618 1085802704 /nfs/dbraw/zinc/80/27/04/1085802704.db2.gz WQUCZLUPBVSFNT-UHFFFAOYSA-N 1 0 352.347 4.348 20 10 FICDRO CC[C@@H]([NH2+]CCC1SCCS1)c1cc(Br)ccc1O ZINC000693781003 1086542522 /nfs/dbraw/zinc/54/25/22/1086542522.db2.gz DLELEQLPPFEHNH-GFCCVEGCSA-N 1 0 362.358 4.392 20 10 FICDRO CC1(C)C[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc21 ZINC000178536257 1086722019 /nfs/dbraw/zinc/72/20/19/1086722019.db2.gz SCKARFNCGOWKQZ-NRFANRHFSA-N 1 0 368.496 4.299 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000728594312 1087531757 /nfs/dbraw/zinc/53/17/57/1087531757.db2.gz PJRBRDCKVWAROI-QHCPKHFHSA-N 1 0 365.565 4.187 20 10 FICDRO c1ccc(C[C@H]2CCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000236593824 1088405140 /nfs/dbraw/zinc/40/51/40/1088405140.db2.gz ISBPMTFEZFPVLF-FYYLOGMGSA-N 1 0 350.506 4.024 20 10 FICDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C(F)(F)F)c1 ZINC001143484794 1088958516 /nfs/dbraw/zinc/95/85/16/1088958516.db2.gz RLGJIJGGTVLLHF-UHFFFAOYSA-N 1 0 352.400 4.412 20 10 FICDRO CC(C)(C)OC(=O)N1CCC(C)(C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000312038667 1090122413 /nfs/dbraw/zinc/12/24/13/1090122413.db2.gz QBCOFUTYDYEQEC-INIZCTEOSA-N 1 0 360.498 4.006 20 10 FICDRO C[C@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc2ccccc2c1O ZINC000312218005 1090432966 /nfs/dbraw/zinc/43/29/66/1090432966.db2.gz UXYKVRAXIMWATK-LIRRHRJNSA-N 1 0 370.493 4.499 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(NC(=O)c3cccnc3)cc2)c1 ZINC000185253572 1090526782 /nfs/dbraw/zinc/52/67/82/1090526782.db2.gz SLEONKAPBBNXDY-MRXNPFEDSA-N 1 0 361.445 4.199 20 10 FICDRO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000756534535 1090960231 /nfs/dbraw/zinc/96/02/31/1090960231.db2.gz JHAAHPBVHIMUTA-LBPRGKRZSA-N 1 0 365.271 4.026 20 10 FICDRO CC[C@H](Cc1ccccc1Br)[NH2+]Cc1cccc(OC)c1O ZINC000759834950 1091280227 /nfs/dbraw/zinc/28/02/27/1091280227.db2.gz NOJYFVZBFWPYLJ-OAHLLOKOSA-N 1 0 364.283 4.274 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(CO)c(F)c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178561065 1091866538 /nfs/dbraw/zinc/86/65/38/1091866538.db2.gz USPAJJFSZSYGIT-HNNXBMFYSA-N 1 0 360.448 4.298 20 10 FICDRO CCOc1cc2c(cc1C[NH2+]Cc1ccc(N(C)C)cc1C)O[C@@H](C)C2 ZINC000236873623 1092107175 /nfs/dbraw/zinc/10/71/75/1092107175.db2.gz XTBFHFRWQWBHSN-INIZCTEOSA-N 1 0 354.494 4.073 20 10 FICDRO CC[C@@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)c1ccsc1 ZINC000840757436 1095911765 /nfs/dbraw/zinc/91/17/65/1095911765.db2.gz KGPGHMOLFXMMNG-QGZVFWFLSA-N 1 0 352.450 4.104 20 10 FICDRO Cc1cc(C(=O)N2CCC[N@@H+](C(C)C)CC2)c(C)n1-c1cccc(Cl)c1 ZINC001143557809 1096084014 /nfs/dbraw/zinc/08/40/14/1096084014.db2.gz GQTBODREWDPVLI-UHFFFAOYSA-N 1 0 373.928 4.304 20 10 FICDRO CC[C@@H]([NH2+]C[C@H]1CSCCN1Cc1ccccc1)c1ccccc1O ZINC000760017655 1096133924 /nfs/dbraw/zinc/13/39/24/1096133924.db2.gz NNKXZDHTSGUJBN-AZUAARDMSA-N 1 0 356.535 4.051 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOC3=O)cc2)c(O)c1C ZINC000273386019 1096257794 /nfs/dbraw/zinc/25/77/94/1096257794.db2.gz JMTFKLHCWNQNJB-CVEARBPZSA-N 1 0 354.450 4.377 20 10 FICDRO COc1ccc([C@H](NCc2c(C)c3ccccc3n2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000423086708 1096569955 /nfs/dbraw/zinc/56/99/55/1096569955.db2.gz NTAKSCUXANQFSK-REWPJTCUSA-N 1 0 363.505 4.078 20 10 FICDRO CCCCCNC(=O)C1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000054489966 1098846940 /nfs/dbraw/zinc/84/69/40/1098846940.db2.gz LGBMZCPFLIBGTQ-UHFFFAOYSA-N 1 0 354.494 4.064 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)NCC1CC[NH+](CC2CC2)CC1 ZINC001167964992 1101703374 /nfs/dbraw/zinc/70/33/74/1101703374.db2.gz RYJVCCWSXZPOBG-UHFFFAOYSA-N 1 0 371.550 4.007 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1CCC[C@@H](C(F)(F)F)O1 ZINC001167982230 1102786479 /nfs/dbraw/zinc/78/64/79/1102786479.db2.gz ALSSIUKBCVAUQW-AEFFLSMTSA-N 1 0 369.383 4.487 20 10 FICDRO Oc1ccccc1C[N@H+](C[C@@H]1CCCO1)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001167984665 1103204101 /nfs/dbraw/zinc/20/41/01/1103204101.db2.gz VNSRXORLRPDMST-FUDKSRODSA-N 1 0 367.489 4.294 20 10 FICDRO CC(=O)c1cc(Cl)cc(C[N@H+](CCO)[C@H]2CCCc3ccccc32)c1O ZINC001167990477 1104372048 /nfs/dbraw/zinc/37/20/48/1104372048.db2.gz UPUVXSJNCPOYID-FQEVSTJZSA-N 1 0 373.880 4.120 20 10 FICDRO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccc(OC)c(OC)c1O ZINC000895010123 1104466060 /nfs/dbraw/zinc/46/60/60/1104466060.db2.gz PMXCDQPLTJWFCR-UHFFFAOYSA-N 1 0 365.857 4.096 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1 ZINC000760040430 1105015753 /nfs/dbraw/zinc/01/57/53/1105015753.db2.gz KCOLBTDCYDEOMZ-KNXBSLHKSA-N 1 0 356.485 4.099 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c(O)c1 ZINC000760041107 1105036724 /nfs/dbraw/zinc/03/67/24/1105036724.db2.gz VUTMBKNEXVRWJM-KNXBSLHKSA-N 1 0 357.469 4.264 20 10 FICDRO Oc1cccc2c1[C@@H]([NH+]1CCC(Cc3nc(C4CCCC4)no3)CC1)CC2 ZINC000527939776 1109863675 /nfs/dbraw/zinc/86/36/75/1109863675.db2.gz SCHSUFRQNSWQIC-SFHVURJKSA-N 1 0 367.493 4.375 20 10 FICDRO CN(C)C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(Cl)c(Cl)c1 ZINC000529668278 1110302636 /nfs/dbraw/zinc/30/26/36/1110302636.db2.gz FYFVOLVPLFEMFD-MRXNPFEDSA-N 1 0 357.256 4.231 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 ZINC000529669028 1110302826 /nfs/dbraw/zinc/30/28/26/1110302826.db2.gz KSVKXBWIEZKGFL-QGZVFWFLSA-N 1 0 369.292 4.100 20 10 FICDRO C[C@@H](CNC(=O)OC(C)(C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000697901618 1112449511 /nfs/dbraw/zinc/44/95/11/1112449511.db2.gz UXNHJWLXZNCWOD-CABCVRRESA-N 1 0 358.482 4.357 20 10 FICDRO COC(=O)c1ccc(Cl)c(C[NH2+]Cc2c(C)c3ccccc3n2C)c1 ZINC000482441425 1113257299 /nfs/dbraw/zinc/25/72/99/1113257299.db2.gz UZPZLYWLQMIPBJ-UHFFFAOYSA-N 1 0 356.853 4.217 20 10 FICDRO CC[C@H]([NH2+]Cc1cc(OC)c(OC)c(OC)c1)c1ccc(N(C)C)cc1 ZINC000160652626 1113430331 /nfs/dbraw/zinc/43/03/31/1113430331.db2.gz XARQYGHPUPBXCC-SFHVURJKSA-N 1 0 358.482 4.019 20 10 FICDRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cccnc1 ZINC000164199782 1114444429 /nfs/dbraw/zinc/44/44/29/1114444429.db2.gz PVTWBLJNXZWRPQ-PXNSSMCTSA-N 1 0 371.500 4.148 20 10 FICDRO C[C@@H](CC[S@@](C)=O)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000760698598 1114599122 /nfs/dbraw/zinc/59/91/22/1114599122.db2.gz MLCXGBKWCOXTED-LFPIHBKWSA-N 1 0 353.572 4.234 20 10 FICDRO CCC(CC)C(=O)N1CCC([NH2+][C@@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000166065180 1114928556 /nfs/dbraw/zinc/92/85/56/1114928556.db2.gz YXTLBDQWBUVTEQ-NRFANRHFSA-N 1 0 359.558 4.221 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OCCOC)c1ccc(N(C)C)cc1 ZINC000167639648 1115309984 /nfs/dbraw/zinc/30/99/84/1115309984.db2.gz LZVDRVNYCVEPFT-NRFANRHFSA-N 1 0 356.510 4.327 20 10 FICDRO COc1cc(Cl)cc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)c1O ZINC000761184222 1115598484 /nfs/dbraw/zinc/59/84/84/1115598484.db2.gz UEWSSISIBIZVMQ-HNNXBMFYSA-N 1 0 367.898 4.297 20 10 FICDRO CC[C@H]([NH2+]CCc1csc(C)n1)c1cc(Br)ccc1O ZINC000229546962 1115851816 /nfs/dbraw/zinc/85/18/16/1115851816.db2.gz RKSUUVUCFOINKO-AWEZNQCLSA-N 1 0 355.301 4.203 20 10 FICDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 ZINC000761433244 1118059636 /nfs/dbraw/zinc/05/96/36/1118059636.db2.gz SXBCJJRSXKNFAF-IHRRRGAJSA-N 1 0 363.502 4.055 20 10 FICDRO CCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)s1 ZINC000151559795 1118499160 /nfs/dbraw/zinc/49/91/60/1118499160.db2.gz YXUJJOQCYAKECC-HNNXBMFYSA-N 1 0 373.566 4.073 20 10 FICDRO C[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000152811193 1119511024 /nfs/dbraw/zinc/51/10/24/1119511024.db2.gz HBSKFEUQJOTRPJ-SFHVURJKSA-N 1 0 352.526 4.103 20 10 FICDRO CCCC[N@H+](CC)Cc1cccc(CNC(=O)NCc2ccccc2O)c1 ZINC000761650862 1120001072 /nfs/dbraw/zinc/00/10/72/1120001072.db2.gz LYIWOCFSJUDGJY-UHFFFAOYSA-N 1 0 369.509 4.014 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N2CCOCC2)cc1Cl ZINC000130314448 1120306521 /nfs/dbraw/zinc/30/65/21/1120306521.db2.gz SGBGPQKWUQBNET-VLIAUNLRSA-N 1 0 372.896 4.220 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(OC)c2O)cc1Br ZINC000237235422 1120975006 /nfs/dbraw/zinc/97/50/06/1120975006.db2.gz CIQZMCZMHBOVBF-LLVKDONJSA-N 1 0 366.255 4.023 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 ZINC000915683505 1121019960 /nfs/dbraw/zinc/01/99/60/1121019960.db2.gz RYKGDOYYUASPMU-INIZCTEOSA-N 1 0 351.494 4.268 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000153701504 1121038793 /nfs/dbraw/zinc/03/87/93/1121038793.db2.gz DKNZNOPTSKOPGL-HNNXBMFYSA-N 1 0 352.457 4.237 20 10 FICDRO COc1cc(C[N@H+](C)Cc2ccc3c(c2)OCCO3)c(O)c(C(C)(C)C)c1 ZINC000915832332 1121121970 /nfs/dbraw/zinc/12/19/70/1121121970.db2.gz SWBAYGSVHCPLAX-UHFFFAOYSA-N 1 0 371.477 4.102 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3c(C)c4ccccc4n3C)CC2)cc1 ZINC001649029067 1121355546 /nfs/dbraw/zinc/35/55/46/1121355546.db2.gz NOJAAMSMKXCKFE-UHFFFAOYSA-N 1 0 363.505 4.254 20 10 FICDRO COc1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccc(N4CCCC4)cc3)CCO2)cc1 ZINC001168586299 1121535824 /nfs/dbraw/zinc/53/58/24/1121535824.db2.gz SNNLTBCVXRGMBQ-REWPJTCUSA-N 1 0 366.505 4.305 20 10 FICDRO CCOCc1cc(CNC[C@@H]2CCC[N@@H+]2CC2CCCCC2)ccc1OC ZINC001649095529 1121755651 /nfs/dbraw/zinc/75/56/51/1121755651.db2.gz DYYNKZYNKVIUTN-QFIPXVFZSA-N 1 0 374.569 4.366 20 10 FICDRO COc1ccc([C@@H]2C[C@@H]([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168610170 1121974539 /nfs/dbraw/zinc/97/45/39/1121974539.db2.gz RHVWMRJBOZDCER-BPXKWBHBSA-N 1 0 354.494 4.332 20 10 FICDRO COc1ccc(O)c([C@H](C)Nc2cccc(C[NH+]3CCSCC3)c2)c1 ZINC000186342969 1122039713 /nfs/dbraw/zinc/03/97/13/1122039713.db2.gz FNRYTYKEUYZJKU-HNNXBMFYSA-N 1 0 358.507 4.123 20 10 FICDRO CSc1cccc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917073809 1122066203 /nfs/dbraw/zinc/06/62/03/1122066203.db2.gz BJUAKLMUEZMRKH-UHFFFAOYSA-N 1 0 369.534 4.078 20 10 FICDRO CC(C)[N@H+](CC(=O)N(C)[C@H](C)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000917075101 1122070558 /nfs/dbraw/zinc/07/05/58/1122070558.db2.gz PYYLTNUYELCJLE-LJQANCHMSA-N 1 0 367.537 4.183 20 10 FICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000917485903 1122326642 /nfs/dbraw/zinc/32/66/42/1122326642.db2.gz VBCRQNHAQSZDCJ-UHFFFAOYSA-N 1 0 354.494 4.108 20 10 FICDRO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc2c(cc1O)OCO2 ZINC000917488815 1122333720 /nfs/dbraw/zinc/33/37/20/1122333720.db2.gz WVVDDLMMVZVPFS-UHFFFAOYSA-N 1 0 354.233 4.450 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH+]3CCCC3)C2)c(C)n1-c1ccccc1C ZINC000918696470 1122749691 /nfs/dbraw/zinc/74/96/91/1122749691.db2.gz UZUOAVOAGMEBJF-FQEVSTJZSA-N 1 0 365.521 4.103 20 10 FICDRO CCCC(=O)NC1CC[NH+](Cc2cc(CC)cc(C(C)(C)C)c2O)CC1 ZINC000919940892 1123274666 /nfs/dbraw/zinc/27/46/66/1123274666.db2.gz NYQNLMLVLRUVOP-UHFFFAOYSA-N 1 0 360.542 4.133 20 10 FICDRO COc1cc2c(cc1OC)CC[NH+](Cc1cc(C(C)C)c(C)cc1O)CC2 ZINC000919952482 1123280128 /nfs/dbraw/zinc/28/01/28/1123280128.db2.gz CERXKZAQFHEGQF-UHFFFAOYSA-N 1 0 369.505 4.442 20 10 FICDRO C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H](c2ccccc2)O1 ZINC000920306513 1123437454 /nfs/dbraw/zinc/43/74/54/1123437454.db2.gz VZGOLZIMOSFEQG-MGPUTAFESA-N 1 0 355.478 4.357 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](O)c2ccccc2C(F)(F)F)cc1 ZINC000921067192 1123555061 /nfs/dbraw/zinc/55/50/61/1123555061.db2.gz NQSZAWFTNJMDSB-IBGZPJMESA-N 1 0 366.427 4.375 20 10 FICDRO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057225 1123558483 /nfs/dbraw/zinc/55/84/83/1123558483.db2.gz VDSYYXQKPMXYAJ-FUHWJXTLSA-N 1 0 354.494 4.062 20 10 FICDRO C[C@H]([NH2+]CCCN1CCCCC1=O)c1ccc(N2CCCCCC2)cc1 ZINC000765846808 1124147264 /nfs/dbraw/zinc/14/72/64/1124147264.db2.gz YPNJVEMLHYEFDP-IBGZPJMESA-N 1 0 357.542 4.120 20 10 FICDRO COC1CCN(C(C)(C)C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765859866 1124292070 /nfs/dbraw/zinc/29/20/70/1124292070.db2.gz LYYJSGQXZPPYPB-IBGZPJMESA-N 1 0 373.585 4.217 20 10 FICDRO C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000180351759 1124297902 /nfs/dbraw/zinc/29/79/02/1124297902.db2.gz GONUSWWZPSAPGI-KRWDZBQOSA-N 1 0 354.469 4.392 20 10 FICDRO CCC[N@H+](Cc1cccc(C(=O)N2CCCCC2)c1)Cc1ccccc1O ZINC000068973528 1124433756 /nfs/dbraw/zinc/43/37/56/1124433756.db2.gz GAJIIEWVOZTMRL-UHFFFAOYSA-N 1 0 366.505 4.431 20 10 FICDRO C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cc(Br)cc(F)c1[O-] ZINC000756363513 1124842428 /nfs/dbraw/zinc/84/24/28/1124842428.db2.gz OZYDFKLDXQDKGZ-OLZOCXBDSA-N 1 0 373.310 4.209 20 10 FICDRO CCOc1ccc(-c2nc(C[NH2+][C@@H](C)c3cc(OC)ccc3O)co2)cc1 ZINC000182471855 1125518292 /nfs/dbraw/zinc/51/82/92/1125518292.db2.gz JBGIJNBHAILCCO-AWEZNQCLSA-N 1 0 368.433 4.305 20 10 FICDRO CC(C)(C)c1ncc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000160195245 1079587683 /nfs/dbraw/zinc/58/76/83/1079587683.db2.gz QMMKNXKEDRVQHV-INIZCTEOSA-N 1 0 360.523 4.327 20 10 FICDRO COC[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccco1 ZINC000183159155 1125763079 /nfs/dbraw/zinc/76/30/79/1125763079.db2.gz XMHLDMCGSBMVBL-LJQANCHMSA-N 1 0 353.418 4.042 20 10 FICDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(N2CCOCC2)cc1Cl ZINC000120414060 1080040842 /nfs/dbraw/zinc/04/08/42/1080040842.db2.gz IFWYXFFXTHANJP-KSSFIOAISA-N 1 0 354.947 4.113 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)c(O)c1C ZINC000274798518 1080080951 /nfs/dbraw/zinc/08/09/51/1080080951.db2.gz UHLMDGSXXKVDPW-MGPUTAFESA-N 1 0 353.441 4.322 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160272972 1080703907 /nfs/dbraw/zinc/70/39/07/1080703907.db2.gz KVJWYAZLCOZTPI-XOBRGWDASA-N 1 0 359.491 4.088 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001167281471 1080968095 /nfs/dbraw/zinc/96/80/95/1080968095.db2.gz BGSNDPFXSJSNAJ-QGZVFWFLSA-N 1 0 371.550 4.292 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cncc(Br)c1 ZINC000580451353 1081951255 /nfs/dbraw/zinc/95/12/55/1081951255.db2.gz DNGFXEMPIARHJO-ZDUSSCGKSA-N 1 0 358.283 4.495 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1ccc(N(C)C)cc1 ZINC000177837338 1082195851 /nfs/dbraw/zinc/19/58/51/1082195851.db2.gz LYVIYOIEFMGKMT-MRXNPFEDSA-N 1 0 363.461 4.449 20 10 FICDRO C[C@H](CCOCc1ccccc1)[NH2+]Cc1c(O)cccc1Br ZINC000706835353 1082385240 /nfs/dbraw/zinc/38/52/40/1082385240.db2.gz VLUTXLSSNUIKRZ-CQSZACIVSA-N 1 0 364.283 4.240 20 10 FICDRO CC(C)Cc1noc(Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)n1 ZINC000558278517 1082408750 /nfs/dbraw/zinc/40/87/50/1082408750.db2.gz QDVTZJJCJUNFDF-UHFFFAOYSA-N 1 0 352.482 4.038 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)O[C@@H](CC)C(=O)N2)c1ccccc1O ZINC000156161032 1082485098 /nfs/dbraw/zinc/48/50/98/1082485098.db2.gz REVYAEKLYJILNV-AXHNFQJDSA-N 1 0 354.450 4.304 20 10 FICDRO Cc1ccc(CC[N@@H+](Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 ZINC001167461508 1082568854 /nfs/dbraw/zinc/56/88/54/1082568854.db2.gz KRBXTNNRTXXFIQ-HSZRJFAPSA-N 1 0 352.522 4.285 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(Br)cc2)c(O)c1OC ZINC000892431493 1083391204 /nfs/dbraw/zinc/39/12/04/1083391204.db2.gz QTVMKNYFOUBGLL-LLVKDONJSA-N 1 0 366.255 4.023 20 10 FICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)COCc1ccccc1 ZINC000177951514 1084487001 /nfs/dbraw/zinc/48/70/01/1084487001.db2.gz HFIYFXLUKRKTHU-PMACEKPBSA-N 1 0 368.521 4.027 20 10 FICDRO COc1ccccc1[C@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178444235 1085780489 /nfs/dbraw/zinc/78/04/89/1085780489.db2.gz IEYIVQBPCKCQHH-HRAATJIYSA-N 1 0 372.484 4.209 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(Br)ccc1O ZINC000314026080 1085956332 /nfs/dbraw/zinc/95/63/32/1085956332.db2.gz AWLIBDWPGBVYBA-KRWDZBQOSA-N 1 0 363.299 4.462 20 10 FICDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)cn1 ZINC000279010461 1086756827 /nfs/dbraw/zinc/75/68/27/1086756827.db2.gz GVVMSWMJESZVDP-OAHLLOKOSA-N 1 0 370.472 4.020 20 10 FICDRO COc1cc(O)c(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000158834147 1087407100 /nfs/dbraw/zinc/40/71/00/1087407100.db2.gz AYXMIGIILQQSOL-UHFFFAOYSA-N 1 0 355.356 4.060 20 10 FICDRO COc1cc(O)c(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cc1OC ZINC000158838261 1087408588 /nfs/dbraw/zinc/40/85/88/1087408588.db2.gz DRAZVGFQSSCSMU-UHFFFAOYSA-N 1 0 370.493 4.032 20 10 FICDRO c1cc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)cc(C2CCCC2)c1 ZINC001648921271 1087587808 /nfs/dbraw/zinc/58/78/08/1087587808.db2.gz UAHXOBCGLUDKAL-UHFFFAOYSA-N 1 0 350.506 4.471 20 10 FICDRO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)c1 ZINC000176989871 1087721686 /nfs/dbraw/zinc/72/16/86/1087721686.db2.gz JCHCFTUJOPKAHO-LLVKDONJSA-N 1 0 363.841 4.116 20 10 FICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000162358612 1087930395 /nfs/dbraw/zinc/93/03/95/1087930395.db2.gz LYKNEYCBTGUIGJ-QZTJIDSGSA-N 1 0 354.494 4.252 20 10 FICDRO CC[C@@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O ZINC000311311001 1088545490 /nfs/dbraw/zinc/54/54/90/1088545490.db2.gz WQKNFGNNNNZNIH-QGZVFWFLSA-N 1 0 362.514 4.470 20 10 FICDRO CN1CCCc2cc(C[NH2+][C@@H](C[C@@H]3CCOC3)c3ccccc3)ccc21 ZINC000166396241 1088570537 /nfs/dbraw/zinc/57/05/37/1088570537.db2.gz FTQQTEOBHMUPQV-UGKGYDQZSA-N 1 0 350.506 4.327 20 10 FICDRO Oc1ccc(F)cc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000278808690 1088784731 /nfs/dbraw/zinc/78/47/31/1088784731.db2.gz YLLSSOOXTJAABJ-UHFFFAOYSA-N 1 0 369.358 4.346 20 10 FICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000180555540 1090216086 /nfs/dbraw/zinc/21/60/86/1090216086.db2.gz WNLAIXRJFCQVFP-NSHDSACASA-N 1 0 372.412 4.256 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccc(N2CCOCC2)cc1Cl ZINC000122884068 1090223021 /nfs/dbraw/zinc/22/30/21/1090223021.db2.gz VSEVPPXQGVPPKX-JKSUJKDBSA-N 1 0 374.912 4.164 20 10 FICDRO c1[nH]c2ccccc2c1C1=CC[N@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000180658907 1090226627 /nfs/dbraw/zinc/22/66/27/1090226627.db2.gz SNVAKPWUDIEXQZ-UHFFFAOYSA-N 1 0 373.500 4.294 20 10 FICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CN1Cc1ccccc1 ZINC000398086454 1091256595 /nfs/dbraw/zinc/25/65/95/1091256595.db2.gz IFECGFOHACYQBF-NFBKMPQASA-N 1 0 363.549 4.430 20 10 FICDRO C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 ZINC000709435132 1091357382 /nfs/dbraw/zinc/35/73/82/1091357382.db2.gz CAPUSLUFPXEQNI-DUPRYPCISA-N 1 0 373.541 4.191 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2sccc2Cl)SC1=S ZINC000195220920 1091475491 /nfs/dbraw/zinc/47/54/91/1091475491.db2.gz XCNYVKNSRJQKAN-GHXNOFRVSA-N 1 0 374.984 4.191 20 10 FICDRO COC1(C[C@@H](C)[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 ZINC000759997722 1093101608 /nfs/dbraw/zinc/10/16/08/1093101608.db2.gz AKLBJVJBJRKIMW-HZPDHXFCSA-N 1 0 368.468 4.194 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2ccnc(-n3ccnc3)c2)cc1 ZINC000237006053 1093336995 /nfs/dbraw/zinc/33/69/95/1093336995.db2.gz PKEATLIQOBEAOB-UHFFFAOYSA-N 1 0 363.509 4.184 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000237262219 1093454755 /nfs/dbraw/zinc/45/47/55/1093454755.db2.gz ZZPFDKJBRVNHAN-UHFFFAOYSA-N 1 0 364.411 4.473 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3c(O)ccc4ccccc43)CC2)cc1 ZINC000108219663 1093707144 /nfs/dbraw/zinc/70/71/44/1093707144.db2.gz CIBDCDMKXBZMRI-UHFFFAOYSA-N 1 0 362.473 4.266 20 10 FICDRO CC[C@@H]([NH2+]Cc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(C)cc1O ZINC000279969958 1093893296 /nfs/dbraw/zinc/89/32/96/1093893296.db2.gz CVTRGCDGKRDCND-CTNGQTDRSA-N 1 0 368.477 4.059 20 10 FICDRO CC[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000280267517 1094316849 /nfs/dbraw/zinc/31/68/49/1094316849.db2.gz XRADIZKBSVYULR-CTNGQTDRSA-N 1 0 353.441 4.404 20 10 FICDRO CC[N@H+](Cc1cc(I)cs1)Cc1ccccc1O ZINC001141866724 1094321264 /nfs/dbraw/zinc/32/12/64/1094321264.db2.gz QVPLKFUVOSPRPO-UHFFFAOYSA-N 1 0 373.259 4.080 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(N3CCOC3=O)c2)c(O)c1C ZINC000273422130 1096260582 /nfs/dbraw/zinc/26/05/82/1096260582.db2.gz SMJQGTHCLBQDAX-HZPDHXFCSA-N 1 0 354.450 4.377 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc2ccccc2c1O ZINC000273599656 1096277639 /nfs/dbraw/zinc/27/76/39/1096277639.db2.gz RQRLPDJKNZHLBW-LSDHHAIUSA-N 1 0 360.457 4.476 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1O ZINC000273799016 1096296727 /nfs/dbraw/zinc/29/67/27/1096296727.db2.gz WTTLUFUGYIGIRW-SJORKVTESA-N 1 0 365.832 4.203 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000185084366 1101687300 /nfs/dbraw/zinc/68/73/00/1101687300.db2.gz GDLINIUPZLHRQI-HNNXBMFYSA-N 1 0 362.477 4.011 20 10 FICDRO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000186643092 1101774643 /nfs/dbraw/zinc/77/46/43/1101774643.db2.gz RAPYTGBRIZWZFX-BUXKBTBVSA-N 1 0 359.832 4.358 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C)nc1-n1cc(Cl)cn1)c1ccccc1O ZINC000191524909 1101946840 /nfs/dbraw/zinc/94/68/40/1101946840.db2.gz YAGFONFPCXRWLM-KRWDZBQOSA-N 1 0 356.857 4.176 20 10 FICDRO CC(C)(C)OC(=O)NC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000054548672 1102137810 /nfs/dbraw/zinc/13/78/10/1102137810.db2.gz XZWCOZUEOKDBFN-UHFFFAOYSA-N 1 0 356.466 4.035 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1COC2(CCCCC2)O1 ZINC001167983417 1102879873 /nfs/dbraw/zinc/87/98/73/1102879873.db2.gz LCFCYCGHAVVBGY-LJQANCHMSA-N 1 0 357.450 4.063 20 10 FICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c2ccccc2n1 ZINC000729679454 1103027039 /nfs/dbraw/zinc/02/70/39/1103027039.db2.gz JFUBOWONKBZUPK-SFHVURJKSA-N 1 0 361.489 4.231 20 10 FICDRO C[C@H]([NH2+]C[C@@]1(CO)C[C@H]1c1ccc(F)cc1)c1cc2c(cc1O)CCCC2 ZINC000760041218 1105037169 /nfs/dbraw/zinc/03/71/69/1105037169.db2.gz NYCUQBWBIDOWHW-VSUDMRMVSA-N 1 0 369.480 4.227 20 10 FICDRO COCC1CCC([NH2+][C@@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000840875515 1106967872 /nfs/dbraw/zinc/96/78/72/1106967872.db2.gz HVDOEWORQOITKO-OPFPJEHXSA-N 1 0 356.304 4.319 20 10 FICDRO CCOc1ccc(C[NH2+]Cc2cc(F)c(Br)cc2F)c(O)c1 ZINC000527789834 1109824335 /nfs/dbraw/zinc/82/43/35/1109824335.db2.gz GITNXBOMXQBKED-UHFFFAOYSA-N 1 0 372.209 4.121 20 10 FICDRO CN(C)C[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(Cl)c(Cl)c1 ZINC000529668277 1110302872 /nfs/dbraw/zinc/30/28/72/1110302872.db2.gz FYFVOLVPLFEMFD-INIZCTEOSA-N 1 0 357.256 4.231 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cccc(N2CCOCC2)c1 ZINC000479435095 1112021755 /nfs/dbraw/zinc/02/17/55/1112021755.db2.gz FFLXZCUPWFEVRQ-GOSISDBHSA-N 1 0 363.505 4.174 20 10 FICDRO COc1cc([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc(OC)c1OC ZINC000479455433 1112030173 /nfs/dbraw/zinc/03/01/73/1112030173.db2.gz NOOZNCUTYNPWFF-HNNXBMFYSA-N 1 0 368.477 4.363 20 10 FICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1[N+](=O)[O-] ZINC000179399370 1113350418 /nfs/dbraw/zinc/35/04/18/1113350418.db2.gz GTHYZGATVAXWKZ-MRXNPFEDSA-N 1 0 369.465 4.445 20 10 FICDRO Cc1ccc(Br)cc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000783995286 1113458345 /nfs/dbraw/zinc/45/83/45/1113458345.db2.gz WVKREHPANNGVNX-UHFFFAOYSA-N 1 0 351.263 4.252 20 10 FICDRO c1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163615229 1114122237 /nfs/dbraw/zinc/12/22/37/1114122237.db2.gz VHKKHRQYABXKAG-FQEVSTJZSA-N 1 0 354.519 4.243 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000163892002 1114409514 /nfs/dbraw/zinc/40/95/14/1114409514.db2.gz XECBEVNTVHYNCL-OAQYLSRUSA-N 1 0 351.494 4.120 20 10 FICDRO CCc1noc(-c2ccc(CC[NH2+][C@H](CC)c3ccccc3O)cc2)n1 ZINC000156496896 1114452199 /nfs/dbraw/zinc/45/21/99/1114452199.db2.gz UIQBNOSQATWDBS-GOSISDBHSA-N 1 0 351.450 4.288 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000157396159 1115104798 /nfs/dbraw/zinc/10/47/98/1115104798.db2.gz NJHNMPOKPXJOBA-MRXNPFEDSA-N 1 0 369.465 4.231 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)[C@]12CCCO2 ZINC000760881419 1115120461 /nfs/dbraw/zinc/12/04/61/1115120461.db2.gz ORCVRSRAQMBHQQ-GUGJDKNPSA-N 1 0 358.526 4.054 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)c1O ZINC000761216330 1115649230 /nfs/dbraw/zinc/64/92/30/1115649230.db2.gz OFQWISFLRJQXNK-UHFFFAOYSA-N 1 0 369.889 4.044 20 10 FICDRO C[N@H+](Cc1ccc(Br)cc1)Cc1cc(Cl)c(O)cc1O ZINC001232261043 1115778622 /nfs/dbraw/zinc/77/86/22/1115778622.db2.gz AHPZOGNKGDYMHU-UHFFFAOYSA-N 1 0 356.647 4.146 20 10 FICDRO Cc1ccc(O)c(CNc2ccc(NC(=O)C[NH+]3CCCCCC3)cc2)c1 ZINC000174292073 1116127875 /nfs/dbraw/zinc/12/78/75/1116127875.db2.gz APGGJHHPJHCYJE-UHFFFAOYSA-N 1 0 367.493 4.127 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000174547253 1116141240 /nfs/dbraw/zinc/14/12/40/1116141240.db2.gz IHQSPBGQVXJNTR-SFHVURJKSA-N 1 0 371.550 4.104 20 10 FICDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccc(Br)cc2O)c1 ZINC000800496259 1116164223 /nfs/dbraw/zinc/16/42/23/1116164223.db2.gz TVJVHKZPGROZBC-SNVBAGLBSA-N 1 0 355.663 4.362 20 10 FICDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1ccc(N(C)C)cc1 ZINC000152047689 1119068873 /nfs/dbraw/zinc/06/88/73/1119068873.db2.gz IVFZEZWOVQQSDH-QGZVFWFLSA-N 1 0 356.485 4.291 20 10 FICDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1cc(Br)ccc1O ZINC000761500059 1119400634 /nfs/dbraw/zinc/40/06/34/1119400634.db2.gz RRZGIWDRSNATIP-FUHWJXTLSA-N 1 0 364.283 4.237 20 10 FICDRO COc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)ccc1F ZINC000153017160 1119818915 /nfs/dbraw/zinc/81/89/15/1119818915.db2.gz BULXHGYNYLTPIH-OAHLLOKOSA-N 1 0 360.498 4.238 20 10 FICDRO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000153156652 1120044821 /nfs/dbraw/zinc/04/48/21/1120044821.db2.gz GEZOREOGAAVWRN-HRAATJIYSA-N 1 0 368.496 4.433 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F ZINC000153228186 1120370564 /nfs/dbraw/zinc/37/05/64/1120370564.db2.gz HODSWBDXYABCOT-JKSUJKDBSA-N 1 0 358.457 4.083 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)cc1 ZINC000915224665 1120881984 /nfs/dbraw/zinc/88/19/84/1120881984.db2.gz CBODYUXGFHKYFY-UHFFFAOYSA-N 1 0 360.885 4.247 20 10 FICDRO Cc1cc(C(=O)N2CCC([NH+](C)C)CC2)c(C)n1-c1ccc(C(C)C)cc1 ZINC000915265257 1120902063 /nfs/dbraw/zinc/90/20/63/1120902063.db2.gz ATEHSHMDVYNMHG-UHFFFAOYSA-N 1 0 367.537 4.384 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1C ZINC000762652773 1120944185 /nfs/dbraw/zinc/94/41/85/1120944185.db2.gz YKCHNMDYCGBMEI-HFTRVMKXSA-N 1 0 362.514 4.305 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1C ZINC000762652775 1120944289 /nfs/dbraw/zinc/94/42/89/1120944289.db2.gz YKCHNMDYCGBMEI-UWWQBHOKSA-N 1 0 362.514 4.305 20 10 FICDRO Cc1cccc(C[NH2+]C(C)(C)[C@@H](O)c2ccc(Br)cc2)c1O ZINC000762787994 1120962615 /nfs/dbraw/zinc/96/26/15/1120962615.db2.gz RVNUOTWHSHQUBS-KRWDZBQOSA-N 1 0 364.283 4.065 20 10 FICDRO CC[C@@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1ccc(N(C)C)cc1 ZINC000153932262 1121465482 /nfs/dbraw/zinc/46/54/82/1121465482.db2.gz IGQXPOJEHCRHSM-JOCHJYFZSA-N 1 0 365.521 4.116 20 10 FICDRO CN(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001649091636 1121722389 /nfs/dbraw/zinc/72/23/89/1121722389.db2.gz SWZJBYWAVCCOIN-NHCUHLMSSA-N 1 0 357.567 4.347 20 10 FICDRO CN(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001649091533 1121728736 /nfs/dbraw/zinc/72/87/36/1121728736.db2.gz QUAYYGJBOFHORH-VWNXMTODSA-N 1 0 363.549 4.212 20 10 FICDRO CC(=O)c1ccccc1OCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074863 1122069147 /nfs/dbraw/zinc/06/91/47/1122069147.db2.gz ILWOFVAFVDPCJG-UHFFFAOYSA-N 1 0 354.494 4.245 20 10 FICDRO CC1(C)OCc2cc(C[NH2+]CCCSc3nccs3)ccc2O1 ZINC000186390916 1122081147 /nfs/dbraw/zinc/08/11/47/1122081147.db2.gz JRLNVLRHWHXRAT-UHFFFAOYSA-N 1 0 350.509 4.060 20 10 FICDRO COc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(O)c(C(C)(C)C)c1 ZINC000918066959 1122542357 /nfs/dbraw/zinc/54/23/57/1122542357.db2.gz POQOGLYZYPXRSC-UHFFFAOYSA-N 1 0 356.510 4.396 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCc4c3cc(F)cc4F)CC2)cc1 ZINC000154655066 1122575202 /nfs/dbraw/zinc/57/52/02/1122575202.db2.gz RUSRNOROHWHJKW-OAQYLSRUSA-N 1 0 358.432 4.219 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601902 1122723493 /nfs/dbraw/zinc/72/34/93/1122723493.db2.gz LLDUUOVYSBMEMI-PKOBYXMFSA-N 1 0 371.912 4.104 20 10 FICDRO c1ccc([C@H]2CCCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000920183785 1123399324 /nfs/dbraw/zinc/39/93/24/1123399324.db2.gz XPWVKQFLPMPPQQ-DHIUTWEWSA-N 1 0 350.506 4.339 20 10 FICDRO Cc1cc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c(O)c(C(C)(C)C)c1 ZINC000175254231 1123793335 /nfs/dbraw/zinc/79/33/35/1123793335.db2.gz OCIMOBNQVBVIBF-IBGZPJMESA-N 1 0 361.526 4.158 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)[C@H](C)C2 ZINC000180215072 1124266157 /nfs/dbraw/zinc/26/61/57/1124266157.db2.gz YTVJZILHPKDNGE-HOYKHHGWSA-N 1 0 364.533 4.227 20 10 FICDRO C[C@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000765968260 1125196392 /nfs/dbraw/zinc/19/63/92/1125196392.db2.gz DBKAVIBLKNQYKO-IBGZPJMESA-N 1 0 371.569 4.366 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2C(C)C)c1 ZINC000182339196 1125414638 /nfs/dbraw/zinc/41/46/38/1125414638.db2.gz MQOLBYUPPRCCHU-OAHLLOKOSA-N 1 0 356.466 4.122 20 10 FICDRO C[C@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000183161979 1125763237 /nfs/dbraw/zinc/76/32/37/1125763237.db2.gz KJRNIXCERZIBCR-IIBYNOLFSA-N 1 0 367.445 4.166 20 10 FICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](c2ccc(Br)cc2)C1 ZINC001140055205 1080740768 /nfs/dbraw/zinc/74/07/68/1080740768.db2.gz NRZWKDURYSBRPS-ZDUSSCGKSA-N 1 0 350.231 4.283 20 10 FICDRO CC[NH+]1CCN(c2ccc(NCc3ccc(N4CCCC4)cc3)cc2)CC1 ZINC001648859396 1081320812 /nfs/dbraw/zinc/32/08/12/1081320812.db2.gz YZLJHJFXMTYRHS-UHFFFAOYSA-N 1 0 364.537 4.041 20 10 FICDRO c1ccc(C[C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000728301029 1082010160 /nfs/dbraw/zinc/01/01/60/1082010160.db2.gz IJJWMXWUCLFTMO-VWNXMTODSA-N 1 0 364.533 4.414 20 10 FICDRO Cn1c[nH+]cc1Nc1ccc(Br)cc1C(=O)c1ccccc1 ZINC001211250476 1082067053 /nfs/dbraw/zinc/06/70/53/1082067053.db2.gz LFFJQHHPAYJTIP-UHFFFAOYSA-N 1 0 356.223 4.157 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](Cc2nc(C)no2)c2ccccc2)cc1 ZINC000277046570 1083727199 /nfs/dbraw/zinc/72/71/99/1083727199.db2.gz GQCPSYVEVHKVMQ-IERDGZPVSA-N 1 0 364.493 4.469 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1Cl ZINC000177245864 1083780221 /nfs/dbraw/zinc/78/02/21/1083780221.db2.gz TYBQOERMWFDBBF-INIZCTEOSA-N 1 0 358.913 4.400 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000725849029 1084253513 /nfs/dbraw/zinc/25/35/13/1084253513.db2.gz QZDHCEDYWKGNNK-OAHLLOKOSA-N 1 0 366.230 4.297 20 10 FICDRO C[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccc(N(C)C)cc1 ZINC000177968897 1084517406 /nfs/dbraw/zinc/51/74/06/1084517406.db2.gz UBPQIIZIRSQFEW-IBGZPJMESA-N 1 0 351.538 4.110 20 10 FICDRO COCc1cc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)ccc1OC ZINC000177975049 1084520557 /nfs/dbraw/zinc/52/05/57/1084520557.db2.gz ODEUSQPDKCAACX-KRWDZBQOSA-N 1 0 354.494 4.293 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(N(C)C)cc1 ZINC000159056959 1085087150 /nfs/dbraw/zinc/08/71/50/1085087150.db2.gz XQCKTOPRJWLSIM-JKSUJKDBSA-N 1 0 366.509 4.448 20 10 FICDRO COCc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)cc1 ZINC000124392636 1085139261 /nfs/dbraw/zinc/13/92/61/1085139261.db2.gz JBKSLNWMSVXEDQ-INIZCTEOSA-N 1 0 374.912 4.174 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(-n2nc(C)cc2C)nc1)c1ccc(N(C)C)cc1 ZINC000162804278 1085418369 /nfs/dbraw/zinc/41/83/69/1085418369.db2.gz XRPXGKJMXOEVMM-NRFANRHFSA-N 1 0 363.509 4.191 20 10 FICDRO CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000756735780 1085650329 /nfs/dbraw/zinc/65/03/29/1085650329.db2.gz IESWPUHBBQWAJB-GDZNZVCISA-N 1 0 356.304 4.257 20 10 FICDRO Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178697055 1085879429 /nfs/dbraw/zinc/87/94/29/1085879429.db2.gz XBXZJVGEESCQSF-IAGOWNOFSA-N 1 0 358.505 4.308 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)cc1F ZINC000182008597 1086667101 /nfs/dbraw/zinc/66/71/01/1086667101.db2.gz NPKVCAUMVOBVPD-JTQLQIEISA-N 1 0 351.805 4.247 20 10 FICDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)cn1 ZINC000278976967 1086734006 /nfs/dbraw/zinc/73/40/06/1086734006.db2.gz CQYZEILJCPVYBP-QGZVFWFLSA-N 1 0 366.509 4.271 20 10 FICDRO C[C@@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000311301305 1088545049 /nfs/dbraw/zinc/54/50/49/1088545049.db2.gz RYSVTQGUKLYHSN-CQSZACIVSA-N 1 0 366.477 4.219 20 10 FICDRO COc1ccc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)c(O)c1OC ZINC000893232148 1090354167 /nfs/dbraw/zinc/35/41/67/1090354167.db2.gz ZPZKFBAWYANXEB-CQSZACIVSA-N 1 0 373.346 4.332 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1cc2c(cc1O)CCCC2 ZINC000185019564 1090496573 /nfs/dbraw/zinc/49/65/73/1090496573.db2.gz QEAGIGGOKSZUNI-MRXNPFEDSA-N 1 0 364.489 4.249 20 10 FICDRO CCOc1ccc(C2(C[NH2+][C@H](C)c3cc(F)ccc3O)CCOCC2)cc1 ZINC000185127069 1090511298 /nfs/dbraw/zinc/51/12/98/1090511298.db2.gz RDYCARYXGIEFDN-MRXNPFEDSA-N 1 0 373.468 4.329 20 10 FICDRO COCCC1(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)CCC1 ZINC000122978208 1090541694 /nfs/dbraw/zinc/54/16/94/1090541694.db2.gz YKGRBYNIJSZOER-MRXNPFEDSA-N 1 0 366.933 4.034 20 10 FICDRO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310074564 1090615436 /nfs/dbraw/zinc/61/54/36/1090615436.db2.gz FTHXCTXGPMTUQX-OAHLLOKOSA-N 1 0 365.304 4.311 20 10 FICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000162370483 1090766599 /nfs/dbraw/zinc/76/65/99/1090766599.db2.gz ORYVLCZLKDRYRR-IRXDYDNUSA-N 1 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c1ccc(C[C@@H]2CCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000236584634 1092397550 /nfs/dbraw/zinc/39/75/50/1092397550.db2.gz ISBPMTFEZFPVLF-JTHBVZDNSA-N 1 0 350.506 4.024 20 10 FICDRO COC1(C[C@H](C)[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 ZINC000759997724 1093101157 /nfs/dbraw/zinc/10/11/57/1093101157.db2.gz AKLBJVJBJRKIMW-JKSUJKDBSA-N 1 0 368.468 4.194 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H]2CCc3n[nH]cc3C2)cc1 ZINC000236972843 1093250930 /nfs/dbraw/zinc/25/09/30/1093250930.db2.gz CXJGLNJAMPJGQV-OAQYLSRUSA-N 1 0 360.505 4.083 20 10 FICDRO COc1cc(C)cc(C[NH2+]Cc2cc(C(F)(F)F)cc(Cl)n2)c1O ZINC000895473182 1093560873 /nfs/dbraw/zinc/56/08/73/1093560873.db2.gz HEDPYLQSHAYWCG-UHFFFAOYSA-N 1 0 360.763 4.066 20 10 FICDRO CC(C)(C)OC(=O)Nc1ccnc(C[NH2+]Cc2cccc(Cl)c2[O-])c1 ZINC000895760868 1093706661 /nfs/dbraw/zinc/70/66/61/1093706661.db2.gz KAWXYZRNTJUZQF-UHFFFAOYSA-N 1 0 363.845 4.077 20 10 FICDRO O=C(Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cccc(Cl)c1 ZINC000108900128 1095731045 /nfs/dbraw/zinc/73/10/45/1095731045.db2.gz UCPMXVCGOCMWOZ-UHFFFAOYSA-N 1 0 369.896 4.124 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc(OC)c1OC ZINC000273401648 1096258990 /nfs/dbraw/zinc/25/89/90/1096258990.db2.gz NEQDCIDHVWIMRE-RYUDHWBXSA-N 1 0 365.857 4.483 20 10 FICDRO CCN(CC)C(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273405856 1096259934 /nfs/dbraw/zinc/25/99/34/1096259934.db2.gz OIXPCOMQHMPXMY-QGZVFWFLSA-N 1 0 354.494 4.342 20 10 FICDRO CCN(CC)C(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273405852 1096259967 /nfs/dbraw/zinc/25/99/67/1096259967.db2.gz OIXPCOMQHMPXMY-KRWDZBQOSA-N 1 0 354.494 4.342 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(N3CCOC3=O)c2)c(O)c1C ZINC000273422128 1096260980 /nfs/dbraw/zinc/26/09/80/1096260980.db2.gz SMJQGTHCLBQDAX-CVEARBPZSA-N 1 0 354.450 4.377 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)nc2)c(O)c1 ZINC000237481922 1099926687 /nfs/dbraw/zinc/92/66/87/1099926687.db2.gz JSUIZNDRGLVJPH-UHFFFAOYSA-N 1 0 354.381 4.017 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000185084320 1101686945 /nfs/dbraw/zinc/68/69/45/1101686945.db2.gz DJZHJVIQEQJEPL-HNNXBMFYSA-N 1 0 358.445 4.285 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000185675708 1101743774 /nfs/dbraw/zinc/74/37/74/1101743774.db2.gz DLHOSCVDAIMRPQ-CABCVRRESA-N 1 0 351.450 4.307 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4ccc(F)cc4)C3)cc2)CC1 ZINC000828031652 1101831599 /nfs/dbraw/zinc/83/15/99/1101831599.db2.gz OVKACAODKBSKBE-HXUWFJFHSA-N 1 0 368.496 4.430 20 10 FICDRO CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648985222 1102570470 /nfs/dbraw/zinc/57/04/70/1102570470.db2.gz BGGQUWLCUUKIDA-RFWXGWTQSA-N 1 0 358.570 4.446 20 10 FICDRO Cc1ncc([C@@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)s1 ZINC000127267938 1102725472 /nfs/dbraw/zinc/72/54/72/1102725472.db2.gz QGTQRKHPZIHNEO-GFCCVEGCSA-N 1 0 367.465 4.373 20 10 FICDRO CC(C)(C)NC(=O)CC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000729685738 1103142085 /nfs/dbraw/zinc/14/20/85/1103142085.db2.gz MVWTZEBLYOYSEL-UHFFFAOYSA-N 1 0 362.558 4.382 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](CC3CC3)CC2)c(C)n1-c1ccccc1C ZINC000195586960 1105185452 /nfs/dbraw/zinc/18/54/52/1105185452.db2.gz KJGQANOTLDZZRB-UHFFFAOYSA-N 1 0 365.521 4.007 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c2ccccc2)n1 ZINC000760052144 1105218664 /nfs/dbraw/zinc/21/86/64/1105218664.db2.gz PZGQQRRUGZEHTO-AFAVFJNCSA-N 1 0 367.424 4.345 20 10 FICDRO Cc1ccc2[nH+]ccc(NCc3ccc(N4CCOCC4)c(F)c3)c2c1 ZINC000302174891 1107326862 /nfs/dbraw/zinc/32/68/62/1107326862.db2.gz WMXCSANGARYXPS-UHFFFAOYSA-N 1 0 351.425 4.131 20 10 FICDRO CCOCc1cc(C[NH2+]CCc2ccc([Si](C)(C)C)cc2)ccc1OC ZINC001203162328 1108780008 /nfs/dbraw/zinc/78/00/08/1108780008.db2.gz ZFLMRARCKJKCID-UHFFFAOYSA-N 1 0 371.597 4.109 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000367396158 1109665498 /nfs/dbraw/zinc/66/54/98/1109665498.db2.gz HEPSKFCEASEFIJ-HRAATJIYSA-N 1 0 351.494 4.291 20 10 FICDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c1O ZINC000528035654 1109890059 /nfs/dbraw/zinc/89/00/59/1109890059.db2.gz JGMHFKXOYUFANU-MNOVXSKESA-N 1 0 353.235 4.409 20 10 FICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1c(C)c3ccccc3n1C)CCCO2 ZINC000479436137 1112022441 /nfs/dbraw/zinc/02/24/41/1112022441.db2.gz ISQUHMSIROMAOY-LJQANCHMSA-N 1 0 350.462 4.499 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCC(=O)Nc2ccc(F)cc21 ZINC000479456760 1112029954 /nfs/dbraw/zinc/02/99/54/1112029954.db2.gz QKMGQUOYKQBIPK-KRWDZBQOSA-N 1 0 351.425 4.189 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1F ZINC000163594133 1113868205 /nfs/dbraw/zinc/86/82/05/1113868205.db2.gz YYAQAURFOVWOFJ-HNNXBMFYSA-N 1 0 360.498 4.238 20 10 FICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F ZINC000150874186 1114151449 /nfs/dbraw/zinc/15/14/49/1114151449.db2.gz JDBJKZWZGBRJQQ-OAQYLSRUSA-N 1 0 360.448 4.288 20 10 FICDRO CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151063292 1114288157 /nfs/dbraw/zinc/28/81/57/1114288157.db2.gz RQFCQIZSEDBUMJ-QGZVFWFLSA-N 1 0 356.535 4.486 20 10 FICDRO O=C(NC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1)c1ccsc1 ZINC000057106909 1114873298 /nfs/dbraw/zinc/87/32/98/1114873298.db2.gz MSCBYSCFEXEVGK-UHFFFAOYSA-N 1 0 366.486 4.001 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cn(C(C)(C)C)nc3C)CC2)cc1 ZINC000157414554 1115103113 /nfs/dbraw/zinc/10/31/13/1115103113.db2.gz PBKMYVQZVXFGQC-INIZCTEOSA-N 1 0 370.541 4.275 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OCCOC)c1ccc(N(C)C)cc1 ZINC000167639763 1115310254 /nfs/dbraw/zinc/31/02/54/1115310254.db2.gz LZVDRVNYCVEPFT-OAQYLSRUSA-N 1 0 356.510 4.327 20 10 FICDRO CC[C@@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1O ZINC000157966406 1115414871 /nfs/dbraw/zinc/41/48/71/1115414871.db2.gz FMELWBNAQVRNFZ-QGZVFWFLSA-N 1 0 355.413 4.255 20 10 FICDRO COc1cc(Cl)cc(C[N@@H+]2CCCN(c3ccc(C)cc3)CC2)c1O ZINC000761184940 1115600381 /nfs/dbraw/zinc/60/03/81/1115600381.db2.gz QGKHRMAZYHKQJQ-UHFFFAOYSA-N 1 0 360.885 4.075 20 10 FICDRO CCC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000761203592 1115622912 /nfs/dbraw/zinc/62/29/12/1115622912.db2.gz WOAFCFAOGGGRSY-ZTFGCOKTSA-N 1 0 353.890 4.080 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](OC)c2ccc(F)cc2)c1O ZINC000761216689 1115648865 /nfs/dbraw/zinc/64/88/65/1115648865.db2.gz WDQBGBOJAGKWFV-BBATYDOGSA-N 1 0 353.821 4.059 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+]C2CCC(F)(F)CC2)ccc1N1CCCCC1 ZINC000761334434 1115805950 /nfs/dbraw/zinc/80/59/50/1115805950.db2.gz CYSPWBUAOSKJFE-UHFFFAOYSA-N 1 0 353.413 4.253 20 10 FICDRO Cc1nc(C)c(C[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 ZINC000174622511 1116231436 /nfs/dbraw/zinc/23/14/36/1116231436.db2.gz PADOHMYOJWLZRK-AWEZNQCLSA-N 1 0 367.465 4.120 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c(C)c1 ZINC000151583717 1118939120 /nfs/dbraw/zinc/93/91/20/1118939120.db2.gz MXHUPPWNELTACD-IBGZPJMESA-N 1 0 352.522 4.363 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Cl)cc1 ZINC000151587787 1118939495 /nfs/dbraw/zinc/93/94/95/1118939495.db2.gz YRUBXDSIUIBVEL-INIZCTEOSA-N 1 0 358.913 4.400 20 10 FICDRO Cc1cccc(C)c1C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000761981129 1120614603 /nfs/dbraw/zinc/61/46/03/1120614603.db2.gz GOCCROQJHMSYRE-GOSISDBHSA-N 1 0 372.896 4.057 20 10 FICDRO Clc1scc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)c1Cl ZINC000762419649 1120904694 /nfs/dbraw/zinc/90/46/94/1120904694.db2.gz GJEIXECPJMBGBO-UHFFFAOYSA-N 1 0 357.306 4.181 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(N2CCOCC2)c(F)c1 ZINC000153548812 1120909146 /nfs/dbraw/zinc/90/91/46/1120909146.db2.gz KMKHDEVTOHEOGP-KBPBESRZSA-N 1 0 364.411 4.352 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1ccc(N2CCOCC2)c(F)c1 ZINC000153549077 1120912712 /nfs/dbraw/zinc/91/27/12/1120912712.db2.gz KMKHDEVTOHEOGP-ZIAGYGMSSA-N 1 0 364.411 4.352 20 10 FICDRO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CCC2 ZINC000762476265 1120913177 /nfs/dbraw/zinc/91/31/77/1120913177.db2.gz OSKWFUASPWMIQF-NRFANRHFSA-N 1 0 356.897 4.344 20 10 FICDRO Cc1cccc([C@H](NCc2ccc(N3CCOCC3)cc2)c2ccccn2)c1 ZINC000153558816 1120915513 /nfs/dbraw/zinc/91/55/13/1120915513.db2.gz MKJKGBZOMUZIQA-DEOSSOPVSA-N 1 0 373.500 4.106 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)C(C)(C)C)C1 ZINC001626060314 1121266380 /nfs/dbraw/zinc/26/63/80/1121266380.db2.gz SRYOQQFCLOCVGW-QGZVFWFLSA-N 1 0 369.553 4.206 20 10 FICDRO COc1ccc([C@H]2C[C@@H]([NH2+]Cc3ccc(N4CCCC4)cc3)CCO2)cc1 ZINC001168586296 1121536029 /nfs/dbraw/zinc/53/60/29/1121536029.db2.gz SNNLTBCVXRGMBQ-NZQKXSOJSA-N 1 0 366.505 4.305 20 10 FICDRO COc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(N4CCCC4)cc3)CCO2)cc1 ZINC001168586295 1121536187 /nfs/dbraw/zinc/53/61/87/1121536187.db2.gz SNNLTBCVXRGMBQ-NFBKMPQASA-N 1 0 366.505 4.305 20 10 FICDRO C[C@@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)NC(=O)OC(C)(C)C ZINC000785441098 1121603778 /nfs/dbraw/zinc/60/37/78/1121603778.db2.gz YQTVBESZQFQGLT-KRWDZBQOSA-N 1 0 361.530 4.022 20 10 FICDRO CCOCc1cc(CNC[C@H]2CCC[N@@H+]2CC2CCCCC2)ccc1OC ZINC001649095528 1121755216 /nfs/dbraw/zinc/75/52/16/1121755216.db2.gz DYYNKZYNKVIUTN-JOCHJYFZSA-N 1 0 374.569 4.366 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(OC)cc3OC)CC2)cc1 ZINC000154181674 1121860999 /nfs/dbraw/zinc/86/09/99/1121860999.db2.gz CWBHDVPEDACDFL-INIZCTEOSA-N 1 0 370.493 4.032 20 10 FICDRO CC(C)(C)c1ccc(CC[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000916833065 1121875147 /nfs/dbraw/zinc/87/51/47/1121875147.db2.gz BWJBUXQGRVWYLL-UHFFFAOYSA-N 1 0 352.522 4.153 20 10 FICDRO COc1ccc([C@H]2C[C@H]([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168610171 1121974186 /nfs/dbraw/zinc/97/41/86/1121974186.db2.gz RHVWMRJBOZDCER-DKZVUGQWSA-N 1 0 354.494 4.332 20 10 FICDRO Cc1ccccc1OCCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000765798761 1122017044 /nfs/dbraw/zinc/01/70/44/1122017044.db2.gz CCWQCOXNPFJLGH-SFHVURJKSA-N 1 0 372.484 4.090 20 10 FICDRO CC(C)[N@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccc(N(C)C)cc1 ZINC000917074910 1122069338 /nfs/dbraw/zinc/06/93/38/1122069338.db2.gz KWDGEMAPEDYMQF-UHFFFAOYSA-N 1 0 357.473 4.131 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H]3CCc4c3cc(F)cc4F)CC2)cc1 ZINC000154655184 1122575429 /nfs/dbraw/zinc/57/54/29/1122575429.db2.gz RUSRNOROHWHJKW-NRFANRHFSA-N 1 0 358.432 4.219 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1C(C)C ZINC000918182620 1122584292 /nfs/dbraw/zinc/58/42/92/1122584292.db2.gz BSVIWPWCNPNWEF-KRWDZBQOSA-N 1 0 362.514 4.313 20 10 FICDRO COC(=O)CN(Cc1ccc(Cl)cc1)Cc1c(O)ccc2ccccc21 ZINC000921188165 1123580364 /nfs/dbraw/zinc/58/03/64/1123580364.db2.gz FWZCFZKCXIGDFY-UHFFFAOYSA-N 1 0 369.848 4.374 20 10 FICDRO Nc1cc[nH+]c2cc(NCc3cc(Cl)c4cccnc4c3O)ccc12 ZINC001168525428 1123839884 /nfs/dbraw/zinc/83/98/84/1123839884.db2.gz CYWYVHCVEZBBJX-UHFFFAOYSA-N 1 0 350.809 4.336 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 ZINC000237766566 1124064591 /nfs/dbraw/zinc/06/45/91/1124064591.db2.gz QSEHAWPTYGGJOJ-MRXNPFEDSA-N 1 0 362.420 4.061 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)c1 ZINC000237766711 1124064638 /nfs/dbraw/zinc/06/46/38/1124064638.db2.gz PIJLZTAEEZZFKV-GOSISDBHSA-N 1 0 364.411 4.084 20 10 FICDRO COc1cc(O)c(C[N@H+](Cc2ccccc2O)C2CCCC2)cc1OC ZINC000180183042 1124257597 /nfs/dbraw/zinc/25/75/97/1124257597.db2.gz HCCHGAIBJRZGFL-UHFFFAOYSA-N 1 0 357.450 4.060 20 10 FICDRO COc1ccc([C@H]([NH2+]Cc2cc(OC)ccc2O)c2ccc(F)cc2)cc1 ZINC000180886468 1124461114 /nfs/dbraw/zinc/46/11/14/1124461114.db2.gz JXAZKSAKQYTBLW-JOCHJYFZSA-N 1 0 367.420 4.428 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@H](COc2ccccc2F)c2ccccc2)c1 ZINC000180907132 1124465772 /nfs/dbraw/zinc/46/57/72/1124465772.db2.gz WQCRIFBXWCKRMA-HXUWFJFHSA-N 1 0 367.420 4.450 20 10 FICDRO CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1 ZINC000181963236 1125199539 /nfs/dbraw/zinc/19/95/39/1125199539.db2.gz XCGRVSOIPMAYSB-MRXNPFEDSA-N 1 0 369.534 4.049 20 10 FICDRO CCOC(=O)c1oc2ccccc2c1C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000182327558 1125411267 /nfs/dbraw/zinc/41/12/67/1125411267.db2.gz WRXWDPASKJKJJF-ZDUSSCGKSA-N 1 0 369.417 4.175 20 10 FICDRO C[N@@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@H]1CCCOC1 ZINC000255033053 1080442061 /nfs/dbraw/zinc/44/20/61/1080442061.db2.gz PKBPFVLKVKMMJO-QGZVFWFLSA-N 1 0 366.465 4.399 20 10 FICDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc(OC(F)F)c1 ZINC001648799454 1080905967 /nfs/dbraw/zinc/90/59/67/1080905967.db2.gz NUZOBKSKQLMTOT-LLVKDONJSA-N 1 0 356.363 4.483 20 10 FICDRO CC(C)([NH2+]Cc1cc(Br)ccc1O)c1ccc([N+](=O)[O-])cc1 ZINC000175986037 1082398239 /nfs/dbraw/zinc/39/82/39/1082398239.db2.gz SHRMKVUJXJKULV-UHFFFAOYSA-N 1 0 365.227 4.088 20 10 FICDRO C[NH+](C)Cc1cccc(C(=O)Nc2cccc(N3CCCCCC3)c2)c1 ZINC000157089615 1082459029 /nfs/dbraw/zinc/45/90/29/1082459029.db2.gz CCIBFLVVVFHSIX-UHFFFAOYSA-N 1 0 351.494 4.381 20 10 FICDRO COc1cc(O)c(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000276519084 1082834989 /nfs/dbraw/zinc/83/49/89/1082834989.db2.gz BXHZGMCFRVJDAD-NSHDSACASA-N 1 0 355.356 4.279 20 10 FICDRO C[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178253975 1083024255 /nfs/dbraw/zinc/02/42/55/1083024255.db2.gz MWZGRCKRXPPWES-KRWDZBQOSA-N 1 0 359.533 4.341 20 10 FICDRO COc1ccc(C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)c(O)c1OC ZINC000892467897 1083530702 /nfs/dbraw/zinc/53/07/02/1083530702.db2.gz BHAFICQQBNSDSW-CQSZACIVSA-N 1 0 365.882 4.390 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC ZINC000157420504 1084379132 /nfs/dbraw/zinc/37/91/32/1084379132.db2.gz FQMRRAGCZXLGKB-CABCVRRESA-N 1 0 358.482 4.190 20 10 FICDRO C[N@H+](CCC[NH2+]Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1 ZINC000310714450 1084391671 /nfs/dbraw/zinc/39/16/71/1084391671.db2.gz OHYPRHFXWWSSFR-UHFFFAOYSA-N 1 0 351.538 4.289 20 10 FICDRO C[C@H](C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)COCc1ccccc1 ZINC000177951547 1084486066 /nfs/dbraw/zinc/48/60/66/1084486066.db2.gz HFIYFXLUKRKTHU-WOJBJXKFSA-N 1 0 368.521 4.027 20 10 FICDRO CC(C)COc1ccc(C(C)(C)[NH2+]Cc2cc3c(cc2O)OCO3)cc1 ZINC000236711134 1085279736 /nfs/dbraw/zinc/27/97/36/1085279736.db2.gz NEJNLUTYYVZGGW-UHFFFAOYSA-N 1 0 357.450 4.181 20 10 FICDRO CC[S@@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000162801321 1085383440 /nfs/dbraw/zinc/38/34/40/1085383440.db2.gz ZBVHOWWZBARMEZ-FSNLZSBCSA-N 1 0 362.583 4.407 20 10 FICDRO COc1cccc(F)c1CNc1ccc2c(c1)ncn2[C@@H]1CCC[NH2+]CC1 ZINC001167606974 1085539086 /nfs/dbraw/zinc/53/90/86/1085539086.db2.gz LTYJBFYMACLTFA-MRXNPFEDSA-N 1 0 368.456 4.111 20 10 FICDRO Cc1ccc(C(=O)N2CCC([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CC2)cc1 ZINC000160982331 1085774702 /nfs/dbraw/zinc/77/47/02/1085774702.db2.gz HCWAZAWYAZFULC-SFHVURJKSA-N 1 0 365.521 4.016 20 10 FICDRO COc1ccc(N2CCCN(Cc3cc(-c4cccs4)on3)CC2)cc1 ZINC000052465568 1086857121 /nfs/dbraw/zinc/85/71/21/1086857121.db2.gz XMSNXKXBUVBHTR-UHFFFAOYSA-N 1 0 369.490 4.124 20 10 FICDRO COc1ccc(OC)c([C@H](C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)c1 ZINC000176989854 1087722127 /nfs/dbraw/zinc/72/21/27/1087722127.db2.gz JCHCFTUJOPKAHO-NSHDSACASA-N 1 0 363.841 4.116 20 10 FICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163627961 1088160073 /nfs/dbraw/zinc/16/00/73/1088160073.db2.gz JPRQYGRPYIRYGT-QGZVFWFLSA-N 1 0 356.535 4.489 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000311291690 1088528982 /nfs/dbraw/zinc/52/89/82/1088528982.db2.gz BERPIEJJBZXHNH-IIBYNOLFSA-N 1 0 362.514 4.388 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311298389 1088543960 /nfs/dbraw/zinc/54/39/60/1088543960.db2.gz IGMGRAOYQLWIJG-ULQDDVLXSA-N 1 0 362.514 4.387 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000311303169 1088546650 /nfs/dbraw/zinc/54/66/50/1088546650.db2.gz OANJYCHLJFYUHP-AEFFLSMTSA-N 1 0 361.530 4.193 20 10 FICDRO CN1CCCc2cc(C[NH2+][C@H](C[C@@H]3CCOC3)c3ccccc3)ccc21 ZINC000166396360 1088570734 /nfs/dbraw/zinc/57/07/34/1088570734.db2.gz FTQQTEOBHMUPQV-SIKLNZKXSA-N 1 0 350.506 4.327 20 10 FICDRO COc1ccc(CN2CCCc3cc(O)c(O)cc3C2)c(C(F)(F)F)c1 ZINC001143485136 1088962593 /nfs/dbraw/zinc/96/25/93/1088962593.db2.gz WCXCNBQMTDPYJD-UHFFFAOYSA-N 1 0 367.367 4.074 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1C ZINC000181467215 1090281308 /nfs/dbraw/zinc/28/13/08/1090281308.db2.gz SBXHGZHQNYRRRQ-OAHLLOKOSA-N 1 0 353.388 4.061 20 10 FICDRO CC(C)Cn1ncnc1CN(Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000182974750 1090383695 /nfs/dbraw/zinc/38/36/95/1090383695.db2.gz SJTGENPECBMBJV-SFHVURJKSA-N 1 0 364.493 4.403 20 10 FICDRO C[N@H+](CCc1nccs1)Cc1ccc(OCc2ccccc2)cc1O ZINC000183116190 1090391500 /nfs/dbraw/zinc/39/15/00/1090391500.db2.gz XUWROPHNNIGCHV-UHFFFAOYSA-N 1 0 354.475 4.102 20 10 FICDRO COc1cccc(Oc2ncccc2C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183528028 1090419645 /nfs/dbraw/zinc/41/96/45/1090419645.db2.gz GTHBWKRTRFWAQT-OAHLLOKOSA-N 1 0 350.418 4.439 20 10 FICDRO CC(C)(C)OC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000312210818 1090430072 /nfs/dbraw/zinc/43/00/72/1090430072.db2.gz UXESGYXQXIYHIS-HXUWFJFHSA-N 1 0 373.541 4.166 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1cc2c(cc1O)CCCC2 ZINC000184905172 1090487652 /nfs/dbraw/zinc/48/76/52/1090487652.db2.gz KLKOVLUDJOUEEH-INIZCTEOSA-N 1 0 364.489 4.249 20 10 FICDRO C[C@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)c1ccc(N(C)C)cc1 ZINC000162636605 1091177711 /nfs/dbraw/zinc/17/77/11/1091177711.db2.gz AVVGPAJCAVCPHS-SFHVURJKSA-N 1 0 368.521 4.299 20 10 FICDRO COc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000194856240 1091423926 /nfs/dbraw/zinc/42/39/26/1091423926.db2.gz CHNQIFQRCCVBHN-NRFANRHFSA-N 1 0 368.546 4.416 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(-n3nc(C)cc3C)nc2)cc1 ZINC000162775801 1091477465 /nfs/dbraw/zinc/47/74/65/1091477465.db2.gz OQTOKWAXYHLDJP-GOSISDBHSA-N 1 0 363.509 4.191 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3[nH]c(=O)ccc32)c(C(F)(F)F)c1 ZINC000279825881 1092056919 /nfs/dbraw/zinc/05/69/19/1092056919.db2.gz GOLMTUXTVJDYCV-INIZCTEOSA-N 1 0 365.399 4.039 20 10 FICDRO CN(C)C(=O)Nc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000279895356 1092082472 /nfs/dbraw/zinc/08/24/72/1092082472.db2.gz PKXSNSMUEMAKFL-UHFFFAOYSA-N 1 0 366.509 4.060 20 10 FICDRO Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc(C[NH+]2CCCC2)cc1 ZINC000028170579 1092218337 /nfs/dbraw/zinc/21/83/37/1092218337.db2.gz MOVOUHODMZREIT-UHFFFAOYSA-N 1 0 374.444 4.099 20 10 FICDRO CN1CCCc2cc(C[NH2+][C@@H]3CN(Cc4ccccc4)C(C)(C)C3)ccc21 ZINC001648951411 1093971869 /nfs/dbraw/zinc/97/18/69/1093971869.db2.gz VHKXKSFRCXKULZ-QFIPXVFZSA-N 1 0 363.549 4.212 20 10 FICDRO COCCSc1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(OC)c2O)cc1 ZINC000894234967 1094276117 /nfs/dbraw/zinc/27/61/17/1094276117.db2.gz MRKNPQPADOYWAE-OAHLLOKOSA-N 1 0 361.507 4.299 20 10 FICDRO C[C@H]([NH2+]C[C@H]1CCN(CC(F)(F)F)C1)c1ccc(N2CCCCC2)cc1 ZINC000163181756 1094323601 /nfs/dbraw/zinc/32/36/01/1094323601.db2.gz JBHUHNGJJIQQHZ-DLBZAZTESA-N 1 0 369.475 4.212 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc(OC)c1OC ZINC000273297631 1096247716 /nfs/dbraw/zinc/24/77/16/1096247716.db2.gz ANWDHOUIZKYEJI-CABCVRRESA-N 1 0 359.466 4.447 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000273799008 1096296840 /nfs/dbraw/zinc/29/68/40/1096296840.db2.gz WTTLUFUGYIGIRW-IAGOWNOFSA-N 1 0 365.832 4.203 20 10 FICDRO C[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000163470138 1099568845 /nfs/dbraw/zinc/56/88/45/1099568845.db2.gz ITSLLZNODGMLDZ-MJGOQNOKSA-N 1 0 364.505 4.052 20 10 FICDRO C[C@H]([NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccccc1O ZINC000183419057 1101627616 /nfs/dbraw/zinc/62/76/16/1101627616.db2.gz JXHXPYLEFCQWNB-ZDUSSCGKSA-N 1 0 365.399 4.126 20 10 FICDRO CC[C@@H]([NH2+]C1CCC(O)(c2cccnc2)CC1)c1ccc(N(C)C)cc1 ZINC000186344338 1101767150 /nfs/dbraw/zinc/76/71/50/1101767150.db2.gz DICMSLKNVKFQIK-NJEKYYFSSA-N 1 0 353.510 4.019 20 10 FICDRO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000760406024 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FICDRO COc1ccc(C(C)(C)[NH2+]Cc2ccc(Br)cc2O)cc1F ZINC000529650876 1110300006 /nfs/dbraw/zinc/30/00/06/1110300006.db2.gz IZFYALKKQBJTPE-UHFFFAOYSA-N 1 0 368.246 4.327 20 10 FICDRO C[C@H](CNC(=O)OC(C)(C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000697901619 1112450761 /nfs/dbraw/zinc/45/07/61/1112450761.db2.gz UXNHJWLXZNCWOD-GJZGRUSLSA-N 1 0 358.482 4.357 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1[N+](=O)[O-] ZINC000163600622 1113885893 /nfs/dbraw/zinc/88/58/93/1113885893.db2.gz FTPIYVJFIPVIOD-MRXNPFEDSA-N 1 0 371.506 4.307 20 10 FICDRO CNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)cc1 ZINC000151028211 1114271215 /nfs/dbraw/zinc/27/12/15/1114271215.db2.gz LWAXOJSDPDBVNI-SFHVURJKSA-N 1 0 365.521 4.277 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC[C@H]1CCCO1)c1ccccc1O ZINC000156336760 1114417634 /nfs/dbraw/zinc/41/76/34/1114417634.db2.gz BPVPRSOOPGTPJM-UYAOXDASSA-N 1 0 355.478 4.499 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2c(OC)cc(OC)cc2OC)cc1 ZINC000164402223 1114494341 /nfs/dbraw/zinc/49/43/41/1114494341.db2.gz WMSNQMAWOMWQCH-OAHLLOKOSA-N 1 0 358.482 4.019 20 10 FICDRO C[C@@H]1C[C@@H]([NH2+]C2CCC(O)(c3ccccc3)CC2)c2c1c(F)ccc2O ZINC000760909850 1115171329 /nfs/dbraw/zinc/17/13/29/1115171329.db2.gz WZXOWUWUTXFJQR-QGRGTZHJSA-N 1 0 355.453 4.500 20 10 FICDRO C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)c1cncs1 ZINC000157719998 1115285715 /nfs/dbraw/zinc/28/57/15/1115285715.db2.gz MWZVOOLNOSKIAI-LBPRGKRZSA-N 1 0 353.438 4.064 20 10 FICDRO C[C@H]([NH2+][C@H]1CCN(c2ncccc2F)C1)c1ccc(N2CCCCC2)cc1 ZINC000168112551 1115425738 /nfs/dbraw/zinc/42/57/38/1115425738.db2.gz KUDRTQFYJXUAFR-HKUYNNGSSA-N 1 0 368.500 4.141 20 10 FICDRO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(Cl)cc(OC)c1O ZINC000761182382 1115596580 /nfs/dbraw/zinc/59/65/80/1115596580.db2.gz CTHVQAQMHQCYPS-UHFFFAOYSA-N 1 0 365.857 4.094 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H](OC)c2ccc(Cl)cc2)c1O ZINC000761207620 1115625638 /nfs/dbraw/zinc/62/56/38/1115625638.db2.gz QWPITIRESBFWBX-MRXNPFEDSA-N 1 0 356.249 4.185 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](OC)c2ccccc2F)c1O ZINC000761214231 1115645708 /nfs/dbraw/zinc/64/57/08/1115645708.db2.gz AGMZNXHBKRSIDU-VOJFVSQTSA-N 1 0 353.821 4.059 20 10 FICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc2c(c1)OCCCO2 ZINC000171378323 1115863342 /nfs/dbraw/zinc/86/33/42/1115863342.db2.gz VZJKCSMPFRBSGI-INIZCTEOSA-N 1 0 352.478 4.081 20 10 FICDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)c1 ZINC000800496594 1116168504 /nfs/dbraw/zinc/16/85/04/1116168504.db2.gz WAPLBZZITKNGQP-JTQLQIEISA-N 1 0 355.663 4.362 20 10 FICDRO C[C@H]([NH2+][C@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc2ccccc2c1O ZINC000312217999 1118317639 /nfs/dbraw/zinc/31/76/39/1118317639.db2.gz UXYKVRAXIMWATK-IFXJQAMLSA-N 1 0 370.493 4.499 20 10 FICDRO Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151558504 1118360820 /nfs/dbraw/zinc/36/08/20/1118360820.db2.gz NXXDMIFKBRVRMW-IBGZPJMESA-N 1 0 352.522 4.363 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(Cl)ccc43)cc2)CC1 ZINC000151589339 1118942091 /nfs/dbraw/zinc/94/20/91/1118942091.db2.gz LLUGRHOECJRWAF-JOCHJYFZSA-N 1 0 370.924 4.326 20 10 FICDRO CC(C)COc1cccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000152506393 1119432036 /nfs/dbraw/zinc/43/20/36/1119432036.db2.gz OLPYAYAVKFXGOW-LJQANCHMSA-N 1 0 368.521 4.409 20 10 FICDRO Cc1cc(CC[NH2+]C[C@H](O)c2ccccc2F)c(C)n1-c1ccccc1 ZINC000914580228 1120389318 /nfs/dbraw/zinc/38/93/18/1120389318.db2.gz CYCDBNVVUDTNEN-QFIPXVFZSA-N 1 0 352.453 4.099 20 10 FICDRO Cc1noc(C)c1CO[C@@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000762471066 1120912428 /nfs/dbraw/zinc/91/24/28/1120912428.db2.gz IIPXUWLPYSUCRJ-GOSISDBHSA-N 1 0 372.509 4.394 20 10 FICDRO Cc1noc(C)c1CO[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000762471026 1120912498 /nfs/dbraw/zinc/91/24/98/1120912498.db2.gz URJILFVGNAFRFZ-SFHVURJKSA-N 1 0 358.482 4.220 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(O)c1C ZINC000762652774 1120944222 /nfs/dbraw/zinc/94/42/22/1120944222.db2.gz YKCHNMDYCGBMEI-QILLFSRXSA-N 1 0 362.514 4.305 20 10 FICDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000916835130 1121877367 /nfs/dbraw/zinc/87/73/67/1121877367.db2.gz ASBHLPFKTYMIHW-HOCLYGCPSA-N 1 0 356.432 4.210 20 10 FICDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 ZINC000916837794 1121879637 /nfs/dbraw/zinc/87/96/37/1121879637.db2.gz ZNXQPDDJMCIMST-WFXMFSGNSA-N 1 0 372.484 4.446 20 10 FICDRO COc1ccc([C@H]2C[C@@H]([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168610173 1121974408 /nfs/dbraw/zinc/97/44/08/1121974408.db2.gz RHVWMRJBOZDCER-XWFZLUIHSA-N 1 0 354.494 4.332 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)cc1 ZINC000186367531 1122063751 /nfs/dbraw/zinc/06/37/51/1122063751.db2.gz PNLBEYUPRDOFOV-UHFFFAOYSA-N 1 0 354.494 4.468 20 10 FICDRO CN(C)c1ccc(C[N@H+](CCC(=O)Nc2ccccc2Cl)C2CC2)cc1 ZINC000917075508 1122071344 /nfs/dbraw/zinc/07/13/44/1122071344.db2.gz YAFJMAUBEDAGDC-UHFFFAOYSA-N 1 0 371.912 4.399 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000917088057 1122098471 /nfs/dbraw/zinc/09/84/71/1122098471.db2.gz NDNKKFDOMRSOKC-UHFFFAOYSA-N 1 0 364.411 4.426 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccccc2N2CCO[C@H](C)C2)cc1 ZINC000917434981 1122313713 /nfs/dbraw/zinc/31/37/13/1122313713.db2.gz FSYQIHRDSXBCMW-LJQANCHMSA-N 1 0 367.537 4.048 20 10 FICDRO C[C@H]([NH2+][C@H]1CCc2c1cc(F)cc2F)c1ccc(N2CCOCC2)cc1 ZINC000154637188 1122544095 /nfs/dbraw/zinc/54/40/95/1122544095.db2.gz DQMSYIUBIWQOPL-QKKBWIMNSA-N 1 0 358.432 4.140 20 10 FICDRO Oc1ccccc1CN(Cc1ccco1)Cc1ccc(N2CCCC2)nc1 ZINC000154714097 1122629725 /nfs/dbraw/zinc/62/97/25/1122629725.db2.gz XXJAQGAXUJWRQC-UHFFFAOYSA-N 1 0 363.461 4.183 20 10 FICDRO O=C(Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccc(Cl)cc1 ZINC000919895340 1123244835 /nfs/dbraw/zinc/24/48/35/1123244835.db2.gz DDGONDYQLBOAFR-UHFFFAOYSA-N 1 0 369.896 4.124 20 10 FICDRO CC[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@@H]1CCCO1 ZINC000919946286 1123277455 /nfs/dbraw/zinc/27/74/55/1123277455.db2.gz ZPJZALRFSZZDSW-HNNXBMFYSA-N 1 0 364.283 4.309 20 10 FICDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1c(O)ccc2ccncc21 ZINC000919949996 1123278552 /nfs/dbraw/zinc/27/85/52/1123278552.db2.gz APEVIXLFLCNCLO-UHFFFAOYSA-N 1 0 351.406 4.259 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)n1-c1cccc(Cl)c1 ZINC000919981875 1123298720 /nfs/dbraw/zinc/29/87/20/1123298720.db2.gz AWDHVLSWCOANPN-UXHICEINSA-N 1 0 371.912 4.104 20 10 FICDRO C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CCc2ccccc2C1 ZINC000921197666 1123578384 /nfs/dbraw/zinc/57/83/84/1123578384.db2.gz UECCPWNKRMFQFR-HXUWFJFHSA-N 1 0 363.549 4.213 20 10 FICDRO Oc1ccccc1C[N@@H+]1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000179568138 1124007665 /nfs/dbraw/zinc/00/76/65/1124007665.db2.gz WFFUPCLYKCNKSP-INIZCTEOSA-N 1 0 369.852 4.475 20 10 FICDRO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000179737088 1124046968 /nfs/dbraw/zinc/04/69/68/1124046968.db2.gz RSLZAJXFHVTHMZ-LJQANCHMSA-N 1 0 373.541 4.024 20 10 FICDRO Cc1cccc(C[NH2+]Cc2cccc(NC(=O)c3cccc(F)c3)c2)c1O ZINC000180095018 1124221742 /nfs/dbraw/zinc/22/17/42/1124221742.db2.gz RXHXGZHUBMUVMD-UHFFFAOYSA-N 1 0 364.420 4.382 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000068411966 1124231353 /nfs/dbraw/zinc/23/13/53/1124231353.db2.gz HUQFUTJBCWVOKP-UHFFFAOYSA-N 1 0 374.410 4.247 20 10 FICDRO COC1CCN(C(C)(C)C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765859868 1124291884 /nfs/dbraw/zinc/29/18/84/1124291884.db2.gz LYYJSGQXZPPYPB-LJQANCHMSA-N 1 0 373.585 4.217 20 10 FICDRO COc1cccc(C[NH2+]Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)c1O ZINC000733900805 1125006960 /nfs/dbraw/zinc/00/69/60/1125006960.db2.gz JZJDSLKIZUFAKY-UHFFFAOYSA-N 1 0 371.868 4.147 20 10 FICDRO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110535 1125283897 /nfs/dbraw/zinc/28/38/97/1125283897.db2.gz ILDYRGSAXBWXHC-MRXNPFEDSA-N 1 0 362.514 4.131 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCC(=O)Nc2c(C)cc(C)cc2C)c1 ZINC000182357063 1125424295 /nfs/dbraw/zinc/42/42/95/1125424295.db2.gz DTZXENYILANKRL-KRWDZBQOSA-N 1 0 370.493 4.396 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(SC(=O)N(C)C)cc2)c1 ZINC000182348602 1125426036 /nfs/dbraw/zinc/42/60/36/1125426036.db2.gz PTHUIBHPOLYWIE-CYBMUJFWSA-N 1 0 360.479 4.025 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)c1O ZINC000182520833 1125547357 /nfs/dbraw/zinc/54/73/57/1125547357.db2.gz WTVQOISPVGIROL-JTQLQIEISA-N 1 0 371.330 4.483 20 10 FICDRO Cc1ncsc1C[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000183044000 1125726029 /nfs/dbraw/zinc/72/60/29/1125726029.db2.gz PCYHWCOBUCOPME-UHFFFAOYSA-N 1 0 354.475 4.368 20 10 FICDRO C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccc(N(C)C)cc1 ZINC000183078018 1125737515 /nfs/dbraw/zinc/73/75/15/1125737515.db2.gz GKTZBGANLRNVRW-SFHVURJKSA-N 1 0 367.537 4.130 20 10 FICDRO C[C@@](O)(C[NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1cccs1 ZINC000183157682 1125762311 /nfs/dbraw/zinc/76/23/11/1125762311.db2.gz GHLSGBBYRGSIJU-OAQYLSRUSA-N 1 0 369.486 4.030 20 10 FICDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000164943613 1080256536 /nfs/dbraw/zinc/25/65/36/1080256536.db2.gz WNAVOIUBKYDUAJ-SFHVURJKSA-N 1 0 351.494 4.356 20 10 FICDRO COc1ccc(N2CCC[N@H+](C[C@@H]3CC[C@@H](c4ccccc4)O3)CC2)cc1 ZINC001167107679 1080552592 /nfs/dbraw/zinc/55/25/92/1080552592.db2.gz GIJKPJSBNSJBSQ-GOTSBHOMSA-N 1 0 366.505 4.128 20 10 FICDRO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000246960017 1080650369 /nfs/dbraw/zinc/65/03/69/1080650369.db2.gz HVAIEANQOQZMON-JJEOQYAHSA-N 1 0 350.506 4.376 20 10 FICDRO C[C@@H]1C[C@@H]1C[N@@H+]1CCc2c(Cl)c(O)c(O)cc2[C@H](c2ccc(O)cc2)C1 ZINC001209433026 1080681874 /nfs/dbraw/zinc/68/18/74/1080681874.db2.gz SNHQFYQFCDYPFA-DFHBCGBQSA-N 1 0 373.880 4.103 20 10 FICDRO CC[C@@H]([NH2+]Cc1cc2c(c(Br)c1)OCO2)c1ccccc1O ZINC000121097629 1081429714 /nfs/dbraw/zinc/42/97/14/1081429714.db2.gz IKJRUSQYLKSIHS-CQSZACIVSA-N 1 0 364.239 4.124 20 10 FICDRO COc1cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc(C(C)C)c1 ZINC001167437161 1082198816 /nfs/dbraw/zinc/19/88/16/1082198816.db2.gz NNXSQECEAUGHKL-UHFFFAOYSA-N 1 0 353.510 4.183 20 10 FICDRO CCCCNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000177877016 1082266585 /nfs/dbraw/zinc/26/65/85/1082266585.db2.gz AEIFQWFKPLBTNN-QGZVFWFLSA-N 1 0 353.510 4.133 20 10 FICDRO COc1ccccc1N1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000178229688 1082997465 /nfs/dbraw/zinc/99/74/65/1082997465.db2.gz ZSGRRFJFVUSXKC-KRWDZBQOSA-N 1 0 353.510 4.081 20 10 FICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1[N+](=O)[O-] ZINC000179399379 1083447186 /nfs/dbraw/zinc/44/71/86/1083447186.db2.gz GTHYZGATVAXWKZ-INIZCTEOSA-N 1 0 369.465 4.445 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH2+]C(C)C)C2)c(C)n1-c1ccccc1C ZINC000728605787 1083543618 /nfs/dbraw/zinc/54/36/18/1083543618.db2.gz IOUBFAIRMUDREN-IBGZPJMESA-N 1 0 353.510 4.005 20 10 FICDRO CC[C@@H]([NH2+][C@@H](Cc1nc(C)no1)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000277028515 1083723511 /nfs/dbraw/zinc/72/35/11/1083723511.db2.gz FAUVPNDKWLTRBR-RTWAWAEBSA-N 1 0 364.493 4.469 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S ZINC000255881982 1084344408 /nfs/dbraw/zinc/34/44/08/1084344408.db2.gz JHFJILQJXHNNHS-NTEUORMPSA-N 1 0 368.955 4.129 20 10 FICDRO Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[NH2+]Cc1ccccc1O ZINC000725851382 1084775211 /nfs/dbraw/zinc/77/52/11/1084775211.db2.gz OBFBXLXPZJTDHP-UHFFFAOYSA-N 1 0 362.260 4.483 20 10 FICDRO COc1ccc(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)cc1O ZINC000725851448 1084784463 /nfs/dbraw/zinc/78/44/63/1084784463.db2.gz PXTGOGXBHJSXPM-UHFFFAOYSA-N 1 0 350.462 4.407 20 10 FICDRO C[C@H](c1ccccc1)[N@H+](CC(=O)NC1CCCC1)Cc1ccccc1O ZINC000176674327 1085055191 /nfs/dbraw/zinc/05/51/91/1085055191.db2.gz VJIOELQKHUAUTC-QGZVFWFLSA-N 1 0 352.478 4.014 20 10 FICDRO CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC001648916774 1085313532 /nfs/dbraw/zinc/31/35/32/1085313532.db2.gz KGPSWNZGVRPVDE-MJGOQNOKSA-N 1 0 362.533 4.481 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2Cc2nc(CCC3CC3)no2)C1 ZINC000582691428 1085392541 /nfs/dbraw/zinc/39/25/41/1085392541.db2.gz DOOODJSIJNSXHN-UHFFFAOYSA-N 1 0 364.493 4.182 20 10 FICDRO C[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000178643568 1085602008 /nfs/dbraw/zinc/60/20/08/1085602008.db2.gz YONSXOGLESLNBT-SIKLNZKXSA-N 1 0 352.522 4.494 20 10 FICDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(OC(F)(F)F)cc2)c1 ZINC000188050257 1085674428 /nfs/dbraw/zinc/67/44/28/1085674428.db2.gz XYEGAKVYRRGFLY-UHFFFAOYSA-N 1 0 355.356 4.324 20 10 FICDRO COc1ccccc1[C@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178444243 1085782738 /nfs/dbraw/zinc/78/27/38/1085782738.db2.gz IEYIVQBPCKCQHH-IIBYNOLFSA-N 1 0 372.484 4.209 20 10 FICDRO C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCC2)c(F)c1 ZINC000166572866 1085979172 /nfs/dbraw/zinc/97/91/72/1085979172.db2.gz MYOLOSTVDRBPFU-RXYZOABWSA-N 1 0 354.469 4.125 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2Cc2nc(-c3ccoc3)no2)C1 ZINC000685365439 1087546764 /nfs/dbraw/zinc/54/67/64/1087546764.db2.gz AZSMOCFUJZWWER-UHFFFAOYSA-N 1 0 362.433 4.099 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CC(=O)Nc2cccnc2Cl)cc1 ZINC000178227901 1088365928 /nfs/dbraw/zinc/36/59/28/1088365928.db2.gz ASCPKKRDOGYIBF-OAHLLOKOSA-N 1 0 374.916 4.088 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000311291692 1088529544 /nfs/dbraw/zinc/52/95/44/1088529544.db2.gz BERPIEJJBZXHNH-KKSFZXQISA-N 1 0 362.514 4.388 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)[C@H](C)C2(C)CC2)C1 ZINC000435806271 1089954501 /nfs/dbraw/zinc/95/45/01/1089954501.db2.gz CKYBIODRRJKYMP-QGZVFWFLSA-N 1 0 367.537 4.055 20 10 FICDRO C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(Br)cc1[O-] ZINC000756363458 1090127477 /nfs/dbraw/zinc/12/74/77/1090127477.db2.gz OGGASJAXGGZZRA-ZIAGYGMSSA-N 1 0 355.320 4.070 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1C ZINC000180276350 1090182713 /nfs/dbraw/zinc/18/27/13/1090182713.db2.gz ZQYKUQLXXQHVDW-UHFFFAOYSA-N 1 0 353.388 4.061 20 10 FICDRO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000756421374 1090392744 /nfs/dbraw/zinc/39/27/44/1090392744.db2.gz LHTAFRKMBWSZEI-LBPRGKRZSA-N 1 0 365.271 4.188 20 10 FICDRO OC1(c2ccccc2)CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000185637811 1090560372 /nfs/dbraw/zinc/56/03/72/1090560372.db2.gz QJWJTEBMVFTDKE-UHFFFAOYSA-N 1 0 350.506 4.161 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCc2nc(-c3ccc(F)cc3)no2)c1 ZINC000186533529 1090659398 /nfs/dbraw/zinc/65/93/98/1090659398.db2.gz ULMQVDVGUHQJEW-CQSZACIVSA-N 1 0 355.413 4.173 20 10 FICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000193995888 1091340614 /nfs/dbraw/zinc/34/06/14/1091340614.db2.gz LMXQIMWXDVPOTO-KKSFZXQISA-N 1 0 374.912 4.215 20 10 FICDRO C[C@@H]([NH2+]CCOCc1ccccc1)c1ccc(Br)cc1O ZINC000756638082 1091672841 /nfs/dbraw/zinc/67/28/41/1091672841.db2.gz RKHAOQUERJBVPF-CYBMUJFWSA-N 1 0 350.256 4.022 20 10 FICDRO CCOc1cccc(C[NH2+]CCCO[C@@H]2CCCc3ccccc32)c1O ZINC000236896431 1092770932 /nfs/dbraw/zinc/77/09/32/1092770932.db2.gz CLTUFIARMCRJHU-HXUWFJFHSA-N 1 0 355.478 4.365 20 10 FICDRO COc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)c(O)c1OC ZINC000895559000 1093601406 /nfs/dbraw/zinc/60/14/06/1093601406.db2.gz MPFYSNCSVFZBDF-UHFFFAOYSA-N 1 0 358.463 4.044 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(-n2nc(C)cc2C)nc1)c1ccc(C)cc1O ZINC000279966086 1093803554 /nfs/dbraw/zinc/80/35/54/1093803554.db2.gz CPNCMPHEZJGFED-LJQANCHMSA-N 1 0 350.466 4.139 20 10 FICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccc2c(c1)OCO2 ZINC001648950950 1093914394 /nfs/dbraw/zinc/91/43/94/1093914394.db2.gz KJOXNVYSDQDFKI-UHFFFAOYSA-N 1 0 366.505 4.473 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCN(c2ncccc2F)C1)c1ccc(N2CCCCC2)cc1 ZINC000168112652 1094797276 /nfs/dbraw/zinc/79/72/76/1094797276.db2.gz KUDRTQFYJXUAFR-MJGOQNOKSA-N 1 0 368.500 4.141 20 10 FICDRO C[C@@H]([NH2+]C1CCN(c2nccs2)CC1)c1ccc2ccccc2c1O ZINC000281118567 1095484608 /nfs/dbraw/zinc/48/46/08/1095484608.db2.gz ALCGKIVKCWBJCL-CQSZACIVSA-N 1 0 353.491 4.322 20 10 FICDRO CSCC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1nnc2ccccn21 ZINC000273367357 1096256677 /nfs/dbraw/zinc/25/66/77/1096256677.db2.gz FKCHFHAXOLZEHL-NVXWUHKLSA-N 1 0 370.522 4.197 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273517907 1096269272 /nfs/dbraw/zinc/26/92/72/1096269272.db2.gz SXBIEZUKXYSVTC-CRAIPNDOSA-N 1 0 361.551 4.366 20 10 FICDRO COc1ccc(C[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 ZINC000237325446 1101713345 /nfs/dbraw/zinc/71/33/45/1101713345.db2.gz MQLHMCSSIRJHPO-MRXNPFEDSA-N 1 0 362.420 4.055 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000185675758 1101743150 /nfs/dbraw/zinc/74/31/50/1101743150.db2.gz DLHOSCVDAIMRPQ-LSDHHAIUSA-N 1 0 351.450 4.307 20 10 FICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000729850998 1102748451 /nfs/dbraw/zinc/74/84/51/1102748451.db2.gz DVUDQKZQENFRGB-HXUWFJFHSA-N 1 0 355.478 4.359 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC001167982234 1102786182 /nfs/dbraw/zinc/78/61/82/1102786182.db2.gz ALSSIUKBCVAUQW-WMZOPIPTSA-N 1 0 369.383 4.487 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1ccccc1O ZINC000760040633 1104996701 /nfs/dbraw/zinc/99/67/01/1104996701.db2.gz UESBLLQDOHKSHB-NNWRFLSQSA-N 1 0 357.469 4.346 20 10 FICDRO Cc1cc(C(=O)N(C)C2CCC([NH3+])CC2)c(C)n1-c1cc(C)cc(C)c1 ZINC000237238528 1105234881 /nfs/dbraw/zinc/23/48/81/1105234881.db2.gz DOYKFBQKFHTDDN-UHFFFAOYSA-N 1 0 353.510 4.053 20 10 FICDRO COc1cccc(C[NH2+][C@H](C)c2cc(F)c(Br)cc2F)c1O ZINC000527753760 1109822058 /nfs/dbraw/zinc/82/20/58/1109822058.db2.gz SSSXTORMRYWZQN-SECBINFHSA-N 1 0 372.209 4.292 20 10 FICDRO Oc1cccc2c1[C@H]([NH2+]Cc1cc(F)c(Br)cc1F)CC2 ZINC000527977205 1109873243 /nfs/dbraw/zinc/87/32/43/1109873243.db2.gz CPYFHIRXURPSRL-CQSZACIVSA-N 1 0 354.194 4.210 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000479449320 1112036871 /nfs/dbraw/zinc/03/68/71/1112036871.db2.gz DUGIRTGDIQTFNT-NRFANRHFSA-N 1 0 373.504 4.308 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000163612196 1114095446 /nfs/dbraw/zinc/09/54/46/1114095446.db2.gz CZXWCMLMGCWSIZ-FQEVSTJZSA-N 1 0 371.506 4.389 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC[C@H]1CCOC1)c1ccccc1O ZINC000156309730 1114382894 /nfs/dbraw/zinc/38/28/94/1114382894.db2.gz DIQYFMXRPJUTPI-FXAWDEMLSA-N 1 0 355.478 4.357 20 10 FICDRO Cc1nccn1CCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000164598648 1114523898 /nfs/dbraw/zinc/52/38/98/1114523898.db2.gz VXQTUZMXLLOENT-QGZVFWFLSA-N 1 0 358.505 4.452 20 10 FICDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000760714040 1114669526 /nfs/dbraw/zinc/66/95/26/1114669526.db2.gz RVZXRSDKZUQHKP-QGZVFWFLSA-N 1 0 370.456 4.491 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)[C@]12CCCO2 ZINC000760881426 1115120386 /nfs/dbraw/zinc/12/03/86/1115120386.db2.gz ORCVRSRAQMBHQQ-XYEHWOGUSA-N 1 0 358.526 4.054 20 10 FICDRO C[C@H]1C[C@H]([NH2+]C2CCC(O)(c3ccccc3)CC2)c2c1c(F)ccc2O ZINC000760909853 1115171124 /nfs/dbraw/zinc/17/11/24/1115171124.db2.gz WZXOWUWUTXFJQR-TWGDKQRHSA-N 1 0 355.453 4.500 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](OC)c2ccccc2F)c1O ZINC000761214225 1115645699 /nfs/dbraw/zinc/64/56/99/1115645699.db2.gz AGMZNXHBKRSIDU-ADLMAVQZSA-N 1 0 353.821 4.059 20 10 FICDRO CN(Cc1ccccc1O)C(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1 ZINC000171258392 1115859598 /nfs/dbraw/zinc/85/95/98/1115859598.db2.gz WTWBBFVGDJFSAV-UHFFFAOYSA-N 1 0 374.484 4.296 20 10 FICDRO CC[C@@H]([NH2+]CCc1nc(C)cs1)c1cc(Br)ccc1O ZINC000063132527 1116011551 /nfs/dbraw/zinc/01/15/51/1116011551.db2.gz AZRAGFNICVKSOR-CYBMUJFWSA-N 1 0 355.301 4.203 20 10 FICDRO FC(F)Oc1ccc(N2CCC[C@H]([NH2+]Cc3cccnc3Cl)C2)cc1 ZINC000174621277 1116181637 /nfs/dbraw/zinc/18/16/37/1116181637.db2.gz ZTTNGUQILMWQFN-AWEZNQCLSA-N 1 0 367.827 4.095 20 10 FICDRO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151510701 1116253786 /nfs/dbraw/zinc/25/37/86/1116253786.db2.gz LNTKSNPRZMYLBA-QGZVFWFLSA-N 1 0 356.485 4.254 20 10 FICDRO Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151510773 1116255145 /nfs/dbraw/zinc/25/51/45/1116255145.db2.gz LNTKSNPRZMYLBA-KRWDZBQOSA-N 1 0 356.485 4.254 20 10 FICDRO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151524921 1116335362 /nfs/dbraw/zinc/33/53/62/1116335362.db2.gz GFPPHFSHUIJBLK-QGZVFWFLSA-N 1 0 356.485 4.254 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(OC)cc1 ZINC000151531201 1116354311 /nfs/dbraw/zinc/35/43/11/1116354311.db2.gz CQKTYIPGTISIDF-NRFANRHFSA-N 1 0 372.484 4.036 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(OC)cc1 ZINC000151531255 1116354333 /nfs/dbraw/zinc/35/43/33/1116354333.db2.gz CQKTYIPGTISIDF-OAQYLSRUSA-N 1 0 372.484 4.036 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(s1)CCC2 ZINC000151534914 1116359050 /nfs/dbraw/zinc/35/90/50/1116359050.db2.gz HHZSSGKZWUIPLA-AWEZNQCLSA-N 1 0 374.525 4.188 20 10 FICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000151545419 1117945592 /nfs/dbraw/zinc/94/55/92/1117945592.db2.gz QCBOZSAOVUMLOQ-MRXNPFEDSA-N 1 0 372.484 4.036 20 10 FICDRO COc1ccc(C[NH2+]C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1C ZINC000312203207 1118290600 /nfs/dbraw/zinc/29/06/00/1118290600.db2.gz GMBFBAYOHUBFPO-IBGZPJMESA-N 1 0 370.493 4.359 20 10 FICDRO CCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)s1 ZINC000151559717 1118498890 /nfs/dbraw/zinc/49/88/90/1118498890.db2.gz YXUJJOQCYAKECC-OAHLLOKOSA-N 1 0 373.566 4.073 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)CCC2 ZINC000151568166 1118584308 /nfs/dbraw/zinc/58/43/08/1118584308.db2.gz CNVRFOJUCONOHM-GOSISDBHSA-N 1 0 364.533 4.235 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(Cl)ccc43)cc2)CC1 ZINC000151589411 1118941857 /nfs/dbraw/zinc/94/18/57/1118941857.db2.gz LLUGRHOECJRWAF-QFIPXVFZSA-N 1 0 370.924 4.326 20 10 FICDRO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000153037366 1119834706 /nfs/dbraw/zinc/83/47/06/1119834706.db2.gz QIUJLTOBKRRTGU-OXJNMPFZSA-N 1 0 354.469 4.309 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N2CCOCC2)cc1Cl ZINC000130314049 1120305614 /nfs/dbraw/zinc/30/56/14/1120305614.db2.gz SGBGPQKWUQBNET-JLTOFOAXSA-N 1 0 372.896 4.220 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ccc(N(C)C)nc2)cc1 ZINC000915228151 1120884182 /nfs/dbraw/zinc/88/41/82/1120884182.db2.gz DZZHIZVFQMVNCS-UHFFFAOYSA-N 1 0 374.532 4.464 20 10 FICDRO CC(C)(C)OC(=O)N1CC(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000762602188 1120938173 /nfs/dbraw/zinc/93/81/73/1120938173.db2.gz LZMYWLIEROVUAK-UHFFFAOYSA-N 1 0 368.477 4.016 20 10 FICDRO CN1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000762622929 1120940667 /nfs/dbraw/zinc/94/06/67/1120940667.db2.gz GHDWODHQXJNUFO-DYESRHJHSA-N 1 0 374.887 4.197 20 10 FICDRO OC1(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CCCCC1 ZINC001649042566 1121097386 /nfs/dbraw/zinc/09/73/86/1121097386.db2.gz HOUMFYJVGGCWAO-UHFFFAOYSA-N 1 0 350.506 4.034 20 10 FICDRO CC(C)c1ccc(C[C@H]2CC[N@H+](Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 ZINC000763392409 1121575592 /nfs/dbraw/zinc/57/55/92/1121575592.db2.gz HLDKWDUXMLCIEJ-VGSWGCGISA-N 1 0 367.489 4.006 20 10 FICDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)o1 ZINC000916837793 1121879813 /nfs/dbraw/zinc/87/98/13/1121879813.db2.gz ZNXQPDDJMCIMST-OAFZBRQQSA-N 1 0 372.484 4.446 20 10 FICDRO COc1ccc(C[NH2+]C[C@@H](c2ccccc2OC)N2CCCCC2)cc1C ZINC000916838562 1121880284 /nfs/dbraw/zinc/88/02/84/1121880284.db2.gz UMXSISYBGYKBAB-NRFANRHFSA-N 1 0 368.521 4.329 20 10 FICDRO CCOc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1O ZINC000154722901 1122642099 /nfs/dbraw/zinc/64/20/99/1122642099.db2.gz RMFFKXPDLNPFIB-UHFFFAOYSA-N 1 0 353.418 4.292 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(Br)c(F)c1 ZINC000763432242 1122777369 /nfs/dbraw/zinc/77/73/69/1122777369.db2.gz FZUQHBSFKUEZII-UHFFFAOYSA-N 1 0 351.263 4.252 20 10 FICDRO C[C@H]1C[N@H+](Cc2c(O)ccc3cc(Br)ccc32)CC(C)(C)O1 ZINC000920866216 1123532147 /nfs/dbraw/zinc/53/21/47/1123532147.db2.gz YFRREHFSGRIVLW-LBPRGKRZSA-N 1 0 364.283 4.307 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCN(c3ccc(F)c(F)c3)C2)cc1 ZINC000921070558 1123555949 /nfs/dbraw/zinc/55/59/49/1123555949.db2.gz ZJNJQVNGRICHPT-SFHVURJKSA-N 1 0 373.491 4.427 20 10 FICDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000180536710 1124356001 /nfs/dbraw/zinc/35/60/01/1124356001.db2.gz DLSAVJSPDKQKRP-UHFFFAOYSA-N 1 0 365.330 4.026 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)c1 ZINC000765912421 1124463909 /nfs/dbraw/zinc/46/39/09/1124463909.db2.gz WIYAITGEOOBTAL-WZONZLPQSA-N 1 0 368.521 4.460 20 10 FICDRO COc1ccc([C@@H]2C[C@H]([N@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671199 1124711861 /nfs/dbraw/zinc/71/18/61/1124711861.db2.gz LXHNRUMGLBSNAS-IRLDBZIGSA-N 1 0 354.494 4.113 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c1O ZINC000181891389 1125170286 /nfs/dbraw/zinc/17/02/86/1125170286.db2.gz DTAHNHRENJKAHG-CQSZACIVSA-N 1 0 356.441 4.185 20 10 FICDRO COc1ccc(CC[N@H+](C)Cc2cccc(C(C)(C)C)c2O)cc1OC ZINC001143104222 1125265513 /nfs/dbraw/zinc/26/55/13/1125265513.db2.gz QUWRDYFFIPIWQT-UHFFFAOYSA-N 1 0 357.494 4.381 20 10 FICDRO Cc1cccc(C[NH2+]C[C@H](O)c2cccc(OCc3ccccc3)c2)c1O ZINC000182618761 1125581381 /nfs/dbraw/zinc/58/13/81/1125581381.db2.gz RSSHDQJEKSWWAL-QFIPXVFZSA-N 1 0 363.457 4.103 20 10 FICDRO COc1ccc(N2CCC[N@@H+](C[C@@H](OC)c3ccc(Cl)cc3)CC2)cc1 ZINC001167107605 1080552114 /nfs/dbraw/zinc/55/21/14/1080552114.db2.gz FFOTWANEPSHKAV-OAQYLSRUSA-N 1 0 374.912 4.248 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000155307976 1080782138 /nfs/dbraw/zinc/78/21/38/1080782138.db2.gz JZUAXAYPKBWWLW-IAGOWNOFSA-N 1 0 369.465 4.152 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(N2CCOCC2)cc1 ZINC000155392621 1080886248 /nfs/dbraw/zinc/88/62/48/1080886248.db2.gz BKSYULQYMYJQHH-UZLBHIALSA-N 1 0 354.519 4.411 20 10 FICDRO CCN(C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1)CC(F)(F)F ZINC000177639541 1081362377 /nfs/dbraw/zinc/36/23/77/1081362377.db2.gz AZBQWRRLFXMCLK-HNNXBMFYSA-N 1 0 366.427 4.252 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3nc(Cl)cc4ccccc43)cc2)CC1 ZINC001167422761 1082041725 /nfs/dbraw/zinc/04/17/25/1082041725.db2.gz AMWIABKOHWNWPS-UHFFFAOYSA-N 1 0 366.896 4.252 20 10 FICDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1 ZINC000588405943 1082439850 /nfs/dbraw/zinc/43/98/50/1082439850.db2.gz JARGEPDPPCEHKM-IYCSXQJISA-N 1 0 366.461 4.124 20 10 FICDRO CN(C)c1ccc(CN(C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1 ZINC000023852668 1082664630 /nfs/dbraw/zinc/66/46/30/1082664630.db2.gz FRBFQRCWUIEOJP-UHFFFAOYSA-N 1 0 372.450 4.027 20 10 FICDRO COc1cccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CCC(O)CC2)c1 ZINC000092966613 1083429359 /nfs/dbraw/zinc/42/93/59/1083429359.db2.gz YFGBONDNHRGZSD-UHFFFAOYSA-N 1 0 368.521 4.067 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)c(O)c1OC ZINC000892478706 1083629505 /nfs/dbraw/zinc/62/95/05/1083629505.db2.gz ORYOFPROTHJOFQ-LLVKDONJSA-N 1 0 355.356 4.279 20 10 FICDRO O=C(NC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1)C1CCCCC1 ZINC000065943884 1083843745 /nfs/dbraw/zinc/84/37/45/1083843745.db2.gz UBEXLWZUMOSXCK-UHFFFAOYSA-N 1 0 366.505 4.206 20 10 FICDRO CC(=O)c1cc(Cl)cc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)c1O ZINC000177357206 1083909219 /nfs/dbraw/zinc/90/92/19/1083909219.db2.gz ZTQPUEQBQXMATG-UHFFFAOYSA-N 1 0 352.887 4.346 20 10 FICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F ZINC000162260540 1083934946 /nfs/dbraw/zinc/93/49/46/1083934946.db2.gz TXZPDNSDZLPMNL-JKSUJKDBSA-N 1 0 358.457 4.083 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccccc2OC2CCCC2)c(O)c1OC ZINC000892618793 1085072569 /nfs/dbraw/zinc/07/25/69/1085072569.db2.gz NGCSEEOGPMMADJ-UHFFFAOYSA-N 1 0 357.450 4.021 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cc(C)ccc1OC ZINC000093399360 1085777297 /nfs/dbraw/zinc/77/72/97/1085777297.db2.gz XBMSYHXQXKYQSR-HXUWFJFHSA-N 1 0 372.484 4.220 20 10 FICDRO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1cc(Br)ccc1O ZINC000313919712 1085818613 /nfs/dbraw/zinc/81/86/13/1085818613.db2.gz WEYQRVIAGMZHDF-HNNXBMFYSA-N 1 0 356.304 4.402 20 10 FICDRO c1cncc([C@H]2CCC[C@@H]([NH2+]Cc3ccc(N4CCSCC4)cc3)C2)c1 ZINC000800222686 1086534342 /nfs/dbraw/zinc/53/43/42/1086534342.db2.gz BXWITJMJUYTCRA-PZJWPPBQSA-N 1 0 367.562 4.451 20 10 FICDRO COc1cccc(C[NH2+]Cc2cc(Br)ccc2Cl)c1O ZINC000722368035 1086629006 /nfs/dbraw/zinc/62/90/06/1086629006.db2.gz BKEMIJSVCXFHFF-UHFFFAOYSA-N 1 0 356.647 4.107 20 10 FICDRO CCOc1cccc(C[NH2+]C2(c3cccc(Br)c3)CC2)c1O ZINC000077447958 1086709147 /nfs/dbraw/zinc/70/91/47/1086709147.db2.gz BQZLEUURPYPMGP-UHFFFAOYSA-N 1 0 362.267 4.332 20 10 FICDRO c1ccc(C[C@H]2CC[C@H]([NH2+]Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000780510048 1086832577 /nfs/dbraw/zinc/83/25/77/1086832577.db2.gz FLOMPOLYQVFUCX-YADHBBJMSA-N 1 0 350.506 4.024 20 10 FICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000782843471 1088236222 /nfs/dbraw/zinc/23/62/22/1088236222.db2.gz PWUCKWJUXRAGCC-INIZCTEOSA-N 1 0 352.409 4.123 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000166222132 1088545931 /nfs/dbraw/zinc/54/59/31/1088545931.db2.gz UPSXZPIKAAIWQL-OAQYLSRUSA-N 1 0 354.469 4.138 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)CC[C@@H]2C)C1 ZINC001126429927 1089140240 /nfs/dbraw/zinc/14/02/40/1089140240.db2.gz YJZBCYDYCJSOAB-MSOLQXFVSA-N 1 0 367.537 4.055 20 10 FICDRO COc1ccc2oc([C@@H](C)[NH2+]Cc3ccc(OC)c(OC)c3O)c(C)c2c1 ZINC000892909679 1089278740 /nfs/dbraw/zinc/27/87/40/1089278740.db2.gz JDYLNYVTARFILL-CYBMUJFWSA-N 1 0 371.433 4.323 20 10 FICDRO CC1CCN(c2ccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000236672909 1090238772 /nfs/dbraw/zinc/23/87/72/1090238772.db2.gz HWDQVNXDBNGVMA-JOCHJYFZSA-N 1 0 365.521 4.019 20 10 FICDRO C[C@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000182221726 1090337319 /nfs/dbraw/zinc/33/73/19/1090337319.db2.gz ZEPRHTHFFBZATD-HNNXBMFYSA-N 1 0 358.432 4.141 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)cc1 ZINC000312204506 1090428264 /nfs/dbraw/zinc/42/82/64/1090428264.db2.gz IZJAWUCLZOAVFT-SFHVURJKSA-N 1 0 373.541 4.164 20 10 FICDRO COCCOc1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185012339 1090495771 /nfs/dbraw/zinc/49/57/71/1090495771.db2.gz VTCNVDVCAZIOIW-MRXNPFEDSA-N 1 0 351.446 4.421 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2cccc(Br)c2)c1 ZINC000756483146 1090504565 /nfs/dbraw/zinc/50/45/65/1090504565.db2.gz NSYQWLYKGBETAV-OLZOCXBDSA-N 1 0 364.283 4.445 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1cc(F)ccc1O ZINC000185253907 1090526942 /nfs/dbraw/zinc/52/69/42/1090526942.db2.gz LJOOFYJAONSIHA-CQSZACIVSA-N 1 0 365.408 4.029 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCCNc4ccccc43)CC2)cc1 ZINC000192805041 1091202450 /nfs/dbraw/zinc/20/24/50/1091202450.db2.gz VHDHAZXXGAMVIZ-JOCHJYFZSA-N 1 0 351.494 4.201 20 10 FICDRO C[C@@H](CC[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 ZINC000194265098 1091366909 /nfs/dbraw/zinc/36/69/09/1091366909.db2.gz FHZIGGCWPKWGBC-KRWDZBQOSA-N 1 0 356.485 4.070 20 10 FICDRO COc1ccccc1C[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237184731 1092466309 /nfs/dbraw/zinc/46/63/09/1092466309.db2.gz ALYPZFKFZLOPQP-MRXNPFEDSA-N 1 0 362.420 4.055 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCCc2cnn(C)c2)cc1 ZINC000236965219 1093153759 /nfs/dbraw/zinc/15/37/59/1093153759.db2.gz LUWAEKMFHDXQKZ-UHFFFAOYSA-N 1 0 362.521 4.169 20 10 FICDRO CCOCc1cc(C[NH2+]Cc2ccccc2Br)ccc1OC ZINC001648959974 1093301397 /nfs/dbraw/zinc/30/13/97/1093301397.db2.gz HTFBXQQQWHZUCZ-UHFFFAOYSA-N 1 0 364.283 4.284 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(-n2nc(C)cc2C)nc1)c1ccc(C)cc1O ZINC000279966081 1093803501 /nfs/dbraw/zinc/80/35/01/1093803501.db2.gz CPNCMPHEZJGFED-IBGZPJMESA-N 1 0 350.466 4.139 20 10 FICDRO COC(C)(C)C[N@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC000758413036 1093919122 /nfs/dbraw/zinc/91/91/22/1093919122.db2.gz XMMUCFLDBOVQLM-UHFFFAOYSA-N 1 0 352.272 4.165 20 10 FICDRO CCN1CC[C@H]([NH2+][C@H](C)c2ccccc2O)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000783533701 1094420420 /nfs/dbraw/zinc/42/04/20/1094420420.db2.gz VJYTVWJGDUJJEN-ZINOCKGTSA-N 1 0 364.411 4.296 20 10 FICDRO C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)CC(C)(C)C1)c1ccccc1O ZINC000710385594 1094772149 /nfs/dbraw/zinc/77/21/49/1094772149.db2.gz SWTTZYKWLWNBFI-HOTGVXAUSA-N 1 0 362.514 4.469 20 10 FICDRO COc1cc(Br)cc([C@@H](C)[NH2+]C[C@H](C)CC(F)F)c1O ZINC000848555133 1095869654 /nfs/dbraw/zinc/86/96/54/1095869654.db2.gz LWAHHJXDABHCFX-RKDXNWHRSA-N 1 0 352.219 4.105 20 10 FICDRO CC[C@H]([NH2+]C[C@@H]1CSCCN1Cc1ccccc1)c1ccccc1O ZINC000760017660 1096136489 /nfs/dbraw/zinc/13/64/89/1096136489.db2.gz NNKXZDHTSGUJBN-QUCCMNQESA-N 1 0 356.535 4.051 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1C ZINC000273049838 1096232028 /nfs/dbraw/zinc/23/20/28/1096232028.db2.gz JLZILLMEMJMDHH-SFHVURJKSA-N 1 0 368.521 4.063 20 10 FICDRO CCOCc1cc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1OC ZINC000273361605 1096255416 /nfs/dbraw/zinc/25/54/16/1096255416.db2.gz CRWRFBXQUKMIQX-IRLDBZIGSA-N 1 0 373.468 4.381 20 10 FICDRO Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)c3ccc(C)c(C)c3O)cn2)n1 ZINC000273414774 1096260935 /nfs/dbraw/zinc/26/09/35/1096260935.db2.gz QNOOAYDDAYMCPU-QGZVFWFLSA-N 1 0 350.466 4.057 20 10 FICDRO COCC[C@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)c1ccco1 ZINC000273495176 1096267944 /nfs/dbraw/zinc/26/79/44/1096267944.db2.gz XRTWRAIXLPVYMQ-FZMZJTMJSA-N 1 0 354.244 4.176 20 10 FICDRO C[C@H]([NH2+]Cc1cccc(C(=O)NC2CC2)c1)c1ccc2ccccc2c1O ZINC000273607359 1096277658 /nfs/dbraw/zinc/27/76/58/1096277658.db2.gz UPORSEIGLJNFJD-HNNXBMFYSA-N 1 0 360.457 4.288 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1nnc2n1CCCCC2 ZINC000273613414 1096279075 /nfs/dbraw/zinc/27/90/75/1096279075.db2.gz WTMHLEGGZIEHMA-DNVCBOLYSA-N 1 0 368.525 4.391 20 10 FICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1nc(C(F)(F)F)cs1 ZINC000894311553 1098692106 /nfs/dbraw/zinc/69/21/06/1098692106.db2.gz VZMDCQBRBWPMLV-LLVKDONJSA-N 1 0 360.401 4.425 20 10 FICDRO COc1ccc(C[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 ZINC000237369157 1099444946 /nfs/dbraw/zinc/44/49/46/1099444946.db2.gz MQLHMCSSIRJHPO-INIZCTEOSA-N 1 0 362.420 4.055 20 10 FICDRO COc1ccc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)cc1OC ZINC000017310677 1101034578 /nfs/dbraw/zinc/03/45/78/1101034578.db2.gz POBNJGMHCAKZGQ-UHFFFAOYSA-N 1 0 350.462 4.401 20 10 FICDRO Cc1ccc([C@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)N2CCCC2)cc1 ZINC001648986051 1102584816 /nfs/dbraw/zinc/58/48/16/1102584816.db2.gz MVECWLWTXNJVDZ-QFIPXVFZSA-N 1 0 355.501 4.127 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC001167982231 1102787186 /nfs/dbraw/zinc/78/71/86/1102787186.db2.gz ALSSIUKBCVAUQW-FUHWJXTLSA-N 1 0 369.383 4.487 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1 ZINC000760040436 1105016841 /nfs/dbraw/zinc/01/68/41/1105016841.db2.gz KCOLBTDCYDEOMZ-USCONSEESA-N 1 0 356.485 4.099 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](CC(C)C)CC2)c(C)n1-c1ccccc1C 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C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1F ZINC000151567593 1118566661 /nfs/dbraw/zinc/56/66/61/1118566661.db2.gz IALANHGCHCXNEX-HNNXBMFYSA-N 1 0 360.448 4.024 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cc(F)ccc1F ZINC000151568971 1118780623 /nfs/dbraw/zinc/78/06/23/1118780623.db2.gz VTJZZHKOLQZQQJ-QFIPXVFZSA-N 1 0 374.475 4.414 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(s1)CCC2 ZINC000151578231 1118862932 /nfs/dbraw/zinc/86/29/32/1118862932.db2.gz FIRSHYVUUDLJEA-MRXNPFEDSA-N 1 0 370.562 4.296 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Cl)cc1 ZINC000151587857 1118939690 /nfs/dbraw/zinc/93/96/90/1118939690.db2.gz YRUBXDSIUIBVEL-MRXNPFEDSA-N 1 0 358.913 4.400 20 10 FICDRO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000153037162 1119834697 /nfs/dbraw/zinc/83/46/97/1119834697.db2.gz QIUJLTOBKRRTGU-JXFKEZNVSA-N 1 0 354.469 4.309 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F ZINC000153228096 1120370687 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4.384 20 10 FICDRO CCOc1ccc(O)c(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154717547 1122631388 /nfs/dbraw/zinc/63/13/88/1122631388.db2.gz GAVVYGFAZSYVTB-UHFFFAOYSA-N 1 0 353.418 4.292 20 10 FICDRO Cc1cc(C(=O)N2CCC(CC[NH+](C)C)CC2)c(C)n1-c1cccc(C)c1 ZINC000918705513 1122754882 /nfs/dbraw/zinc/75/48/82/1122754882.db2.gz CYQRDMUYZKIIRD-UHFFFAOYSA-N 1 0 367.537 4.206 20 10 FICDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000921070404 1123555057 /nfs/dbraw/zinc/55/50/57/1123555057.db2.gz WPRRQZURHQUKHJ-IBGZPJMESA-N 1 0 352.522 4.369 20 10 FICDRO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057222 1123558443 /nfs/dbraw/zinc/55/84/43/1123558443.db2.gz VDSYYXQKPMXYAJ-AEFFLSMTSA-N 1 0 354.494 4.062 20 10 FICDRO C[C@H](c1ccccc1)[N@H+](Cc1cn2cccnc2n1)Cc1ccccc1O ZINC000179645541 1124020470 /nfs/dbraw/zinc/02/04/70/1124020470.db2.gz NHTUGKZQACUMKS-QGZVFWFLSA-N 1 0 358.445 4.198 20 10 FICDRO COc1ccc(O)c(C[N@H+](CCc2ccccn2)Cc2ccc(F)cc2)c1 ZINC000180025398 1124191205 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COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OCc3ccccn3)cc2)c1 ZINC000182391315 1125445007 /nfs/dbraw/zinc/44/50/07/1125445007.db2.gz JFGJZTPTCARXTB-INIZCTEOSA-N 1 0 364.445 4.226 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(-c3ccccc3OC)n2)c1 ZINC000182410565 1125473661 /nfs/dbraw/zinc/47/36/61/1125473661.db2.gz SXWGDCUDOBOJOH-CYBMUJFWSA-N 1 0 370.474 4.384 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OCC(F)(F)F)c1 ZINC000182449673 1125500970 /nfs/dbraw/zinc/50/09/70/1125500970.db2.gz SXDBPSYAGXTRAO-GFCCVEGCSA-N 1 0 355.356 4.193 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)ccc2Br)cc1 ZINC000090249612 1079599238 /nfs/dbraw/zinc/59/92/38/1079599238.db2.gz OWLAVFZVDKWDPF-UHFFFAOYSA-N 1 0 353.691 4.458 20 10 FICDRO CC[N@H+](Cc1nc2ccccc2o1)Cc1cc(Br)ccc1O ZINC000076118460 1125784479 /nfs/dbraw/zinc/78/44/79/1125784479.db2.gz PEWDTUKFIMBCEE-UHFFFAOYSA-N 1 0 361.239 4.318 20 10 FICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc(COCC(F)(F)F)c1 ZINC000120877982 1080894081 /nfs/dbraw/zinc/89/40/81/1080894081.db2.gz USDHSNUCFGRFLN-UHFFFAOYSA-N 1 0 359.775 4.414 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)cc1OC ZINC000160309692 1081239317 /nfs/dbraw/zinc/23/93/17/1081239317.db2.gz JCFUMFDKAKVOMA-OAHLLOKOSA-N 1 0 359.491 4.024 20 10 FICDRO C[C@@]1(c2ccccc2)CCC[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167367693 1081751545 /nfs/dbraw/zinc/75/15/45/1081751545.db2.gz QIERCULOXYFWET-HSZRJFAPSA-N 1 0 350.506 4.077 20 10 FICDRO COc1cccc2c1OC[C@H]([NH2+]Cc1cc(-c3ccccc3)ccc1O)C2 ZINC000728300730 1082013505 /nfs/dbraw/zinc/01/35/05/1082013505.db2.gz YNUJNRZUPFSGOO-HXUWFJFHSA-N 1 0 361.441 4.161 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ncc(Cl)cc3C(F)F)cc2)CC1 ZINC001167423098 1082042836 /nfs/dbraw/zinc/04/28/36/1082042836.db2.gz NBNILGADADFOHO-UHFFFAOYSA-N 1 0 366.843 4.037 20 10 FICDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccc2c(c1)CC(=O)N2C ZINC000728302819 1082046790 /nfs/dbraw/zinc/04/67/90/1082046790.db2.gz YFVDWHXRWSPGSS-MRXNPFEDSA-N 1 0 372.468 4.429 20 10 FICDRO CC[C@H]([NH2+]CCCc1nnc(SC)n1CC(C)C)c1ccccc1O ZINC000155824034 1082093245 /nfs/dbraw/zinc/09/32/45/1082093245.db2.gz RBTGOGJVXPOIKH-INIZCTEOSA-N 1 0 362.543 4.035 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)c1 ZINC000073005364 1082630188 /nfs/dbraw/zinc/63/01/88/1082630188.db2.gz YFSYRZKSBFECDT-INIZCTEOSA-N 1 0 361.445 4.199 20 10 FICDRO COc1ccccc1N1CCC([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000178229699 1082997510 /nfs/dbraw/zinc/99/75/10/1082997510.db2.gz ZSGRRFJFVUSXKC-QGZVFWFLSA-N 1 0 353.510 4.081 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)c(O)c1OC ZINC000892431494 1083391352 /nfs/dbraw/zinc/39/13/52/1083391352.db2.gz QTVMKNYFOUBGLL-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000179568149 1083566653 /nfs/dbraw/zinc/56/66/53/1083566653.db2.gz WFFUPCLYKCNKSP-MRXNPFEDSA-N 1 0 369.852 4.475 20 10 FICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1F ZINC000162260670 1083935561 /nfs/dbraw/zinc/93/55/61/1083935561.db2.gz TXZPDNSDZLPMNL-HZPDHXFCSA-N 1 0 358.457 4.083 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC ZINC000157420653 1084380473 /nfs/dbraw/zinc/38/04/73/1084380473.db2.gz FQMRRAGCZXLGKB-LSDHHAIUSA-N 1 0 358.482 4.190 20 10 FICDRO CCc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974584 1084520670 /nfs/dbraw/zinc/52/06/70/1084520670.db2.gz GMLXUUMKAFEVKJ-SFHVURJKSA-N 1 0 365.521 4.356 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(=O)NCc1ccccc1 ZINC000161178684 1084753979 /nfs/dbraw/zinc/75/39/79/1084753979.db2.gz JENSFZKKVDLPQR-RTBURBONSA-N 1 0 365.521 4.032 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)CC12CCC2 ZINC000313234564 1085290719 /nfs/dbraw/zinc/29/07/19/1085290719.db2.gz TWPXTSYJNSPWJK-DLBZAZTESA-N 1 0 372.509 4.291 20 10 FICDRO c1cncc([C@H]2CCC[C@H]([NH2+]Cc3ccc(N4CCSCC4)cc3)C2)c1 ZINC000800222685 1086534500 /nfs/dbraw/zinc/53/45/00/1086534500.db2.gz BXWITJMJUYTCRA-FPOVZHCZSA-N 1 0 367.562 4.451 20 10 FICDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c2ccccc21 ZINC000178538377 1086783458 /nfs/dbraw/zinc/78/34/58/1086783458.db2.gz NYRZIIDERMLBSF-HSZRJFAPSA-N 1 0 364.533 4.408 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000311303171 1088547533 /nfs/dbraw/zinc/54/75/33/1088547533.db2.gz OANJYCHLJFYUHP-SJLPKXTDSA-N 1 0 361.530 4.193 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(OC)c(OC)cc2OC)cc1 ZINC000178316058 1089218091 /nfs/dbraw/zinc/21/80/91/1089218091.db2.gz ARJZCBPVIGPCCU-OAHLLOKOSA-N 1 0 358.482 4.019 20 10 FICDRO Cc1ccccc1NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435613968 1089798269 /nfs/dbraw/zinc/79/82/69/1089798269.db2.gz LMPPNEQBDMHMSH-UHFFFAOYSA-N 1 0 361.489 4.355 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)c(O)c1OC ZINC000893133092 1089955684 /nfs/dbraw/zinc/95/56/84/1089955684.db2.gz ZYYWZSKFEJVECI-NSHDSACASA-N 1 0 371.355 4.159 20 10 FICDRO C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cc(Br)cc(F)c1[O-] ZINC000756363525 1090128462 /nfs/dbraw/zinc/12/84/62/1090128462.db2.gz OZYDFKLDXQDKGZ-STQMWFEESA-N 1 0 373.310 4.209 20 10 FICDRO CC1CCN(c2ccc(CNC(=O)CC[C@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000236672934 1090238924 /nfs/dbraw/zinc/23/89/24/1090238924.db2.gz HWDQVNXDBNGVMA-QFIPXVFZSA-N 1 0 365.521 4.019 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3OC(F)F)C2)c1 ZINC000185476958 1090546130 /nfs/dbraw/zinc/54/61/30/1090546130.db2.gz VHBWLQACMZNPGO-LSDHHAIUSA-N 1 0 362.420 4.232 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cc(C)ccc3OC)CC2)cc1 ZINC000162376892 1090787916 /nfs/dbraw/zinc/78/79/16/1090787916.db2.gz LZJVDXBSZAQKKY-QGZVFWFLSA-N 1 0 354.494 4.332 20 10 FICDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1Cl ZINC000195438890 1091503426 /nfs/dbraw/zinc/50/34/26/1091503426.db2.gz KDKLHYGOWXUGNN-UHFFFAOYSA-N 1 0 358.913 4.147 20 10 FICDRO CCOC[C@H]1CC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000299738007 1091679016 /nfs/dbraw/zinc/67/90/16/1091679016.db2.gz MNIKTJPLFLFNNR-KRWDZBQOSA-N 1 0 366.465 4.399 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(OC)c(OC)c2OC)cc1 ZINC000178555570 1091848075 /nfs/dbraw/zinc/84/80/75/1091848075.db2.gz NCOXNAWMEJMXPJ-MRXNPFEDSA-N 1 0 372.509 4.062 20 10 FICDRO CCOc1cccc(C[NH2+]C[C@H](C)CSc2ccccc2OC)c1O ZINC000236940144 1093009808 /nfs/dbraw/zinc/00/98/08/1093009808.db2.gz QBZLWJLKKQJQJV-HNNXBMFYSA-N 1 0 361.507 4.318 20 10 FICDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Br)ccc2O)o1 ZINC000137064234 1093774349 /nfs/dbraw/zinc/77/43/49/1093774349.db2.gz FUJKWOFOFQUVDD-HNNXBMFYSA-N 1 0 366.255 4.231 20 10 FICDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Br)ccc2O)o1 ZINC000137064282 1093775803 /nfs/dbraw/zinc/77/58/03/1093775803.db2.gz FUJKWOFOFQUVDD-OAHLLOKOSA-N 1 0 366.255 4.231 20 10 FICDRO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 ZINC000728979351 1093911275 /nfs/dbraw/zinc/91/12/75/1093911275.db2.gz UYISYAGATSNYAZ-MRXNPFEDSA-N 1 0 370.493 4.124 20 10 FICDRO C[C@@H]([NH2+]C[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(N2CCCCC2)cc1 ZINC000163181682 1094323296 /nfs/dbraw/zinc/32/32/96/1094323296.db2.gz JBHUHNGJJIQQHZ-SJORKVTESA-N 1 0 369.475 4.212 20 10 FICDRO C[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000163470235 1099568772 /nfs/dbraw/zinc/56/87/72/1099568772.db2.gz ITSLLZNODGMLDZ-PKOBYXMFSA-N 1 0 364.505 4.052 20 10 FICDRO COC1CCN(c2ccc(C[NH2+][C@H](c3ncccc3C)C(C)C)cc2)CC1 ZINC000295012044 1101025957 /nfs/dbraw/zinc/02/59/57/1101025957.db2.gz TVTLEANLIWBSNN-QFIPXVFZSA-N 1 0 367.537 4.492 20 10 FICDRO Fc1ccc(Br)c2c1CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000760327789 1101916566 /nfs/dbraw/zinc/91/65/66/1101916566.db2.gz VDDTZPBXMMNMNG-INIZCTEOSA-N 1 0 362.242 4.300 20 10 FICDRO CN(C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1)C(=O)OC(C)(C)C ZINC000729464155 1102635808 /nfs/dbraw/zinc/63/58/08/1102635808.db2.gz SCOLHRMLCRRTPJ-INIZCTEOSA-N 1 0 370.493 4.234 20 10 FICDRO C[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1cc(F)ccc1O ZINC000760041603 1105020889 /nfs/dbraw/zinc/02/08/89/1105020889.db2.gz YOWGUYHWVDPTCM-LVXYXVKQSA-N 1 0 361.432 4.095 20 10 FICDRO C[C@H]([NH2+]C[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cc(F)ccc1O ZINC000760041607 1105021176 /nfs/dbraw/zinc/02/11/76/1105021176.db2.gz YOWGUYHWVDPTCM-WVFSVQOHSA-N 1 0 361.432 4.095 20 10 FICDRO COc1ccc(N2CC[NH+](Cc3ccc(CC(C)C)cc3)CC2)cc1F ZINC001168069616 1107664969 /nfs/dbraw/zinc/66/49/69/1107664969.db2.gz ZSHAOUDUBWABQA-UHFFFAOYSA-N 1 0 356.485 4.355 20 10 FICDRO CCN1CC[C@@H]([NH2+]Cc2cccc(C)c2O)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000783595078 1107677218 /nfs/dbraw/zinc/67/72/18/1107677218.db2.gz MJHSMZDTAJZBGW-IEBWSBKVSA-N 1 0 364.411 4.043 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Br)ccc1O ZINC000528034674 1109889480 /nfs/dbraw/zinc/88/94/80/1109889480.db2.gz ATRXRVMOYRYGLP-HZMBPMFUSA-N 1 0 353.235 4.491 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)c(OC)c1 ZINC000528673859 1110071927 /nfs/dbraw/zinc/07/19/27/1110071927.db2.gz ZUODWTVLOZDJPH-NSHDSACASA-N 1 0 363.841 4.116 20 10 FICDRO Cc1cc(Br)cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1O ZINC000529643879 1110298841 /nfs/dbraw/zinc/29/88/41/1110298841.db2.gz KEEUCLZJGSKIEC-QGZVFWFLSA-N 1 0 361.283 4.489 20 10 FICDRO COc1cc(F)c([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1OC ZINC000479455507 1112029900 /nfs/dbraw/zinc/02/99/00/1112029900.db2.gz QSZXHAHTKAEOMP-AWEZNQCLSA-N 1 0 356.441 4.494 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(OC)cc1 ZINC000163602327 1113984456 /nfs/dbraw/zinc/98/44/56/1113984456.db2.gz PICBVZJZXOZPTQ-NRFANRHFSA-N 1 0 356.535 4.489 20 10 FICDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163606916 1113993159 /nfs/dbraw/zinc/99/31/59/1113993159.db2.gz ULGQAXGCJJACKF-MRXNPFEDSA-N 1 0 371.506 4.307 20 10 FICDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cccc1[N+](=O)[O-] ZINC000163607221 1113993914 /nfs/dbraw/zinc/99/39/14/1113993914.db2.gz CVLKXKPWGVKPPI-MRXNPFEDSA-N 1 0 371.506 4.307 20 10 FICDRO CSc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1F ZINC000151063044 1114288173 /nfs/dbraw/zinc/28/81/73/1114288173.db2.gz QODCLNBCWNUOIG-OAHLLOKOSA-N 1 0 360.498 4.235 20 10 FICDRO CCOc1ncccc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000151178799 1114308610 /nfs/dbraw/zinc/30/86/10/1114308610.db2.gz BCMOAQNKOXUACA-INIZCTEOSA-N 1 0 357.473 4.461 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC[C@@H]1CCOC1)c1ccccc1O ZINC000156309503 1114382978 /nfs/dbraw/zinc/38/29/78/1114382978.db2.gz DIQYFMXRPJUTPI-YLJYHZDGSA-N 1 0 355.478 4.357 20 10 FICDRO Cc1cc(C)c(O)c(C[N@H+](Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1 ZINC000163889454 1114406970 /nfs/dbraw/zinc/40/69/70/1114406970.db2.gz SFTSMGIUYLNPKQ-UHFFFAOYSA-N 1 0 364.489 4.066 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1O ZINC000156446408 1114442225 /nfs/dbraw/zinc/44/22/25/1114442225.db2.gz HCFQLMNOBKGYMQ-FQEVSTJZSA-N 1 0 352.478 4.259 20 10 FICDRO CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cccnc1 ZINC000164199894 1114444419 /nfs/dbraw/zinc/44/44/19/1114444419.db2.gz PVTWBLJNXZWRPQ-YLJYHZDGSA-N 1 0 371.500 4.148 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000156808035 1114594912 /nfs/dbraw/zinc/59/49/12/1114594912.db2.gz VBJMYCMJHHKAKB-SJORKVTESA-N 1 0 351.494 4.291 20 10 FICDRO C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000166609493 1115053265 /nfs/dbraw/zinc/05/32/65/1115053265.db2.gz HVAIEANQOQZMON-MQNAVGNWSA-N 1 0 350.506 4.376 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)cc1 ZINC000157677691 1115228953 /nfs/dbraw/zinc/22/89/53/1115228953.db2.gz XMWZILYVBNMIGO-HRAATJIYSA-N 1 0 372.484 4.473 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2OCCOC)cc1 ZINC000167627124 1115311958 /nfs/dbraw/zinc/31/19/58/1115311958.db2.gz SMPCHZYYMXZACP-SFHVURJKSA-N 1 0 356.510 4.327 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(C)c2O)cc1Br ZINC000158084075 1115495150 /nfs/dbraw/zinc/49/51/50/1115495150.db2.gz MOAAMSCUDOCLAI-LBPRGKRZSA-N 1 0 350.256 4.323 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccccc2N2CCCC2)c1O ZINC000761183445 1115596552 /nfs/dbraw/zinc/59/65/52/1115596552.db2.gz KFHXOSVJHZJWJP-UHFFFAOYSA-N 1 0 360.885 4.286 20 10 FICDRO COc1cc(Cl)cc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)c1O ZINC000761184224 1115598681 /nfs/dbraw/zinc/59/86/81/1115598681.db2.gz UEWSSISIBIZVMQ-OAHLLOKOSA-N 1 0 367.898 4.297 20 10 FICDRO CCC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000761203584 1115623055 /nfs/dbraw/zinc/62/30/55/1115623055.db2.gz WOAFCFAOGGGRSY-OLMNPRSZSA-N 1 0 353.890 4.080 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]C2(CCOCc3ccccc3)CC2)c1O ZINC000761214573 1115643521 /nfs/dbraw/zinc/64/35/21/1115643521.db2.gz DTDGAPMDARTHJY-UHFFFAOYSA-N 1 0 361.869 4.283 20 10 FICDRO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000172676998 1115972018 /nfs/dbraw/zinc/97/20/18/1115972018.db2.gz KHGOZOLDAASCMQ-MRXNPFEDSA-N 1 0 367.518 4.326 20 10 FICDRO O=C1OCCN1c1cccc2c1CC[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC000173383973 1116055868 /nfs/dbraw/zinc/05/58/68/1116055868.db2.gz LXYATFBPYKNAGS-UHFFFAOYSA-N 1 0 374.440 4.060 20 10 FICDRO Cc1cc(O)c(C[NH2+]CCCc2nc(-c3ccncc3)cs2)cc1C ZINC000174389763 1116134094 /nfs/dbraw/zinc/13/40/94/1116134094.db2.gz WBIGNYPHTNZPGF-UHFFFAOYSA-N 1 0 353.491 4.250 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)c1ccccc1 ZINC000151513382 1116264890 /nfs/dbraw/zinc/26/48/90/1116264890.db2.gz VWIJOPDRZVSBTI-KRWDZBQOSA-N 1 0 370.512 4.243 20 10 FICDRO CC[N@H+](Cc1cccs1)Cc1cc(Br)c(OC)cc1O ZINC001233142530 1116337585 /nfs/dbraw/zinc/33/75/85/1116337585.db2.gz TVLSEGSQMDHCMD-UHFFFAOYSA-N 1 0 356.285 4.247 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(C)cc1 ZINC000151562318 1118528390 /nfs/dbraw/zinc/52/83/90/1118528390.db2.gz BLPJHRQFBGYBCS-HSZRJFAPSA-N 1 0 352.522 4.445 20 10 FICDRO C[C@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000090221156 1118738280 /nfs/dbraw/zinc/73/82/80/1118738280.db2.gz XRTBGJKSVKHSJV-YHAMSUFESA-N 1 0 374.525 4.404 20 10 FICDRO COc1ccc(C[C@H](C)C[NH2+]CCCSc2nccs2)cc1F ZINC000761525493 1119412113 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20 10 FICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl)OCO2 ZINC000917474250 1122322272 /nfs/dbraw/zinc/32/22/72/1122322272.db2.gz XVDQMRPDHAZJEX-CYBMUJFWSA-N 1 0 363.816 4.121 20 10 FICDRO C[N@H+](CCCOc1cccc(Cl)c1)Cc1c(O)ccc2ccncc21 ZINC000917487485 1122332875 /nfs/dbraw/zinc/33/28/75/1122332875.db2.gz QEPVJCJTUOYWRN-UHFFFAOYSA-N 1 0 356.853 4.495 20 10 FICDRO C[C@H]([NH2+]Cc1cccnc1N(C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154728889 1122650500 /nfs/dbraw/zinc/65/05/00/1122650500.db2.gz ZFGHALYYWZASPH-INIZCTEOSA-N 1 0 356.489 4.128 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCN(c3ccc(F)cc3)C2)cc1 ZINC000920183442 1123399471 /nfs/dbraw/zinc/39/94/71/1123399471.db2.gz NYGBZPRJPOMVJR-LJQANCHMSA-N 1 0 355.501 4.288 20 10 FICDRO C[C@@H]([NH2+]CCCN1CCCCC1=O)c1ccc(N2CCCCCC2)cc1 ZINC000765846809 1124153562 /nfs/dbraw/zinc/15/35/62/1124153562.db2.gz YPNJVEMLHYEFDP-LJQANCHMSA-N 1 0 357.542 4.120 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCC(O)CC3)c(F)c1)[C@H](C)C2 ZINC000180214650 1124265796 /nfs/dbraw/zinc/26/57/96/1124265796.db2.gz IAKXKZBYZJNGOU-WAIKUNEKSA-N 1 0 368.496 4.118 20 10 FICDRO O=C(Nc1cccc(C[NH2+]Cc2ccccc2O)c1)c1ccc(F)cc1 ZINC000238107838 1124281566 /nfs/dbraw/zinc/28/15/66/1124281566.db2.gz JLRCICDZAQGJKI-UHFFFAOYSA-N 1 0 350.393 4.073 20 10 FICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C[C@@H](O)c2cccs2)c1 ZINC000180648812 1124381867 /nfs/dbraw/zinc/38/18/67/1124381867.db2.gz HVDHCELLMHBHHQ-HXUWFJFHSA-N 1 0 369.486 4.198 20 10 FICDRO Cc1cccc(CNc2cccc(NC(=O)C[NH+]3CCCCCC3)c2)c1O ZINC000181015788 1124505907 /nfs/dbraw/zinc/50/59/07/1124505907.db2.gz URASMQLQHNWESN-UHFFFAOYSA-N 1 0 367.493 4.127 20 10 FICDRO COc1ccc([C@@H]2C[C@@H]([N@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671201 1124711758 /nfs/dbraw/zinc/71/17/58/1124711758.db2.gz LXHNRUMGLBSNAS-UNMCSNQZSA-N 1 0 354.494 4.113 20 10 FICDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765968184 1125206783 /nfs/dbraw/zinc/20/67/83/1125206783.db2.gz BQWAYZNMWCXDED-QGZVFWFLSA-N 1 0 369.484 4.495 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(CCc3ccccc3)n2)c1 ZINC000182325678 1125411392 /nfs/dbraw/zinc/41/13/92/1125411392.db2.gz VEIZPKWPGAGKMA-HNNXBMFYSA-N 1 0 368.502 4.493 20 10 FICDRO CCOC(=O)c1oc2ccccc2c1C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000182327576 1125411422 /nfs/dbraw/zinc/41/14/22/1125411422.db2.gz WRXWDPASKJKJJF-CYBMUJFWSA-N 1 0 369.417 4.175 20 10 FICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1cccnc1OCC(F)F ZINC000763524947 1125427028 /nfs/dbraw/zinc/42/70/28/1125427028.db2.gz HDCDCNIEQLFGBO-UHFFFAOYSA-N 1 0 370.399 4.388 20 10 FICDRO COc1ccc(C[NH2+]Cc2cccc(Br)c2[O-])cc1Cl ZINC000132233591 1125489111 /nfs/dbraw/zinc/48/91/11/1125489111.db2.gz LNBUKIOAEPPCIK-UHFFFAOYSA-N 1 0 356.647 4.107 20 10 FICDRO CCC(=O)N1CCC[N@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CC1 ZINC000748067535 1079729801 /nfs/dbraw/zinc/72/98/01/1079729801.db2.gz SUBHLLZFOIQHMR-UHFFFAOYSA-N 1 0 374.569 4.432 20 10 FICDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)c1O ZINC000275266720 1080647870 /nfs/dbraw/zinc/64/78/70/1080647870.db2.gz BGDUHTPVPXCZMU-QWRGUYRKSA-N 1 0 367.291 4.116 20 10 FICDRO CCOC(=O)CC[N@@H+](Cc1ccc(N2CCCCC2)c(C)c1)CC1CC1 ZINC001167261926 1080929812 /nfs/dbraw/zinc/92/98/12/1080929812.db2.gz PSKZXDGLGVNMBT-UHFFFAOYSA-N 1 0 358.526 4.151 20 10 FICDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H]1C ZINC001648826650 1081262891 /nfs/dbraw/zinc/26/28/91/1081262891.db2.gz NEWDHQYABXXZFU-HLLBOEOZSA-N 1 0 370.459 4.456 20 10 FICDRO CC[C@H]([NH2+]C1CCN(C(=O)c2ccc(C)cc2)CC1)c1ccccc1O ZINC000155592137 1081553345 /nfs/dbraw/zinc/55/33/45/1081553345.db2.gz JDSLTPJQKJSJMV-FQEVSTJZSA-N 1 0 352.478 4.046 20 10 FICDRO N=c1ccc(/N=N/c2ccccc2)c(N)n1C1=CC[C@@H]([NH+]2CCCC2)CC1 ZINC001210706211 1081558634 /nfs/dbraw/zinc/55/86/34/1081558634.db2.gz UYAJLCXWTUKGHM-YAUMUAQOSA-N 1 0 362.481 4.454 20 10 FICDRO C[C@]1(c2ccccc2)CCC[N@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167367694 1081751489 /nfs/dbraw/zinc/75/14/89/1081751489.db2.gz QIERCULOXYFWET-QHCPKHFHSA-N 1 0 350.506 4.077 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCCC2)nc1)c1ccc(N(C)C)cc1 ZINC000160526198 1081984830 /nfs/dbraw/zinc/98/48/30/1081984830.db2.gz GJGXWZYTEWQAAB-SFHVURJKSA-N 1 0 352.526 4.379 20 10 FICDRO CCCC(C)(C)NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC001125546645 1083109881 /nfs/dbraw/zinc/10/98/81/1083109881.db2.gz FSTNMFSAWWHAQF-UHFFFAOYSA-N 1 0 355.526 4.103 20 10 FICDRO COc1cccc(C[NH2+]C(C)(C)c2ccccc2Br)c1O ZINC000179329651 1083380141 /nfs/dbraw/zinc/38/01/41/1083380141.db2.gz CYHIZBJTRFLCNV-UHFFFAOYSA-N 1 0 350.256 4.188 20 10 FICDRO CC[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1O ZINC000179554610 1083564570 /nfs/dbraw/zinc/56/45/70/1083564570.db2.gz QZXYPGHVFUGJQC-UHFFFAOYSA-N 1 0 353.249 4.160 20 10 FICDRO CC[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cc(C)ccc1O ZINC000179605759 1083572723 /nfs/dbraw/zinc/57/27/23/1083572723.db2.gz NBILNZQCZYXMPU-UHFFFAOYSA-N 1 0 366.383 4.180 20 10 FICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000151574613 1083723884 /nfs/dbraw/zinc/72/38/84/1083723884.db2.gz OHJZNDZKJBJOAW-SFHVURJKSA-N 1 0 368.521 4.063 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(N2CCOCC2)c(F)c1 ZINC000177862710 1084393773 /nfs/dbraw/zinc/39/37/73/1084393773.db2.gz PPCWXKNMUCMVKK-LBPRGKRZSA-N 1 0 354.878 4.228 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(NC(=O)CC3CCCC3)CC2)cc1C(C)C ZINC000066859035 1085184954 /nfs/dbraw/zinc/18/49/54/1085184954.db2.gz GEBKEDDICHBGAL-UHFFFAOYSA-N 1 0 372.553 4.485 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)[C@@H](O)c1cccc(F)c1 ZINC000756737054 1085659285 /nfs/dbraw/zinc/65/92/85/1085659285.db2.gz RVTAXSSWMIHNQT-WVQJBOLRSA-N 1 0 368.246 4.067 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cc2ccccc2o1 ZINC000066970264 1086614575 /nfs/dbraw/zinc/61/45/75/1086614575.db2.gz HREGWLDCDHOFOA-OAHLLOKOSA-N 1 0 354.425 4.259 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2sccc2Cl)SC1=S ZINC000588601004 1087368426 /nfs/dbraw/zinc/36/84/26/1087368426.db2.gz XCNYVKNSRJQKAN-KPKJPENVSA-N 1 0 374.984 4.191 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(NC(=O)OC(C)(C)C)cc2)c1O ZINC000311309924 1088540204 /nfs/dbraw/zinc/54/02/04/1088540204.db2.gz XVHBKEYPJGFZFB-UHFFFAOYSA-N 1 0 358.438 4.038 20 10 FICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(OC[C@@H]2CCOC2)c1 ZINC000167177380 1088639327 /nfs/dbraw/zinc/63/93/27/1088639327.db2.gz AJSBLFHEBWEHFP-RBUKOAKNSA-N 1 0 368.521 4.327 20 10 FICDRO CC(C)(C)OC(=O)NC1CCC([NH2+]CCCSc2nccs2)CC1 ZINC000180574801 1090218719 /nfs/dbraw/zinc/21/87/19/1090218719.db2.gz LNSCRHNUODZGEC-UHFFFAOYSA-N 1 0 371.572 4.051 20 10 FICDRO COc1cc(O)c(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)cc1OC ZINC000182633999 1090365599 /nfs/dbraw/zinc/36/55/99/1090365599.db2.gz OYTPRYIALGWPPA-NSHDSACASA-N 1 0 371.355 4.159 20 10 FICDRO COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(F)cc3[O-])CC2)cc1 ZINC000185230162 1090521770 /nfs/dbraw/zinc/52/17/70/1090521770.db2.gz SCHKXMMQMQRIOB-INIZCTEOSA-N 1 0 372.484 4.103 20 10 FICDRO C[C@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)c1cc(F)ccc1O ZINC000185429748 1090542665 /nfs/dbraw/zinc/54/26/65/1090542665.db2.gz SAEBGCFWVCMVRW-HNNXBMFYSA-N 1 0 359.441 4.078 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3OC(F)F)C2)c(O)c1 ZINC000185477340 1090546863 /nfs/dbraw/zinc/54/68/63/1090546863.db2.gz VYIOWMBHQSDHDN-LSDHHAIUSA-N 1 0 362.420 4.232 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CCS[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC000828025105 1091020698 /nfs/dbraw/zinc/02/06/98/1091020698.db2.gz DKSHYEYCVDBZQS-LEWJYISDSA-N 1 0 360.567 4.162 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cnn(C(C)C)c3C)CC2)cc1 ZINC000191255557 1091059756 /nfs/dbraw/zinc/05/97/56/1091059756.db2.gz YOSGNFSIIZIBOV-INIZCTEOSA-N 1 0 356.514 4.101 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)c1 ZINC000311310919 1091366894 /nfs/dbraw/zinc/36/68/94/1091366894.db2.gz WFJUIOZVMZTTCA-KRWDZBQOSA-N 1 0 360.498 4.112 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(CO)c(F)c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178561071 1091866406 /nfs/dbraw/zinc/86/64/06/1091866406.db2.gz USPAJJFSZSYGIT-OAHLLOKOSA-N 1 0 360.448 4.298 20 10 FICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(Br)cn2)c(O)c1 ZINC000279620145 1091944661 /nfs/dbraw/zinc/94/46/61/1091944661.db2.gz ARUXYAUUNVTDMW-GFCCVEGCSA-N 1 0 365.271 4.189 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(Br)cn2)c1O ZINC000279794747 1092047535 /nfs/dbraw/zinc/04/75/35/1092047535.db2.gz MTCHZIVZJQQYHL-SECBINFHSA-N 1 0 371.662 4.063 20 10 FICDRO CCc1cccc(C[NH2+][C@H]2CC3(CCOCC3)Oc3ccccc32)c1O ZINC000895699221 1093679979 /nfs/dbraw/zinc/67/99/79/1093679979.db2.gz JHUMGEJCMGWNPP-IBGZPJMESA-N 1 0 353.462 4.117 20 10 FICDRO COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001648951614 1094096086 /nfs/dbraw/zinc/09/60/86/1094096086.db2.gz ZNGUIBVFQIBFFZ-AQTBWJFISA-N 1 0 350.506 4.409 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(C)cc1O ZINC000280278025 1094323139 /nfs/dbraw/zinc/32/31/39/1094323139.db2.gz YIEYAIMPDWZYND-KXBFYZLASA-N 1 0 354.450 4.459 20 10 FICDRO CC[NH+](CC)[C@H](C)CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl ZINC001271371624 1095719689 /nfs/dbraw/zinc/71/96/89/1095719689.db2.gz YQRCABQYTLNABM-MRXNPFEDSA-N 1 0 361.917 4.208 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H](CN2CCCC2=O)c2ccccc2)c(O)c1C ZINC000273362691 1096255429 /nfs/dbraw/zinc/25/54/29/1096255429.db2.gz DHNFEVFNYKDARX-YLJYHZDGSA-N 1 0 352.478 4.023 20 10 FICDRO CCOCc1cc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1OC ZINC000273361604 1096255647 /nfs/dbraw/zinc/25/56/47/1096255647.db2.gz CRWRFBXQUKMIQX-IFMALSPDSA-N 1 0 373.468 4.381 20 10 FICDRO c1ccc2oc(-c3ccc(N4CC[NH+]([C@@H]5C[C@H]6C[C@H]6C5)CC4)cc3)nc2c1 ZINC001167959910 1098562855 /nfs/dbraw/zinc/56/28/55/1098562855.db2.gz UXFKZVMXGORCQZ-OPVJXMOQSA-N 1 0 359.473 4.415 20 10 FICDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Br)cc(C)c2O)cn1 ZINC000295999239 1101242702 /nfs/dbraw/zinc/24/27/02/1101242702.db2.gz QFVNWXQPPFHXST-NEPJUHHUSA-N 1 0 352.276 4.091 20 10 FICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1c1nc3ccccc3s1)OCO2 ZINC000007091980 1101633175 /nfs/dbraw/zinc/63/31/75/1101633175.db2.gz YTKWEQDVSFHDBM-CQSZACIVSA-N 1 0 354.431 4.068 20 10 FICDRO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000186643145 1101775335 /nfs/dbraw/zinc/77/53/35/1101775335.db2.gz RAPYTGBRIZWZFX-CWTRNNRKSA-N 1 0 359.832 4.358 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 ZINC000163414329 1102752859 /nfs/dbraw/zinc/75/28/59/1102752859.db2.gz JZLLIFUTXZZUFM-CQSZACIVSA-N 1 0 368.399 4.294 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 ZINC001648957110 1104454965 /nfs/dbraw/zinc/45/49/65/1104454965.db2.gz YQNWNMSRYKCQKA-PGRDOPGGSA-N 1 0 350.506 4.121 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@]2(CO)C[C@H]2c2ccc(F)cc2)cc1 ZINC000760040440 1105016507 /nfs/dbraw/zinc/01/65/07/1105016507.db2.gz KCOLBTDCYDEOMZ-WQTXXOFMSA-N 1 0 356.485 4.099 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c(O)c1 ZINC000760041109 1105036704 /nfs/dbraw/zinc/03/67/04/1105036704.db2.gz VUTMBKNEXVRWJM-USCONSEESA-N 1 0 357.469 4.264 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3C[C@@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000827986121 1108743705 /nfs/dbraw/zinc/74/37/05/1108743705.db2.gz SDSZHPHJAOAKPA-JPYJTQIMSA-N 1 0 350.506 4.495 20 10 FICDRO C[C@H](c1ccccc1O)[NH+]1CCC(Cc2nc(C3CCCC3)no2)CC1 ZINC000527939821 1109863547 /nfs/dbraw/zinc/86/35/47/1109863547.db2.gz SWJPMJYTMXGDAD-OAHLLOKOSA-N 1 0 355.482 4.449 20 10 FICDRO CC[C@@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1O ZINC000527997139 1109881268 /nfs/dbraw/zinc/88/12/68/1109881268.db2.gz HELDOWIALWTYKN-GDBMZVCRSA-N 1 0 364.367 4.015 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 ZINC000529669025 1110302875 /nfs/dbraw/zinc/30/28/75/1110302875.db2.gz KSVKXBWIEZKGFL-KRWDZBQOSA-N 1 0 369.292 4.100 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC(=O)Nc2ccc(F)cc21 ZINC000479456761 1112030185 /nfs/dbraw/zinc/03/01/85/1112030185.db2.gz QKMGQUOYKQBIPK-QGZVFWFLSA-N 1 0 351.425 4.189 20 10 FICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)c1 ZINC000163606308 1113991318 /nfs/dbraw/zinc/99/13/18/1113991318.db2.gz HCYDFBDFRDWWNM-KRWDZBQOSA-N 1 0 356.535 4.489 20 10 FICDRO CCc1nc2c(s1)[C@H]([NH2+]Cc1ccc(N3CCSCC3)cc1)CCC2 ZINC000163608391 1113996849 /nfs/dbraw/zinc/99/68/49/1113996849.db2.gz ZCELLQWLRINVHN-QGZVFWFLSA-N 1 0 373.591 4.426 20 10 FICDRO COCCC[N@H+](Cc1ccncc1)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164305019 1114472620 /nfs/dbraw/zinc/47/26/20/1114472620.db2.gz JDEYLJAVAVOCLH-UHFFFAOYSA-N 1 0 372.509 4.132 20 10 FICDRO CC1CCN(c2cccc(NC(=O)c3cccc(C[NH+](C)C)c3)c2)CC1 ZINC000156699417 1114500980 /nfs/dbraw/zinc/50/09/80/1114500980.db2.gz YYDGESVTDRXWMF-UHFFFAOYSA-N 1 0 351.494 4.237 20 10 FICDRO CCc1nc(C)c([C@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)s1 ZINC000157354134 1115094992 /nfs/dbraw/zinc/09/49/92/1115094992.db2.gz WWNGQHSGQQTNRZ-AWEZNQCLSA-N 1 0 359.539 4.342 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000157662705 1115231358 /nfs/dbraw/zinc/23/13/58/1115231358.db2.gz HPQNWAWZIKWMIX-VGOFRKELSA-N 1 0 354.494 4.334 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCN(c2ncccc2F)C1)c1ccc(N2CCCCC2)cc1 ZINC000168112359 1115425912 /nfs/dbraw/zinc/42/59/12/1115425912.db2.gz KUDRTQFYJXUAFR-PKOBYXMFSA-N 1 0 368.500 4.141 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2)[C@@H](CO)C(C)C)c1O ZINC000761203693 1115620699 /nfs/dbraw/zinc/62/06/99/1115620699.db2.gz XKHKXPNHPFEUDP-SFHVURJKSA-N 1 0 363.885 4.073 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc2c(c1)OCCCO2 ZINC000171378330 1115863354 /nfs/dbraw/zinc/86/33/54/1115863354.db2.gz VZJKCSMPFRBSGI-MRXNPFEDSA-N 1 0 352.478 4.081 20 10 FICDRO C[C@@H]([NH2+]CCCNC(=O)c1cccs1)c1ccc(N2CCCCC2)cc1 ZINC000089641073 1116207930 /nfs/dbraw/zinc/20/79/30/1116207930.db2.gz YTDMZGWNDGPJOH-QGZVFWFLSA-N 1 0 371.550 4.209 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)cc1 ZINC000151517189 1116277474 /nfs/dbraw/zinc/27/74/74/1116277474.db2.gz IUGOGRLMRXOTSZ-OAQYLSRUSA-N 1 0 356.485 4.336 20 10 FICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151533096 1116356432 /nfs/dbraw/zinc/35/64/32/1116356432.db2.gz VNQCPMUZXQWCAB-INIZCTEOSA-N 1 0 372.484 4.036 20 10 FICDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc(C)c1F ZINC000151550774 1118270522 /nfs/dbraw/zinc/27/05/22/1118270522.db2.gz BDSGOTPHCHMSAK-INIZCTEOSA-N 1 0 374.475 4.394 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1 ZINC000312206707 1118290806 /nfs/dbraw/zinc/29/08/06/1118290806.db2.gz NLMMJBLSQNUUST-UHFFFAOYSA-N 1 0 369.509 4.067 20 10 FICDRO Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151567512 1118566516 /nfs/dbraw/zinc/56/65/16/1118566516.db2.gz JBNWGILLLIYDBO-IBGZPJMESA-N 1 0 352.522 4.363 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1C ZINC000151572679 1118811124 /nfs/dbraw/zinc/81/11/24/1118811124.db2.gz BAHNJCBIWAIPSE-IBGZPJMESA-N 1 0 352.522 4.363 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H]3CCCCc4ccccc43)cc2)CC1 ZINC000151586757 1118939350 /nfs/dbraw/zinc/93/93/50/1118939350.db2.gz ISSVWBCYLBENGZ-XMMPIXPASA-N 1 0 364.533 4.453 20 10 FICDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000152130058 1119116830 /nfs/dbraw/zinc/11/68/30/1119116830.db2.gz AMAVNYDLUBVLFD-OAHLLOKOSA-N 1 0 367.449 4.424 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](COCC(C)C)c3ccco3)CC2)cc1 ZINC000152596437 1119458900 /nfs/dbraw/zinc/45/89/00/1119458900.db2.gz PCESWRXQURUOBB-OAQYLSRUSA-N 1 0 372.509 4.261 20 10 FICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1[N+](=O)[O-] ZINC000153389476 1120606393 /nfs/dbraw/zinc/60/63/93/1120606393.db2.gz XQMIYEAKYUQKOC-ZDUSSCGKSA-N 1 0 361.417 4.049 20 10 FICDRO Cc1noc(C)c1CO[C@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000762471070 1120912529 /nfs/dbraw/zinc/91/25/29/1120912529.db2.gz IIPXUWLPYSUCRJ-SFHVURJKSA-N 1 0 372.509 4.394 20 10 FICDRO CN1CC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000762622938 1120940616 /nfs/dbraw/zinc/94/06/16/1120940616.db2.gz GHDWODHQXJNUFO-UWJYYQICSA-N 1 0 374.887 4.197 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(O)c1C ZINC000762652776 1120944243 /nfs/dbraw/zinc/94/42/43/1120944243.db2.gz YKCHNMDYCGBMEI-ZVZYQTTQSA-N 1 0 362.514 4.305 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc(Br)ncc1F ZINC000762762935 1120960965 /nfs/dbraw/zinc/96/09/65/1120960965.db2.gz TUXWERQOEUTMPG-LBPRGKRZSA-N 1 0 366.278 4.208 20 10 FICDRO COCC[N@H+](Cc1ccccc1)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000915808511 1121065134 /nfs/dbraw/zinc/06/51/34/1121065134.db2.gz XJUGEGXCKYSNQX-UHFFFAOYSA-N 1 0 357.494 4.347 20 10 FICDRO C=Cc1ccc(C(=O)Nc2cccc(N3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC000763250071 1121304969 /nfs/dbraw/zinc/30/49/69/1121304969.db2.gz YRTPLLZZVUHCOU-UHFFFAOYSA-N 1 0 361.489 4.114 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1ccc(-n2ccnn2)cc1 ZINC000186183806 1121396580 /nfs/dbraw/zinc/39/65/80/1121396580.db2.gz MRAROHQBGJIVBD-HZPDHXFCSA-N 1 0 362.477 4.264 20 10 FICDRO C[C@@H]([NH2+]Cc1cccnc1OCC(F)F)c1cc2c(cc1O)CCCC2 ZINC000186199318 1121634901 /nfs/dbraw/zinc/63/49/01/1121634901.db2.gz HKKOVPTWGLPTHU-CYBMUJFWSA-N 1 0 362.420 4.161 20 10 FICDRO COC(=O)CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC001649089972 1121715661 /nfs/dbraw/zinc/71/56/61/1121715661.db2.gz BGVFPFPADNRQTF-IBGZPJMESA-N 1 0 350.462 4.271 20 10 FICDRO CN(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001649091531 1121729006 /nfs/dbraw/zinc/72/90/06/1121729006.db2.gz QUAYYGJBOFHORH-LADGPHEKSA-N 1 0 363.549 4.212 20 10 FICDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000916835131 1121876619 /nfs/dbraw/zinc/87/66/19/1121876619.db2.gz ASBHLPFKTYMIHW-ZBFHGGJFSA-N 1 0 356.432 4.210 20 10 FICDRO CCc1ccc(C[NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 ZINC000916835875 1121877999 /nfs/dbraw/zinc/87/79/99/1121877999.db2.gz BHAIHKLGKHPJRT-IRXDYDNUSA-N 1 0 356.485 4.292 20 10 FICDRO CCN(CC)c1ccc(CNc2ccc(N3CC[NH+](C)CC3)cc2C)cc1 ZINC000916839102 1121882292 /nfs/dbraw/zinc/88/22/92/1121882292.db2.gz XAHGFQNDQLHXTA-UHFFFAOYSA-N 1 0 366.553 4.205 20 10 FICDRO Cc1cc(CC[NH2+]C[C@@H](O)c2ccc(F)c(F)c2)c(C)n1-c1ccccc1 ZINC000916989389 1121991740 /nfs/dbraw/zinc/99/17/40/1121991740.db2.gz HXKHYIGIEJMOSQ-JOCHJYFZSA-N 1 0 370.443 4.238 20 10 FICDRO Cc1cccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1C ZINC000917074602 1122068921 /nfs/dbraw/zinc/06/89/21/1122068921.db2.gz CDNOCCKCLCALEW-UHFFFAOYSA-N 1 0 353.510 4.219 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3ccccc3OC(F)F)CC2)cc1 ZINC000917089730 1122102957 /nfs/dbraw/zinc/10/29/57/1122102957.db2.gz ISSDMTAXIRCAQE-UHFFFAOYSA-N 1 0 362.420 4.009 20 10 FICDRO Cc1cc(CC[NH2+]Cc2cnc3c(c2)c(C)nn3C)c(C)n1-c1ccccc1 ZINC000917139186 1122198455 /nfs/dbraw/zinc/19/84/55/1122198455.db2.gz MSXRFTLMLDBSPN-UHFFFAOYSA-N 1 0 373.504 4.017 20 10 FICDRO Oc1ccc2cc(Br)ccc2c1C[N@@H+]1CCCSCC1 ZINC000917465667 1122327211 /nfs/dbraw/zinc/32/72/11/1122327211.db2.gz PRFMRCCEJYZDHY-UHFFFAOYSA-N 1 0 352.297 4.247 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCc2c1cc(F)cc2F)c1ccc(N2CCOCC2)cc1 ZINC000154637079 1122544451 /nfs/dbraw/zinc/54/44/51/1122544451.db2.gz DQMSYIUBIWQOPL-SPLOXXLWSA-N 1 0 358.432 4.140 20 10 FICDRO Cc1ccc(-c2n[nH]cc2C[N@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000154706088 1122623497 /nfs/dbraw/zinc/62/34/97/1122623497.db2.gz YDXXDMIUYOOJHT-UHFFFAOYSA-N 1 0 363.417 4.479 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984914 1123300291 /nfs/dbraw/zinc/30/02/91/1123300291.db2.gz WGRCOWZFXGFCAD-ROUUACIJSA-N 1 0 371.912 4.104 20 10 FICDRO CCN(CC)c1ccc(CNC(=O)c2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000920082031 1123336535 /nfs/dbraw/zinc/33/65/35/1123336535.db2.gz KUXBEGVEDJHRBU-UHFFFAOYSA-N 1 0 365.521 4.059 20 10 FICDRO Cc1cc(O)c(CN2CCN(C(=O)C3CCCCC3)CC2)cc1C(C)C ZINC000921187961 1123580669 /nfs/dbraw/zinc/58/06/69/1123580669.db2.gz VYBZMZJQTLDLGP-UHFFFAOYSA-N 1 0 358.526 4.049 20 10 FICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000180027913 1124191712 /nfs/dbraw/zinc/19/17/12/1124191712.db2.gz QVAMALHMMWYVGD-AWEZNQCLSA-N 1 0 371.387 4.100 20 10 FICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000180555559 1124364808 /nfs/dbraw/zinc/36/48/08/1124364808.db2.gz WNLAIXRJFCQVFP-LLVKDONJSA-N 1 0 372.412 4.256 20 10 FICDRO CCOCc1cc(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)ccc1OC ZINC000180893003 1124466990 /nfs/dbraw/zinc/46/69/90/1124466990.db2.gz UOECPHKIINTFQY-UHFFFAOYSA-N 1 0 358.482 4.094 20 10 FICDRO COc1ccc([C@H]2C[C@H]([N@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671198 1124711633 /nfs/dbraw/zinc/71/16/33/1124711633.db2.gz LXHNRUMGLBSNAS-IFMALSPDSA-N 1 0 354.494 4.113 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143103393 1125244850 /nfs/dbraw/zinc/24/48/50/1125244850.db2.gz BTMHMCKJQAQCCT-MAUKXSAKSA-N 1 0 374.525 4.131 20 10 FICDRO COc1cccc(N2CC[NH+](Cc3cccc(C(C)(C)C)c3O)CC2)c1 ZINC001143103601 1125255348 /nfs/dbraw/zinc/25/53/48/1125255348.db2.gz GPFDFVXMXLQLDK-UHFFFAOYSA-N 1 0 354.494 4.021 20 10 FICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)OC(F)(F)O2 ZINC001167108325 1080553748 /nfs/dbraw/zinc/55/37/48/1080553748.db2.gz PDZVQDIBVMCDOJ-UHFFFAOYSA-N 1 0 362.420 4.485 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(N2CCOCC2)cc1 ZINC000155392396 1080884203 /nfs/dbraw/zinc/88/42/03/1080884203.db2.gz BKSYULQYMYJQHH-OXQOHEQNSA-N 1 0 354.519 4.411 20 10 FICDRO Cc1cc(Br)c([O-])c(C[NH2+]CCOc2c(C)cccc2C)c1 ZINC001648878572 1081339774 /nfs/dbraw/zinc/33/97/74/1081339774.db2.gz GLEHPJLFIBDKBR-UHFFFAOYSA-N 1 0 364.283 4.249 20 10 FICDRO CC1(C)CC([NH2+]Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC(C)(C)C1 ZINC001648889036 1081348567 /nfs/dbraw/zinc/34/85/67/1081348567.db2.gz DPWPYQGPJBWKLV-GOSISDBHSA-N 1 0 371.569 4.083 20 10 FICDRO Oc1ccccc1C[N@@H+](C[C@@H](O)Cc1cccc(Cl)c1)C1CCCC1 ZINC001167353145 1081591824 /nfs/dbraw/zinc/59/18/24/1081591824.db2.gz FZLQTQZGHSLEAA-FQEVSTJZSA-N 1 0 359.897 4.394 20 10 FICDRO COc1cc(C[N@H+](C)Cc2cc(C)c(C)cc2O)ccc1OC(F)F ZINC000022312060 1082096264 /nfs/dbraw/zinc/09/62/64/1082096264.db2.gz BATLZHGZLLQPTA-UHFFFAOYSA-N 1 0 351.393 4.251 20 10 FICDRO CCCOc1ccc(C)c(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001167437154 1082198742 /nfs/dbraw/zinc/19/87/42/1082198742.db2.gz NJBJLWDZQAJARU-UHFFFAOYSA-N 1 0 353.510 4.148 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CC(=O)Nc2cccnc2Cl)cc1 ZINC000178227887 1082996775 /nfs/dbraw/zinc/99/67/75/1082996775.db2.gz ASCPKKRDOGYIBF-HNNXBMFYSA-N 1 0 374.916 4.088 20 10 FICDRO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161068569 1083036373 /nfs/dbraw/zinc/03/63/73/1083036373.db2.gz QGBPHENRXYHINL-DLBZAZTESA-N 1 0 353.510 4.132 20 10 FICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000177252719 1083775505 /nfs/dbraw/zinc/77/55/05/1083775505.db2.gz VKYPOOGOLZIAGY-CQSZACIVSA-N 1 0 368.408 4.255 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)c2ccccc2)n1 ZINC000277152014 1083858587 /nfs/dbraw/zinc/85/85/87/1083858587.db2.gz QJNVTFRPUQPYQU-HNAYVOBHSA-N 1 0 351.450 4.335 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)c2ccccc2)n1 ZINC000277154000 1083859426 /nfs/dbraw/zinc/85/94/26/1083859426.db2.gz QJNVTFRPUQPYQU-KXBFYZLASA-N 1 0 351.450 4.335 20 10 FICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000725846059 1084038386 /nfs/dbraw/zinc/03/83/86/1084038386.db2.gz RRKBZVUZUQIOSH-UHFFFAOYSA-N 1 0 354.837 4.309 20 10 FICDRO CC[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccccc1O ZINC000157438469 1084383052 /nfs/dbraw/zinc/38/30/52/1084383052.db2.gz RRWOOAFQNHHREN-OAQYLSRUSA-N 1 0 354.494 4.160 20 10 FICDRO CCCCOc1ccc([C@H](C)[NH2+]Cc2cc3c(cc2O)OCO3)cc1OC ZINC000725849482 1084510065 /nfs/dbraw/zinc/51/00/65/1084510065.db2.gz JUOUEBMETSVDIK-AWEZNQCLSA-N 1 0 373.449 4.159 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cc(C)ccc1OC ZINC000093399359 1085777046 /nfs/dbraw/zinc/77/70/46/1085777046.db2.gz XBMSYHXQXKYQSR-FQEVSTJZSA-N 1 0 372.484 4.220 20 10 FICDRO Cc1cc(C(=O)N(C)CC2CC[NH+](C)CC2)c(C)n1-c1ccc(Cl)cc1 ZINC000728881847 1086586911 /nfs/dbraw/zinc/58/69/11/1086586911.db2.gz STSQUTCVWDGFRR-UHFFFAOYSA-N 1 0 373.928 4.161 20 10 FICDRO CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccc4ncccc4c3)c2)CC1 ZINC000162987527 1086614794 /nfs/dbraw/zinc/61/47/94/1086614794.db2.gz ZZZITSDHKAOZHC-UHFFFAOYSA-N 1 0 374.488 4.018 20 10 FICDRO CC[C@H]([NH2+]CCc1ccc(OC)c(OC)c1OC)c1ccc(N(C)C)cc1 ZINC000163032859 1086680313 /nfs/dbraw/zinc/68/03/13/1086680313.db2.gz HWJHQJOMUMNQGX-IBGZPJMESA-N 1 0 372.509 4.062 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CC[C@@H]3Cc3ccccc3)cc2)CC1 ZINC000828021386 1086812552 /nfs/dbraw/zinc/81/25/52/1086812552.db2.gz WHSFTBOGGSEUKW-JOCHJYFZSA-N 1 0 350.506 4.119 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(-n2nc(C)cc2C)nc1)c1ccc(N(C)C)cc1 ZINC000162804391 1088000234 /nfs/dbraw/zinc/00/02/34/1088000234.db2.gz XRPXGKJMXOEVMM-OAQYLSRUSA-N 1 0 363.509 4.191 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCc3c[nH]c4cccc(C)c34)CC2)cc1 ZINC000165244315 1088416936 /nfs/dbraw/zinc/41/69/36/1088416936.db2.gz AIUUTXYUURROLH-UHFFFAOYSA-N 1 0 363.505 4.286 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(-c3csc(C)n3)cc2)c(O)c1OC ZINC000892763700 1089021783 /nfs/dbraw/zinc/02/17/83/1089021783.db2.gz PLHAWDBRLMQGPN-UHFFFAOYSA-N 1 0 370.474 4.131 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2C[C@@H](C)CC[C@@H]2C)C1 ZINC001126429929 1089139960 /nfs/dbraw/zinc/13/99/60/1089139960.db2.gz YJZBCYDYCJSOAB-ROUUACIJSA-N 1 0 367.537 4.055 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000122753536 1090046072 /nfs/dbraw/zinc/04/60/72/1090046072.db2.gz LKMBYXGKLQHZKE-OAHLLOKOSA-N 1 0 369.900 4.146 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)[C@@H](C)C2 ZINC000180215118 1090172346 /nfs/dbraw/zinc/17/23/46/1090172346.db2.gz YTVJZILHPKDNGE-UUOWRZLLSA-N 1 0 364.533 4.227 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)c(OC)c1 ZINC000756433506 1090429058 /nfs/dbraw/zinc/42/90/58/1090429058.db2.gz OZTSYAXYDPLHAF-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1cc2c(cc1O)CCCC2 ZINC000184999313 1090494721 /nfs/dbraw/zinc/49/47/21/1090494721.db2.gz JFISVEOKWGEUNA-KRWDZBQOSA-N 1 0 361.489 4.367 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2cccc(Br)c2)c1 ZINC000756483148 1090504140 /nfs/dbraw/zinc/50/41/40/1090504140.db2.gz NSYQWLYKGBETAV-STQMWFEESA-N 1 0 364.283 4.445 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)c1cc(F)ccc1O ZINC000185429766 1090542537 /nfs/dbraw/zinc/54/25/37/1090542537.db2.gz SAEBGCFWVCMVRW-OAHLLOKOSA-N 1 0 359.441 4.078 20 10 FICDRO CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Br)c(F)cc2[O-])CC1 ZINC000756536462 1090961006 /nfs/dbraw/zinc/96/10/06/1090961006.db2.gz VXGKQFXULCIENJ-LBPRGKRZSA-N 1 0 373.310 4.066 20 10 FICDRO C[C@H](CC[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 ZINC000194265117 1091366733 /nfs/dbraw/zinc/36/67/33/1091366733.db2.gz FHZIGGCWPKWGBC-QGZVFWFLSA-N 1 0 356.485 4.070 20 10 FICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(CNC(=O)OC(C)(C)C)cc2)c1 ZINC000311311309 1091367213 /nfs/dbraw/zinc/36/72/13/1091367213.db2.gz YSPIXMJZAYULCS-UHFFFAOYSA-N 1 0 356.466 4.015 20 10 FICDRO CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000194857542 1091423592 /nfs/dbraw/zinc/42/35/92/1091423592.db2.gz ZQTIGWCUMXFSRE-HNNXBMFYSA-N 1 0 360.498 4.235 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000108092875 1092140182 /nfs/dbraw/zinc/14/01/82/1092140182.db2.gz NGVWTIBLPVNTCT-UHFFFAOYSA-N 1 0 364.411 4.426 20 10 FICDRO CCOc1cccc(C[NH2+]CCCO[C@H]2CCCc3ccccc32)c1O ZINC000236896461 1092764672 /nfs/dbraw/zinc/76/46/72/1092764672.db2.gz CLTUFIARMCRJHU-FQEVSTJZSA-N 1 0 355.478 4.365 20 10 FICDRO CCn1cc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c(-c2ccccc2)n1 ZINC001648951349 1093967923 /nfs/dbraw/zinc/96/79/23/1093967923.db2.gz SMBUBGKKUIUUSN-UHFFFAOYSA-N 1 0 360.505 4.242 20 10 FICDRO C[C@@H]([NH2+]C[C@H]1CCN(CC(F)(F)F)C1)c1ccc(N2CCCCC2)cc1 ZINC000163181846 1094322905 /nfs/dbraw/zinc/32/29/05/1094322905.db2.gz JBHUHNGJJIQQHZ-IAGOWNOFSA-N 1 0 369.475 4.212 20 10 FICDRO CCN1CC[C@H]([NH2+][C@@H](C)c2ccccc2O)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000783533700 1094419684 /nfs/dbraw/zinc/41/96/84/1094419684.db2.gz VJYTVWJGDUJJEN-JTBRQZTESA-N 1 0 364.411 4.296 20 10 FICDRO C[C@H]([NH2+]C1CCN(c2nccs2)CC1)c1ccc2ccccc2c1O ZINC000281118563 1095484794 /nfs/dbraw/zinc/48/47/94/1095484794.db2.gz ALCGKIVKCWBJCL-AWEZNQCLSA-N 1 0 353.491 4.322 20 10 FICDRO C[NH2+]CCc1ccccc1C(=O)N1CC2(CCCC2)c2c1cccc2F ZINC000423119816 1096578581 /nfs/dbraw/zinc/57/85/81/1096578581.db2.gz DUOSUDHTAWBFLQ-UHFFFAOYSA-N 1 0 352.453 4.060 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000237391603 1099462847 /nfs/dbraw/zinc/46/28/47/1099462847.db2.gz DTALWWFHHCPIRV-OAHLLOKOSA-N 1 0 364.411 4.393 20 10 FICDRO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000760406020 1101961466 /nfs/dbraw/zinc/96/14/66/1101961466.db2.gz DEYAOXYQRYXMNB-INIZCTEOSA-N 1 0 355.478 4.489 20 10 FICDRO Cc1ncc([C@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)s1 ZINC000127268141 1102724690 /nfs/dbraw/zinc/72/46/90/1102724690.db2.gz QGTQRKHPZIHNEO-LBPRGKRZSA-N 1 0 367.465 4.373 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(CO)C[C@H]1c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000760042075 1105056024 /nfs/dbraw/zinc/05/60/24/1105056024.db2.gz RNUIVTAGGDFOFC-BJLQDIEVSA-N 1 0 363.860 4.392 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c2ccccc2)n1 ZINC000760052151 1105218328 /nfs/dbraw/zinc/21/83/28/1105218328.db2.gz PZGQQRRUGZEHTO-ZLIFDBKOSA-N 1 0 367.424 4.345 20 10 FICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(N3CCCCCC3)nc2)c(Cl)c1 ZINC000840876680 1106992219 /nfs/dbraw/zinc/99/22/19/1106992219.db2.gz SHWMVSRFYIYSAI-UHFFFAOYSA-N 1 0 359.901 4.419 20 10 FICDRO CC[C@@H](Cc1ccccc1)[N@H+](CC)Cc1ccc(N2CCOCC2)cc1 ZINC001168073703 1107791500 /nfs/dbraw/zinc/79/15/00/1107791500.db2.gz NNJHUNPDJWECEC-QFIPXVFZSA-N 1 0 352.522 4.366 20 10 FICDRO COc1ccc(C(C)(C)[NH2+]Cc2cc(Br)ccc2O)cc1F ZINC000527782095 1109823256 /nfs/dbraw/zinc/82/32/56/1109823256.db2.gz SPNKHEPCSXKJRM-UHFFFAOYSA-N 1 0 368.246 4.327 20 10 FICDRO COc1cccc(C[NH2+][C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1O ZINC000527806514 1109832149 /nfs/dbraw/zinc/83/21/49/1109832149.db2.gz FYQQIJOKTXCWNH-MRXNPFEDSA-N 1 0 369.292 4.100 20 10 FICDRO COc1ccc([C@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C2CC2)cn1 ZINC000528044858 1109897577 /nfs/dbraw/zinc/89/75/77/1109897577.db2.gz VYHGFJRVHJLEPZ-RCDICMHDSA-N 1 0 352.478 4.477 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cccc(N2CCOCC2)c1 ZINC000479435096 1112021846 /nfs/dbraw/zinc/02/18/46/1112021846.db2.gz FFLXZCUPWFEVRQ-SFHVURJKSA-N 1 0 363.505 4.174 20 10 FICDRO COc1cc(NC(C)=O)ccc1[C@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479440803 1112023786 /nfs/dbraw/zinc/02/37/86/1112023786.db2.gz UVCZBJCMPNVWLW-HNNXBMFYSA-N 1 0 365.477 4.305 20 10 FICDRO CC[C@@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1O ZINC000155876301 1113927897 /nfs/dbraw/zinc/92/78/97/1113927897.db2.gz GCWSFTPOLLYZGP-GOEBONIOSA-N 1 0 362.420 4.313 20 10 FICDRO CC[C@@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1O ZINC000155876096 1113927919 /nfs/dbraw/zinc/92/79/19/1113927919.db2.gz GCWSFTPOLLYZGP-GDBMZVCRSA-N 1 0 362.420 4.313 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1N(C)C ZINC000163622269 1114241352 /nfs/dbraw/zinc/24/13/52/1114241352.db2.gz XPOMAVGPSXRIIA-INIZCTEOSA-N 1 0 373.541 4.296 20 10 FICDRO Clc1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151059869 1114287906 /nfs/dbraw/zinc/28/79/06/1114287906.db2.gz IKRYNSTXVQVFGJ-HXUWFJFHSA-N 1 0 372.896 4.180 20 10 FICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000164008763 1114414969 /nfs/dbraw/zinc/41/49/69/1114414969.db2.gz AKZFPEMDLPPFFU-OAHLLOKOSA-N 1 0 352.434 4.230 20 10 FICDRO C[C@H](CC[S@@](C)=O)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000760698596 1114599010 /nfs/dbraw/zinc/59/90/10/1114599010.db2.gz MLCXGBKWCOXTED-JBEBIEQOSA-N 1 0 353.572 4.234 20 10 FICDRO C[C@H]([NH2+]C[C@](C)(O)c1cccs1)c1ccc(N2CCCCC2)c(F)c1 ZINC000156890475 1114632126 /nfs/dbraw/zinc/63/21/26/1114632126.db2.gz LNENHTJKIKZDBL-YWZLYKJASA-N 1 0 362.514 4.436 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2ccccc2OCc2cccnc2)cc1F ZINC000058474637 1115232162 /nfs/dbraw/zinc/23/21/62/1115232162.db2.gz CZJVOFXRVVMCIT-UHFFFAOYSA-N 1 0 365.452 4.156 20 10 FICDRO CC(C)[NH+]1CCC(NC(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 ZINC000173378843 1116059447 /nfs/dbraw/zinc/05/94/47/1116059447.db2.gz QUTUBIYMBKYPTA-UHFFFAOYSA-N 1 0 373.541 4.109 20 10 FICDRO OC1CCN(c2ccc(C[NH2+][C@H]3CCCCc4ccccc43)cc2F)CC1 ZINC000151543274 1117913925 /nfs/dbraw/zinc/91/39/25/1117913925.db2.gz HGRHLIOSGOHWRL-QFIPXVFZSA-N 1 0 368.496 4.344 20 10 FICDRO CC(C)(C)OC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000312210817 1118295293 /nfs/dbraw/zinc/29/52/93/1118295293.db2.gz UXESGYXQXIYHIS-FQEVSTJZSA-N 1 0 373.541 4.166 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H]3CCCc4ccccc43)cc2)CC1 ZINC000151587998 1118939731 /nfs/dbraw/zinc/93/97/31/1118939731.db2.gz YZPYDDZKKYMSDX-HSZRJFAPSA-N 1 0 350.506 4.063 20 10 FICDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000152129969 1119116897 /nfs/dbraw/zinc/11/68/97/1119116897.db2.gz AMAVNYDLUBVLFD-HNNXBMFYSA-N 1 0 367.449 4.424 20 10 FICDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1cc(Br)ccc1O ZINC000761500061 1119400623 /nfs/dbraw/zinc/40/06/23/1119400623.db2.gz RRZGIWDRSNATIP-SJLPKXTDSA-N 1 0 364.283 4.237 20 10 FICDRO COc1ccc(OC)c(C[N@H+](Cc2c(O)ccc3ccncc32)C2CC2)c1 ZINC000914569906 1120374331 /nfs/dbraw/zinc/37/43/31/1120374331.db2.gz AXGIJTKWAXRHKX-UHFFFAOYSA-N 1 0 364.445 4.122 20 10 FICDRO COCc1ccccc1C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000914581715 1120390144 /nfs/dbraw/zinc/39/01/44/1120390144.db2.gz NZZJXFDBVARADB-UHFFFAOYSA-N 1 0 369.465 4.021 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(N2CCOCC2)c(F)c1 ZINC000153548922 1120912691 /nfs/dbraw/zinc/91/26/91/1120912691.db2.gz KMKHDEVTOHEOGP-KGLIPLIRSA-N 1 0 364.411 4.352 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc(Br)ncc1F ZINC000762762933 1120961116 /nfs/dbraw/zinc/96/11/16/1120961116.db2.gz TUXWERQOEUTMPG-GFCCVEGCSA-N 1 0 366.278 4.208 20 10 FICDRO CC(C)(C[NH2+]Cc1c(O)cccc1Br)c1ccc(F)cc1 ZINC001649101303 1121790883 /nfs/dbraw/zinc/79/08/83/1121790883.db2.gz HENDOGMVONENQO-UHFFFAOYSA-N 1 0 352.247 4.361 20 10 FICDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000916835128 1121876545 /nfs/dbraw/zinc/87/65/45/1121876545.db2.gz ASBHLPFKTYMIHW-GDBMZVCRSA-N 1 0 356.432 4.210 20 10 FICDRO COc1ccc([C@@H]2C[C@H]([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168610172 1121973989 /nfs/dbraw/zinc/97/39/89/1121973989.db2.gz RHVWMRJBOZDCER-NBCNXNJRSA-N 1 0 354.494 4.332 20 10 FICDRO CCOc1ccccc1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074913 1122069165 /nfs/dbraw/zinc/06/91/65/1122069165.db2.gz LBDYAXVTQKYSJG-UHFFFAOYSA-N 1 0 369.509 4.000 20 10 FICDRO Cc1ccc(C)c(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075417 1122070445 /nfs/dbraw/zinc/07/04/45/1122070445.db2.gz VMXWXSIVJPVOBA-UHFFFAOYSA-N 1 0 353.510 4.219 20 10 FICDRO CC(C)[N@H+](Cc1nnc(-c2ccccc2)o1)Cc1ccc(N(C)C)cc1 ZINC000917075552 1122070894 /nfs/dbraw/zinc/07/08/94/1122070894.db2.gz ZQZJNVLMYLTBMJ-UHFFFAOYSA-N 1 0 350.466 4.213 20 10 FICDRO Cc1ccc(C)n1-c1ccc(C(=O)NC2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000917493106 1122335843 /nfs/dbraw/zinc/33/58/43/1122335843.db2.gz XCATTZPCFQXJAH-UHFFFAOYSA-N 1 0 353.510 4.087 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583090 1122714141 /nfs/dbraw/zinc/71/41/41/1122714141.db2.gz VCDDJEBSDMJSOH-WOJBJXKFSA-N 1 0 371.912 4.104 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)C2)c(C)n1-c1cccc(C)c1 ZINC000918696163 1122757792 /nfs/dbraw/zinc/75/77/92/1122757792.db2.gz MSTYYIGBNALWRS-OAQYLSRUSA-N 1 0 365.521 4.103 20 10 FICDRO CCCc1ccc(C[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1 ZINC000920182579 1123399619 /nfs/dbraw/zinc/39/96/19/1123399619.db2.gz TVOVGDFKYAWGTD-UHFFFAOYSA-N 1 0 352.522 4.138 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Br)ccc2O)c(OC)c1 ZINC000237248597 1123609377 /nfs/dbraw/zinc/60/93/77/1123609377.db2.gz XMUYFFSMWBMNDD-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO CCOc1cc(C[N@H+](C)Cc2cc(OC)ccc2O)ccc1OC(F)F ZINC000179680533 1124028359 /nfs/dbraw/zinc/02/83/59/1124028359.db2.gz HHLOWJIMRJRXCG-UHFFFAOYSA-N 1 0 367.392 4.033 20 10 FICDRO Cc1cccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)c1O ZINC000179847275 1124119231 /nfs/dbraw/zinc/11/92/31/1124119231.db2.gz PQDMDXCRMKWENT-JWTNVVGKSA-N 1 0 360.498 4.063 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 ZINC000068478635 1124253261 /nfs/dbraw/zinc/25/32/61/1124253261.db2.gz JWPSVARXZRKGDP-OAHLLOKOSA-N 1 0 364.411 4.393 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)[C@H](C)C2 ZINC000180215087 1124265694 /nfs/dbraw/zinc/26/56/94/1124265694.db2.gz YTVJZILHPKDNGE-KOSHJBKYSA-N 1 0 364.533 4.227 20 10 FICDRO Cc1ccccc1[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)C(C)(C)C ZINC001168656454 1124528872 /nfs/dbraw/zinc/52/88/72/1124528872.db2.gz BZNHWBJUUVIQST-JOCHJYFZSA-N 1 0 367.537 4.054 20 10 FICDRO COc1cccc(C[N@@H+]2CCc3sc(-c4csc(C)n4)cc3C2)c1O ZINC000181570382 1125025997 /nfs/dbraw/zinc/02/59/97/1125025997.db2.gz GRIHPKDFJWBOSF-UHFFFAOYSA-N 1 0 372.515 4.453 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OCC(F)(F)F)c1 ZINC000182449655 1125500814 /nfs/dbraw/zinc/50/08/14/1125500814.db2.gz SXDBPSYAGXTRAO-LBPRGKRZSA-N 1 0 355.356 4.193 20 10 FICDRO CC(C)(C)OC(=O)NC[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000382416786 1125575708 /nfs/dbraw/zinc/57/57/08/1125575708.db2.gz HTEXUXZQTOTMEM-OALUTQOASA-N 1 0 373.541 4.070 20 10 FICDRO C[C@@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000183161961 1125763020 /nfs/dbraw/zinc/76/30/20/1125763020.db2.gz KJRNIXCERZIBCR-HRAATJIYSA-N 1 0 367.445 4.166 20 10 FICDRO C[N@@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)CC1CCOCC1 ZINC000255032840 1080442102 /nfs/dbraw/zinc/44/21/02/1080442102.db2.gz IQGNTROUNGKLKH-UHFFFAOYSA-N 1 0 366.465 4.399 20 10 FICDRO COc1ncc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c2ccccc21 ZINC001167107673 1080552567 /nfs/dbraw/zinc/55/25/67/1080552567.db2.gz GCDOSNWPDYGHBC-UHFFFAOYSA-N 1 0 361.489 4.474 20 10 FICDRO COc1ccc(N2CCC[N@@H+](C[C@H](OC)c3ccc(Cl)cc3)CC2)cc1 ZINC001167107604 1080552580 /nfs/dbraw/zinc/55/25/80/1080552580.db2.gz FFOTWANEPSHKAV-NRFANRHFSA-N 1 0 374.912 4.248 20 10 FICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000155245564 1080740258 /nfs/dbraw/zinc/74/02/58/1080740258.db2.gz HHABYHQHPLAZCK-VWLOTQADSA-N 1 0 356.535 4.046 20 10 FICDRO C[C@@H]1CN(c2ccc(C[NH2+]Cc3cc(F)cc(F)c3)cc2F)C[C@@H](C)O1 ZINC001648835420 1081277042 /nfs/dbraw/zinc/27/70/42/1081277042.db2.gz NSHVTPYPXASZSM-ZIAGYGMSSA-N 1 0 364.411 4.007 20 10 FICDRO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000048747232 1081835473 /nfs/dbraw/zinc/83/54/73/1081835473.db2.gz UACMZHALDQYITD-QGZVFWFLSA-N 1 0 350.462 4.429 20 10 FICDRO CCCC[C@H](CC)C[NH+]1CC2(CN(Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279107505 1081853115 /nfs/dbraw/zinc/85/31/15/1081853115.db2.gz PODACJCPTJEISO-HNNXBMFYSA-N 1 0 352.469 4.004 20 10 FICDRO COc1cc(Cl)cc(C)c1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167431403 1082096128 /nfs/dbraw/zinc/09/61/28/1082096128.db2.gz XXADOAHVDWWIJI-UHFFFAOYSA-N 1 0 359.901 4.021 20 10 FICDRO CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)O[C@@H](CC)C(=O)N2)c1ccccc1O ZINC000156160853 1082485487 /nfs/dbraw/zinc/48/54/87/1082485487.db2.gz REVYAEKLYJILNV-AZOIQLNYSA-N 1 0 354.450 4.304 20 10 FICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC001167567736 1084917914 /nfs/dbraw/zinc/91/79/14/1084917914.db2.gz JNBRXFQTUKNWPL-QHCPKHFHSA-N 1 0 352.522 4.366 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)cc1F ZINC000158708844 1085004972 /nfs/dbraw/zinc/00/49/72/1085004972.db2.gz ITYOAIOKVATVTO-SGANQWHYSA-N 1 0 362.514 4.260 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)cc1O ZINC000178408024 1085462262 /nfs/dbraw/zinc/46/22/62/1085462262.db2.gz QEPMUFSDHIBQBK-HNNXBMFYSA-N 1 0 358.457 4.381 20 10 FICDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000121945651 1085787783 /nfs/dbraw/zinc/78/77/83/1085787783.db2.gz JQNKEQKFXNQUOL-HUUCEWRRSA-N 1 0 354.922 4.031 20 10 FICDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)cn1 ZINC000278976965 1086733937 /nfs/dbraw/zinc/73/39/37/1086733937.db2.gz CQYZEILJCPVYBP-KRWDZBQOSA-N 1 0 366.509 4.271 20 10 FICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000728594792 1087587712 /nfs/dbraw/zinc/58/77/12/1087587712.db2.gz BRVANEOOTWWJOR-UHFFFAOYSA-N 1 0 356.485 4.038 20 10 FICDRO C[C@@H](c1ccccc1)[N@H+](CC(=O)N1CCC[C@H](C)C1)Cc1ccccc1O ZINC000255953824 1088241567 /nfs/dbraw/zinc/24/15/67/1088241567.db2.gz ULFVBFAICOZRQD-OALUTQOASA-N 1 0 366.505 4.214 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O ZINC000311295556 1088535344 /nfs/dbraw/zinc/53/53/44/1088535344.db2.gz COYJSILFMIDZMV-LAUBAEHRSA-N 1 0 362.514 4.470 20 10 FICDRO C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000283383329 1089523600 /nfs/dbraw/zinc/52/36/00/1089523600.db2.gz KEMPBWHIVYTTIE-NSHGMRRFSA-N 1 0 366.505 4.212 20 10 FICDRO Cc1ccc(CNC(=O)c2cccc(C[NH2+][C@H](C)c3ccccc3O)c2)cc1 ZINC000183423357 1090413857 /nfs/dbraw/zinc/41/38/57/1090413857.db2.gz UJWRYCOCMWCBQR-GOSISDBHSA-N 1 0 374.484 4.481 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)cc1 ZINC000312204505 1090428403 /nfs/dbraw/zinc/42/84/03/1090428403.db2.gz IZJAWUCLZOAVFT-GOSISDBHSA-N 1 0 373.541 4.164 20 10 FICDRO C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000367436628 1090460114 /nfs/dbraw/zinc/46/01/14/1090460114.db2.gz GQOXKDAJYIPYKS-INIZCTEOSA-N 1 0 356.489 4.200 20 10 FICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000162358481 1090739537 /nfs/dbraw/zinc/73/95/37/1090739537.db2.gz LYKNEYCBTGUIGJ-ROUUACIJSA-N 1 0 354.494 4.252 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cc(C)ccc3OC)CC2)cc1 ZINC000162377002 1090787853 /nfs/dbraw/zinc/78/78/53/1090787853.db2.gz LZJVDXBSZAQKKY-KRWDZBQOSA-N 1 0 354.494 4.332 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)c1O ZINC000728774497 1090855688 /nfs/dbraw/zinc/85/56/88/1090855688.db2.gz IUBKCOYXMRTUNJ-UHFFFAOYSA-N 1 0 367.420 4.409 20 10 FICDRO COC[C@@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 ZINC000194016819 1091342419 /nfs/dbraw/zinc/34/24/19/1091342419.db2.gz CRHNTTUXLCMBCI-OAQYLSRUSA-N 1 0 374.912 4.295 20 10 FICDRO COc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000194856257 1091423841 /nfs/dbraw/zinc/42/38/41/1091423841.db2.gz CHNQIFQRCCVBHN-OAQYLSRUSA-N 1 0 368.546 4.416 20 10 FICDRO CSc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000178592031 1092108945 /nfs/dbraw/zinc/10/89/45/1092108945.db2.gz JKXDGJCLTRTDLN-HNNXBMFYSA-N 1 0 360.498 4.235 20 10 FICDRO C[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000178643596 1092942150 /nfs/dbraw/zinc/94/21/50/1092942150.db2.gz YONSXOGLESLNBT-UGKGYDQZSA-N 1 0 352.522 4.494 20 10 FICDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178728005 1093262120 /nfs/dbraw/zinc/26/21/20/1093262120.db2.gz KRIFIPYZAVEQMD-INIZCTEOSA-N 1 0 369.465 4.445 20 10 FICDRO CCOc1cccc(C[NH2+]C2(c3ccc4c(c3)OCCO4)CCCC2)c1O ZINC000236991227 1093307900 /nfs/dbraw/zinc/30/79/00/1093307900.db2.gz UCYKWCLLCIBQIE-UHFFFAOYSA-N 1 0 369.461 4.121 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000237262640 1093485246 /nfs/dbraw/zinc/48/52/46/1093485246.db2.gz HTPIDLCNTDHLKV-UHFFFAOYSA-N 1 0 364.411 4.473 20 10 FICDRO CCc1nc(C)c(C[NH2+][C@H](CC)c2cc(Br)ccc2O)o1 ZINC000291883532 1093896545 /nfs/dbraw/zinc/89/65/45/1093896545.db2.gz JTBHETIMVKZJMB-CYBMUJFWSA-N 1 0 353.260 4.254 20 10 FICDRO CCc1nc(C)c(C[NH2+][C@@H](CC)c2cc(Br)ccc2O)o1 ZINC000291883536 1093898175 /nfs/dbraw/zinc/89/81/75/1093898175.db2.gz JTBHETIMVKZJMB-ZDUSSCGKSA-N 1 0 353.260 4.254 20 10 FICDRO CC[C@@H]([NH2+][C@H](Cc1nc(C)no1)c1ccccc1)c1ccc(C)cc1O ZINC000280012996 1094282220 /nfs/dbraw/zinc/28/22/20/1094282220.db2.gz GTLRAYSFQMHIOM-RTBURBONSA-N 1 0 351.450 4.417 20 10 FICDRO CC[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000280267538 1094317056 /nfs/dbraw/zinc/31/70/56/1094317056.db2.gz XRADIZKBSVYULR-TZIWHRDSSA-N 1 0 353.441 4.404 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)CC(C)(C)C1)c1ccccc1O ZINC000710386274 1094772278 /nfs/dbraw/zinc/77/22/78/1094772278.db2.gz SWTTZYKWLWNBFI-JKSUJKDBSA-N 1 0 362.514 4.469 20 10 FICDRO C[NH2+]C1CCN(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CC1 ZINC000237142540 1095177331 /nfs/dbraw/zinc/17/73/31/1095177331.db2.gz UZOMSZCLFHLRMU-UHFFFAOYSA-N 1 0 353.510 4.042 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)N3CCCCC3)cc2)c(O)c1C ZINC000273357083 1096254285 /nfs/dbraw/zinc/25/42/85/1096254285.db2.gz CYOXPQSBCHVYFL-SFHVURJKSA-N 1 0 366.505 4.486 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c(O)c1C ZINC000273371044 1096256411 /nfs/dbraw/zinc/25/64/11/1096256411.db2.gz GGDUSGJJVVKLCY-SFHVURJKSA-N 1 0 368.521 4.069 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(N3CCOC3=O)c2)c(O)c1C ZINC000273422131 1096261024 /nfs/dbraw/zinc/26/10/24/1096261024.db2.gz SMJQGTHCLBQDAX-JKSUJKDBSA-N 1 0 354.450 4.377 20 10 FICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(Br)cc1O)c1ccco1 ZINC000273432563 1096261426 /nfs/dbraw/zinc/26/14/26/1096261426.db2.gz LJDLEKWDEQDLCC-BXUZGUMPSA-N 1 0 354.244 4.176 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)c1O ZINC000237397909 1099473704 /nfs/dbraw/zinc/47/37/04/1099473704.db2.gz GDIGJAJIVMILCS-UHFFFAOYSA-N 1 0 367.420 4.409 20 10 FICDRO C[C@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000163470025 1099568698 /nfs/dbraw/zinc/56/86/98/1099568698.db2.gz ITSLLZNODGMLDZ-HKUYNNGSSA-N 1 0 364.505 4.052 20 10 FICDRO C[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000163470346 1099569027 /nfs/dbraw/zinc/56/90/27/1099569027.db2.gz ITSLLZNODGMLDZ-IEBWSBKVSA-N 1 0 364.505 4.052 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)nc2-n2cc(Cl)cn2)c1 ZINC000191531201 1101947659 /nfs/dbraw/zinc/94/76/59/1101947659.db2.gz HFQPATLGBWVQBO-AWEZNQCLSA-N 1 0 356.857 4.094 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 ZINC000127537513 1102730842 /nfs/dbraw/zinc/73/08/42/1102730842.db2.gz YTDMMBFIKFLLSL-AZUAARDMSA-N 1 0 358.526 4.056 20 10 FICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000729850997 1102780280 /nfs/dbraw/zinc/78/02/80/1102780280.db2.gz DVUDQKZQENFRGB-FQEVSTJZSA-N 1 0 355.478 4.359 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(CO)C[C@@H]1c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000760039973 1105016330 /nfs/dbraw/zinc/01/63/30/1105016330.db2.gz HRBXQSOOFSWUQW-BHIFYINESA-N 1 0 356.485 4.099 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c(O)c1 ZINC000760041108 1105036166 /nfs/dbraw/zinc/03/61/66/1105036166.db2.gz VUTMBKNEXVRWJM-SSKFGXFMSA-N 1 0 357.469 4.264 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3C[C@H]3c3cccc(OC)c3)CC2)cc1 ZINC000840888443 1107666336 /nfs/dbraw/zinc/66/63/36/1107666336.db2.gz KKULOQWIKMHYMX-MBSDFSHPSA-N 1 0 366.505 4.066 20 10 FICDRO Oc1cccc2c1[C@H]([NH+]1CCC(Cc3nc(C4CCCC4)no3)CC1)CC2 ZINC000527939775 1109863580 /nfs/dbraw/zinc/86/35/80/1109863580.db2.gz SCHSUFRQNSWQIC-GOSISDBHSA-N 1 0 367.493 4.375 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Br)ccc1O ZINC000528034675 1109889125 /nfs/dbraw/zinc/88/91/25/1109889125.db2.gz ATRXRVMOYRYGLP-IINYFYTJSA-N 1 0 353.235 4.491 20 10 FICDRO C[C@@H]([NH2+]C[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1O ZINC000697901621 1112446939 /nfs/dbraw/zinc/44/69/39/1112446939.db2.gz UXNHJWLXZNCWOD-HUUCEWRRSA-N 1 0 358.482 4.357 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)c(OC)c1 ZINC000163624414 1114237385 /nfs/dbraw/zinc/23/73/85/1114237385.db2.gz QTLXJPAXUKFIEW-MRXNPFEDSA-N 1 0 372.534 4.108 20 10 FICDRO Clc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151059827 1114287776 /nfs/dbraw/zinc/28/77/76/1114287776.db2.gz IKRYNSTXVQVFGJ-FQEVSTJZSA-N 1 0 372.896 4.180 20 10 FICDRO CC[C@@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000151118067 1114297837 /nfs/dbraw/zinc/29/78/37/1114297837.db2.gz HVXQOQIURDJIIJ-QGZVFWFLSA-N 1 0 367.415 4.330 20 10 FICDRO Cc1cc(CNCc2ccc3c(c2)CCO3)c(Br)cc1F ZINC001649009835 1114308312 /nfs/dbraw/zinc/30/83/12/1114308312.db2.gz KWSROISRNNPWNX-UHFFFAOYSA-N 1 0 350.231 4.121 20 10 FICDRO COc1cc(C)cc(C[NH+]2CCC(Oc3ccc(F)cc3F)CC2)c1O ZINC000164133665 1114436338 /nfs/dbraw/zinc/43/63/38/1114436338.db2.gz IWCMDHKRPXLPGT-UHFFFAOYSA-N 1 0 363.404 4.031 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000156807761 1114595007 /nfs/dbraw/zinc/59/50/07/1114595007.db2.gz VBJMYCMJHHKAKB-IRXDYDNUSA-N 1 0 351.494 4.291 20 10 FICDRO C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCC2)c(F)c1 ZINC000166572779 1115037521 /nfs/dbraw/zinc/03/75/21/1115037521.db2.gz MYOLOSTVDRBPFU-KBJGYGKASA-N 1 0 354.469 4.125 20 10 FICDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000157416928 1115103431 /nfs/dbraw/zinc/10/34/31/1115103431.db2.gz DMQXTXSXELFHOU-ZWKOTPCHSA-N 1 0 368.521 4.454 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)[C@]12CCCO2 ZINC000760882481 1115121797 /nfs/dbraw/zinc/12/17/97/1115121797.db2.gz XENWNYNZAYHCHM-YJSIEXFISA-N 1 0 372.553 4.444 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000226036702 1115272255 /nfs/dbraw/zinc/27/22/55/1115272255.db2.gz CAJVROQVBNNRSP-AWEZNQCLSA-N 1 0 350.281 4.481 20 10 FICDRO COc1cc2c(cc1C[N@H+](Cc1ccccc1O)C1CCCC1)OCO2 ZINC000761197222 1115614766 /nfs/dbraw/zinc/61/47/66/1115614766.db2.gz BJGVDFKEEVFZRJ-UHFFFAOYSA-N 1 0 355.434 4.074 20 10 FICDRO COCCCC[N@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761195238 1115617120 /nfs/dbraw/zinc/61/71/20/1115617120.db2.gz KZKZFKDVXGAMCW-UHFFFAOYSA-N 1 0 363.885 4.483 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](O)c2c(F)cccc2Cl)c1O ZINC000761206473 1115622164 /nfs/dbraw/zinc/62/21/64/1115622164.db2.gz HTLSCRFMSJZCAR-JDNHERCYSA-N 1 0 374.239 4.058 20 10 FICDRO Oc1ccccc1C[NH+]1CCC(Oc2cccc(Br)c2)CC1 ZINC000761224968 1115670512 /nfs/dbraw/zinc/67/05/12/1115670512.db2.gz DFNLORCWXFMNAM-UHFFFAOYSA-N 1 0 362.267 4.198 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2cccc(Cl)c2)SC1=S ZINC000170738295 1115765889 /nfs/dbraw/zinc/76/58/89/1115765889.db2.gz AZYSQNHRGUWTOG-ZROIWOOFSA-N 1 0 368.955 4.129 20 10 FICDRO CC[C@H]([NH2+]C[C@@H]1CSCCS1)c1cc(Br)ccc1O ZINC000229583408 1115857570 /nfs/dbraw/zinc/85/75/70/1115857570.db2.gz GITVQIIJEJGGFF-YPMHNXCESA-N 1 0 362.358 4.044 20 10 FICDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 ZINC000761433245 1118059486 /nfs/dbraw/zinc/05/94/86/1118059486.db2.gz SXBCJJRSXKNFAF-MCIONIFRSA-N 1 0 363.502 4.055 20 10 FICDRO C[C@H]([NH2+]CCCNC(=O)C1CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000090185489 1118619605 /nfs/dbraw/zinc/61/96/05/1118619605.db2.gz VZOBPNNYJIDOGW-SFHVURJKSA-N 1 0 357.542 4.024 20 10 FICDRO CC1(C)Cc2occc2[C@@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)C1 ZINC000151570895 1118787342 /nfs/dbraw/zinc/78/73/42/1118787342.db2.gz UAFXLGRVFMDHMD-NRFANRHFSA-N 1 0 368.521 4.292 20 10 FICDRO CCC(=O)N1CC[C@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000761989621 1120635114 /nfs/dbraw/zinc/63/51/14/1120635114.db2.gz PVVZNBJVWJGRFI-KRWDZBQOSA-N 1 0 360.542 4.088 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1cc(Cl)ccc1O ZINC000762641290 1120942734 /nfs/dbraw/zinc/94/27/34/1120942734.db2.gz HAXYQOQHXOWMBY-DVOMOZLQSA-N 1 0 368.905 4.342 20 10 FICDRO Cc1ccc(O)c(C[NH2+]C(C)(C)[C@H](O)c2ccc(Br)cc2)c1 ZINC000762788903 1120962997 /nfs/dbraw/zinc/96/29/97/1120962997.db2.gz ZBPPTXXGCQJHKZ-QGZVFWFLSA-N 1 0 364.283 4.065 20 10 FICDRO CCN(CC)C(=O)C1([NH2+]Cc2c(O)ccc3ccccc32)CCCCC1 ZINC000763336965 1121339481 /nfs/dbraw/zinc/33/94/81/1121339481.db2.gz AJXOAOPRAWMQNM-UHFFFAOYSA-N 1 0 354.494 4.206 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H]3CCc4ccc(Cl)cc43)cc2)CC1 ZINC000763395267 1121571613 /nfs/dbraw/zinc/57/16/13/1121571613.db2.gz LBSYDGQJPAKVMD-QFIPXVFZSA-N 1 0 370.924 4.326 20 10 FICDRO C[C@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)NC(=O)OC(C)(C)C ZINC000785441099 1121603411 /nfs/dbraw/zinc/60/34/11/1121603411.db2.gz YQTVBESZQFQGLT-QGZVFWFLSA-N 1 0 361.530 4.022 20 10 FICDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000916835129 1121877535 /nfs/dbraw/zinc/87/75/35/1121877535.db2.gz ASBHLPFKTYMIHW-GOEBONIOSA-N 1 0 356.432 4.210 20 10 FICDRO C[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765800061 1122020846 /nfs/dbraw/zinc/02/08/46/1122020846.db2.gz MIQZZIHHGRSFSL-YLJYHZDGSA-N 1 0 356.485 4.070 20 10 FICDRO C[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765800055 1122021143 /nfs/dbraw/zinc/02/11/43/1122021143.db2.gz MIQZZIHHGRSFSL-PXNSSMCTSA-N 1 0 356.485 4.070 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](OC(C)C)c2ccccc2OC)c1 ZINC000186384057 1122077422 /nfs/dbraw/zinc/07/74/22/1122077422.db2.gz YEHMYBFEUZILBM-QVKFZJNVSA-N 1 0 359.466 4.226 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccccc2N2CCO[C@@H](C)C2)cc1 ZINC000917434980 1122313354 /nfs/dbraw/zinc/31/33/54/1122313354.db2.gz FSYQIHRDSXBCMW-IBGZPJMESA-N 1 0 367.537 4.048 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCc2c1cc(F)cc2F)c1ccc(N2CCOCC2)cc1 ZINC000154636966 1122544352 /nfs/dbraw/zinc/54/43/52/1122544352.db2.gz DQMSYIUBIWQOPL-LHSJRXKWSA-N 1 0 358.432 4.140 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000918357011 1122623206 /nfs/dbraw/zinc/62/32/06/1122623206.db2.gz LLOKLMQIKIGJSH-UHFFFAOYSA-N 1 0 359.539 4.148 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(CC(=O)NC3CCCC3)CC2)cc1C(C)C ZINC000920086701 1123345619 /nfs/dbraw/zinc/34/56/19/1123345619.db2.gz LIYDDPHOZRATNR-UHFFFAOYSA-N 1 0 372.553 4.485 20 10 FICDRO c1ccc([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000920183788 1123399233 /nfs/dbraw/zinc/39/92/33/1123399233.db2.gz XPWVKQFLPMPPQQ-XZOQPEGZSA-N 1 0 350.506 4.339 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3ccc4c(c3)CC(C)(C)O4)CC2)cc1 ZINC000237575262 1123987430 /nfs/dbraw/zinc/98/74/30/1123987430.db2.gz CFAXCJKJOIGNFO-UHFFFAOYSA-N 1 0 366.505 4.167 20 10 FICDRO Fc1ccc(C2([NH2+]Cc3ccc(N4CCOCC4)c(F)c3)CCCC2)cc1 ZINC000237829649 1124116844 /nfs/dbraw/zinc/11/68/44/1124116844.db2.gz OUBKKMQEWIZMTI-UHFFFAOYSA-N 1 0 372.459 4.361 20 10 FICDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000237835639 1124126268 /nfs/dbraw/zinc/12/62/68/1124126268.db2.gz BNQSMNWLNPWAMZ-LJQANCHMSA-N 1 0 372.484 4.367 20 10 FICDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(Cl)cc(C(C)=O)c1O ZINC000179937149 1124147611 /nfs/dbraw/zinc/14/76/11/1124147611.db2.gz HZOHLWFWGHCSME-JTQLQIEISA-N 1 0 351.805 4.247 20 10 FICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000179993616 1124186944 /nfs/dbraw/zinc/18/69/44/1124186944.db2.gz ZDKWMQGOWSUXQI-KRWDZBQOSA-N 1 0 371.500 4.205 20 10 FICDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000765902713 1124353411 /nfs/dbraw/zinc/35/34/11/1124353411.db2.gz DKXATNBOEGFHLU-APWZRJJASA-N 1 0 354.469 4.043 20 10 FICDRO C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cc(F)ccc1O ZINC000180782860 1124435829 /nfs/dbraw/zinc/43/58/29/1124435829.db2.gz VEMHIFFIGPYXKI-UHFFFAOYSA-N 1 0 354.425 4.046 20 10 FICDRO COc1ccc([C@H]2C[C@@H]([N@H+](C)Cc3ccc(N(C)C)cc3)CCO2)cc1 ZINC001168671200 1124712041 /nfs/dbraw/zinc/71/20/41/1124712041.db2.gz LXHNRUMGLBSNAS-RBBKRZOGSA-N 1 0 354.494 4.113 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3cccc(C(C)(C)C)c3)c2)CC1 ZINC001128313113 1125274310 /nfs/dbraw/zinc/27/43/10/1125274310.db2.gz LZTIFVIGLNSDCL-UHFFFAOYSA-N 1 0 365.521 4.378 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(-n3nc(C)cc3C)cc2)c1 ZINC000182376192 1125439612 /nfs/dbraw/zinc/43/96/12/1125439612.db2.gz QSHPNNKBNANZTC-INIZCTEOSA-N 1 0 351.450 4.054 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc3cc(C(F)(F)F)ccc3o2)c1 ZINC000182467552 1125517645 /nfs/dbraw/zinc/51/76/45/1125517645.db2.gz YMDNYRNCUZKANE-JTQLQIEISA-N 1 0 366.339 4.412 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc3cc(C(F)(F)F)ccc3o2)c1 ZINC000182467576 1125517803 /nfs/dbraw/zinc/51/78/03/1125517803.db2.gz YMDNYRNCUZKANE-SNVBAGLBSA-N 1 0 366.339 4.412 20 10 FICDRO Cc1ncc(C[N@@H+](C)Cc2ccc(OCc3ccccc3)cc2O)s1 ZINC000183009608 1125717502 /nfs/dbraw/zinc/71/75/02/1125717502.db2.gz ZTIMOQWLIOQVEX-UHFFFAOYSA-N 1 0 354.475 4.368 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1c[nH]nc1-c1cccs1)C[C@@H]1CCCO1 ZINC000160178242 1079547929 /nfs/dbraw/zinc/54/79/29/1079547929.db2.gz UISAYVIOLHFXFN-KRWDZBQOSA-N 1 0 369.490 4.025 20 10 FICDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648821991 1081249435 /nfs/dbraw/zinc/24/94/35/1081249435.db2.gz LHZJKSLCRYHGFN-OAQYLSRUSA-N 1 0 368.521 4.352 20 10 FICDRO CCCC[C@@H](CC)C[NH+]1CC2(CN(Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279107510 1081850289 /nfs/dbraw/zinc/85/02/89/1081850289.db2.gz PODACJCPTJEISO-OAHLLOKOSA-N 1 0 352.469 4.004 20 10 FICDRO CCCNC(=O)c1cccc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)c1 ZINC000160601698 1082090471 /nfs/dbraw/zinc/09/04/71/1082090471.db2.gz DZDOBCYKTOWGKE-NRFANRHFSA-N 1 0 353.510 4.133 20 10 FICDRO Cc1ccc(Br)cc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167431398 1082095939 /nfs/dbraw/zinc/09/59/39/1082095939.db2.gz XTUMMCPDSYQNSQ-UHFFFAOYSA-N 1 0 374.326 4.121 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc(Oc4ccccc4)nc3)cc2)CC1 ZINC001167434483 1082136148 /nfs/dbraw/zinc/13/61/48/1082136148.db2.gz MCUBGCIGFGRKJG-UHFFFAOYSA-N 1 0 374.488 4.238 20 10 FICDRO c1coc(CN(Cc2cccs2)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000160657404 1082180099 /nfs/dbraw/zinc/18/00/99/1082180099.db2.gz ZSXNOWKHTHRFJC-UHFFFAOYSA-N 1 0 368.502 4.380 20 10 FICDRO CC[C@@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000160721654 1082274114 /nfs/dbraw/zinc/27/41/14/1082274114.db2.gz ZHIYLXPVRKTBNX-YADHBBJMSA-N 1 0 365.521 4.157 20 10 FICDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000834844780 1082542403 /nfs/dbraw/zinc/54/24/03/1082542403.db2.gz UWLYUSLEMTYBID-ONGXEEELSA-N 1 0 370.209 4.163 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000178082926 1082719642 /nfs/dbraw/zinc/71/96/42/1082719642.db2.gz LYMAHWZTQLTWES-ZHRRBRCNSA-N 1 0 372.484 4.209 20 10 FICDRO CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc(OC)c(OC)c3O)oc21 ZINC000892475965 1083596094 /nfs/dbraw/zinc/59/60/94/1083596094.db2.gz MYCNQFSTQDQPKH-ZDUSSCGKSA-N 1 0 371.433 4.405 20 10 FICDRO CCOCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000167142849 1083633059 /nfs/dbraw/zinc/63/30/59/1083633059.db2.gz LDWFUPOZJPQXSS-SFHVURJKSA-N 1 0 356.510 4.327 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(NC(=O)C3CCCCC3)CC2)cc1C(C)C ZINC000065943886 1083844530 /nfs/dbraw/zinc/84/45/30/1083844530.db2.gz PKIOPDXMANSROW-UHFFFAOYSA-N 1 0 372.553 4.485 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)cc1F ZINC000158709070 1085004052 /nfs/dbraw/zinc/00/40/52/1085004052.db2.gz ITYOAIOKVATVTO-BZQUYTCOSA-N 1 0 362.514 4.260 20 10 FICDRO CC(C)(C)OC(=O)NCc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000313254415 1085304553 /nfs/dbraw/zinc/30/45/53/1085304553.db2.gz XXLHENUELNDKBD-SFHVURJKSA-N 1 0 368.477 4.194 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000136742101 1086350852 /nfs/dbraw/zinc/35/08/52/1086350852.db2.gz MYAVQLMXVRACET-OAHLLOKOSA-N 1 0 354.288 4.126 20 10 FICDRO [O-]c1c(Br)cc(Cl)cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC001141373102 1086452470 /nfs/dbraw/zinc/45/24/70/1086452470.db2.gz NFOAGJQQEATBLB-LBPRGKRZSA-N 1 0 352.606 4.039 20 10 FICDRO Cc1cc(NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2[nH+]1 ZINC000052446668 1086820898 /nfs/dbraw/zinc/82/08/98/1086820898.db2.gz KIRVAMRAIYNHHD-UHFFFAOYSA-N 1 0 361.489 4.364 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2cc(Cl)cs2)SC1=S ZINC000588600937 1087368362 /nfs/dbraw/zinc/36/83/62/1087368362.db2.gz SFFNLQWANHTLNX-WUXMJOGZSA-N 1 0 374.984 4.191 20 10 FICDRO COc1ccc([C@H](C)CC[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000166090164 1088526343 /nfs/dbraw/zinc/52/63/43/1088526343.db2.gz YISUGPLOFHNJFV-GOSISDBHSA-N 1 0 368.521 4.456 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000311291688 1088530051 /nfs/dbraw/zinc/53/00/51/1088530051.db2.gz BERPIEJJBZXHNH-IERDGZPVSA-N 1 0 362.514 4.388 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(C(F)F)c(F)c1)c1ccc(N2CCOCC2)cc1 ZINC000892729295 1088968962 /nfs/dbraw/zinc/96/89/62/1088968962.db2.gz KHBSYNJBXSVNEB-AWEZNQCLSA-N 1 0 364.411 4.451 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(OC)c(OC)cc2OC)cc1 ZINC000178316073 1089217853 /nfs/dbraw/zinc/21/78/53/1089217853.db2.gz ARJZCBPVIGPCCU-HNNXBMFYSA-N 1 0 358.482 4.019 20 10 FICDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3F)CC2)c(O)c1 ZINC000283894262 1089704067 /nfs/dbraw/zinc/70/40/67/1089704067.db2.gz CRPZJIPUGZNLOL-INIZCTEOSA-N 1 0 370.468 4.104 20 10 FICDRO c1ccc(C[N@H+]2CC[C@@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240034 1090434417 /nfs/dbraw/zinc/43/44/17/1090434417.db2.gz CEWIGIGFFQZYAV-QHCPKHFHSA-N 1 0 363.549 4.289 20 10 FICDRO C[C@@H]([NH2+]Cc1ccccc1Cn1cccn1)c1cc2c(cc1O)CCCC2 ZINC000184911331 1090488846 /nfs/dbraw/zinc/48/88/46/1090488846.db2.gz IJJXSBDAGCIMKS-QGZVFWFLSA-N 1 0 361.489 4.367 20 10 FICDRO CC(C)(C)OC(=O)N(CC[NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000312290081 1090518531 /nfs/dbraw/zinc/51/85/31/1090518531.db2.gz WJOFNPQCBYITLD-UHFFFAOYSA-N 1 0 373.541 4.166 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](OC(C)C)c2ccccc2OC)c1 ZINC000186384003 1090638139 /nfs/dbraw/zinc/63/81/39/1090638139.db2.gz YEHMYBFEUZILBM-BTYIYWSLSA-N 1 0 359.466 4.226 20 10 FICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000162370354 1090766575 /nfs/dbraw/zinc/76/65/75/1090766575.db2.gz ORYVLCZLKDRYRR-DLBZAZTESA-N 1 0 372.484 4.391 20 10 FICDRO CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000236702287 1091539318 /nfs/dbraw/zinc/53/93/18/1091539318.db2.gz XMWHFSUVZKHVLX-QFIPXVFZSA-N 1 0 356.485 4.019 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccn(-c2ccc(OC)cc2)n1)c1ccc(N(C)C)cc1 ZINC000178712036 1093149680 /nfs/dbraw/zinc/14/96/80/1093149680.db2.gz LYPOMGJXAQPOGS-JOCHJYFZSA-N 1 0 364.493 4.188 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cccnc2OC)cc1 ZINC000236966770 1093237975 /nfs/dbraw/zinc/23/79/75/1093237975.db2.gz SHNJZJRAUMFSGW-UHFFFAOYSA-N 1 0 361.489 4.407 20 10 FICDRO COc1ccc(C[NH2+]Cc2cn(C(F)F)c3ccccc23)c(O)c1OC ZINC000895629838 1093641717 /nfs/dbraw/zinc/64/17/17/1093641717.db2.gz AHCWDKQAKFQWLO-UHFFFAOYSA-N 1 0 362.376 4.049 20 10 FICDRO CCOc1ccc(Oc2cc(C[NH2+]Cc3ccccc3O)ccn2)cc1 ZINC000237102925 1093973849 /nfs/dbraw/zinc/97/38/49/1093973849.db2.gz ITGINWHWFLITNF-UHFFFAOYSA-N 1 0 350.418 4.268 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1ccc(C)cc1O ZINC000279996313 1094282315 /nfs/dbraw/zinc/28/23/15/1094282315.db2.gz FRBXIYOEBYYKSN-HXUWFJFHSA-N 1 0 352.478 4.064 20 10 FICDRO C[C@H]([NH2+]C[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(N2CCCCC2)cc1 ZINC000163181581 1094323274 /nfs/dbraw/zinc/32/32/74/1094323274.db2.gz JBHUHNGJJIQQHZ-IRXDYDNUSA-N 1 0 369.475 4.212 20 10 FICDRO CCN1CC[C@H]([NH2+][C@@H](C)c2ccccc2O)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000783533698 1094435116 /nfs/dbraw/zinc/43/51/16/1094435116.db2.gz VJYTVWJGDUJJEN-CYFODOTGSA-N 1 0 364.411 4.296 20 10 FICDRO COc1ccc([C@@H]([NH2+]Cc2cccc(OC)c2O)c2ccc(F)cc2)cc1 ZINC000237275778 1095694351 /nfs/dbraw/zinc/69/43/51/1095694351.db2.gz NHGBTMQFTUJIQF-NRFANRHFSA-N 1 0 367.420 4.428 20 10 FICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)c1ccco1 ZINC000273432564 1096261530 /nfs/dbraw/zinc/26/15/30/1096261530.db2.gz LJDLEKWDEQDLCC-FZMZJTMJSA-N 1 0 354.244 4.176 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273517916 1096269948 /nfs/dbraw/zinc/26/99/48/1096269948.db2.gz SXBIEZUKXYSVTC-QAPCUYQASA-N 1 0 361.551 4.366 20 10 FICDRO Cc1nn(-c2ccc(F)cc2)c(Cl)c1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000017318004 1101045218 /nfs/dbraw/zinc/04/52/18/1101045218.db2.gz DANPOZBJYXQVMI-UHFFFAOYSA-N 1 0 372.875 4.329 20 10 FICDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1nc(-c3ccncc3)cs1)CC2 ZINC000296811112 1101440670 /nfs/dbraw/zinc/44/06/70/1101440670.db2.gz LWDYRVDTMWXLBJ-INIZCTEOSA-N 1 0 351.475 4.120 20 10 FICDRO C[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000186643107 1101775441 /nfs/dbraw/zinc/77/54/41/1101775441.db2.gz RAPYTGBRIZWZFX-BLVKFPJESA-N 1 0 359.832 4.358 20 10 FICDRO Cc1ccc(O)c(C[NH+]2CCC(C(=O)c3c(F)cc(F)cc3F)CC2)c1 ZINC000093440837 1102573092 /nfs/dbraw/zinc/57/30/92/1102573092.db2.gz BVXRBWUSIVJIGU-UHFFFAOYSA-N 1 0 363.379 4.213 20 10 FICDRO COc1ccc2c(c1)CCCCN2C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001168244259 1102599123 /nfs/dbraw/zinc/59/91/23/1102599123.db2.gz LPBHSYPUQYXLAR-QGZVFWFLSA-N 1 0 374.525 4.485 20 10 FICDRO COc1ccc2ccc(O)c(C[N@H+](C)CCc3ccccc3OC)c2c1 ZINC000729466636 1102766329 /nfs/dbraw/zinc/76/63/29/1102766329.db2.gz VZCGDCWQZVEXCD-UHFFFAOYSA-N 1 0 351.446 4.237 20 10 FICDRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccc(N3CCOCC3)cc2)c1C ZINC000729681932 1103037787 /nfs/dbraw/zinc/03/77/87/1103037787.db2.gz OJEAJHXFBWYJRN-UHFFFAOYSA-N 1 0 363.505 4.220 20 10 FICDRO CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3Br)c(O)c1 ZINC000729685253 1103062188 /nfs/dbraw/zinc/06/21/88/1103062188.db2.gz ADNKODXZFITZRQ-QGZVFWFLSA-N 1 0 362.267 4.331 20 10 FICDRO COC1CCC(CC[NH2+][C@H](C)c2ccc(Br)cc2O)CC1 ZINC000757683466 1103183231 /nfs/dbraw/zinc/18/32/31/1103183231.db2.gz YUJNIRBJDPHCOE-DNOWBOINSA-N 1 0 356.304 4.401 20 10 FICDRO C[C@H]([NH2+]C[C@@]1(CO)C[C@@H]1c1ccc(F)cc1)c1cc2c(cc1O)CCCC2 ZINC000760041213 1105037541 /nfs/dbraw/zinc/03/75/41/1105037541.db2.gz NYCUQBWBIDOWHW-PNDGYVOYSA-N 1 0 369.480 4.227 20 10 FICDRO CC(C)Cc1ncc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)s1 ZINC000160209230 1105123983 /nfs/dbraw/zinc/12/39/83/1105123983.db2.gz PEOQZYIWADYSRU-KRWDZBQOSA-N 1 0 360.523 4.228 20 10 FICDRO COc1cccc(C[NH2+][C@H](C)c2ccc(OCC(C)C)c(OC)c2)c1O ZINC000237235554 1105193741 /nfs/dbraw/zinc/19/37/41/1105193741.db2.gz PGYHUUSPHOVUKD-OAHLLOKOSA-N 1 0 359.466 4.295 20 10 FICDRO CCN1CC[C@@H]([NH2+]Cc2cccc(C)c2O)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000783595079 1107675860 /nfs/dbraw/zinc/67/58/60/1107675860.db2.gz MJHSMZDTAJZBGW-MJGOQNOKSA-N 1 0 364.411 4.043 20 10 FICDRO CN(Cc1ccccc1O)C(=O)CN(Cc1ccccc1)Cc1ccccc1 ZINC000303922960 1107793859 /nfs/dbraw/zinc/79/38/59/1107793859.db2.gz PAFXICWAIVTRGA-UHFFFAOYSA-N 1 0 374.484 4.053 20 10 FICDRO COc1cc2c(cc1C[NH2+]Cc1c(C)c3ccccc3n1C)O[C@H](C)C2 ZINC000525995754 1109578169 /nfs/dbraw/zinc/57/81/69/1109578169.db2.gz FSVQALZFRJUVCQ-CQSZACIVSA-N 1 0 350.462 4.109 20 10 FICDRO COc1cccc(C[NH2+][C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1O ZINC000527806513 1109832099 /nfs/dbraw/zinc/83/20/99/1109832099.db2.gz FYQQIJOKTXCWNH-INIZCTEOSA-N 1 0 369.292 4.100 20 10 FICDRO Cc1cccc(C[NH2+][C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1O ZINC000529671060 1110303585 /nfs/dbraw/zinc/30/35/85/1110303585.db2.gz YIOIPENSCZJZBZ-QGZVFWFLSA-N 1 0 353.293 4.400 20 10 FICDRO COc1cc([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc(OC)c1OC ZINC000479455434 1112030120 /nfs/dbraw/zinc/03/01/20/1112030120.db2.gz NOOZNCUTYNPWFF-OAHLLOKOSA-N 1 0 368.477 4.363 20 10 FICDRO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000155314748 1113557338 /nfs/dbraw/zinc/55/73/38/1113557338.db2.gz VZQMAENKDGYEIC-ZWKOTPCHSA-N 1 0 354.494 4.334 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(N(C)C)cc1 ZINC000163593883 1113867824 /nfs/dbraw/zinc/86/78/24/1113867824.db2.gz YQNNFJBVJVZTDW-KRWDZBQOSA-N 1 0 355.551 4.157 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000151043157 1114281449 /nfs/dbraw/zinc/28/14/49/1114281449.db2.gz PHBHCOCRZXKUFP-QGZVFWFLSA-N 1 0 351.494 4.120 20 10 FICDRO CCN(CC)c1ccc(CN[C@@H](C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000913170306 1114304998 /nfs/dbraw/zinc/30/49/98/1114304998.db2.gz UJVWUSDRAISKKB-QHCPKHFHSA-N 1 0 351.538 4.460 20 10 FICDRO CC[C@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000164280415 1114461837 /nfs/dbraw/zinc/46/18/37/1114461837.db2.gz OGMDHMLYUWBBIS-QFIPXVFZSA-N 1 0 362.521 4.433 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(N2CCCC2=O)cc1 ZINC000156807894 1114594943 /nfs/dbraw/zinc/59/49/43/1114594943.db2.gz VBJMYCMJHHKAKB-DLBZAZTESA-N 1 0 351.494 4.291 20 10 FICDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000164943723 1114657760 /nfs/dbraw/zinc/65/77/60/1114657760.db2.gz WNAVOIUBKYDUAJ-GOSISDBHSA-N 1 0 351.494 4.356 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c(C)n1-c1cccc(Cl)c1 ZINC000760755954 1114845987 /nfs/dbraw/zinc/84/59/87/1114845987.db2.gz ASEYAZIPVIPIGZ-SFHVURJKSA-N 1 0 373.928 4.304 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1O ZINC000761191412 1115614670 /nfs/dbraw/zinc/61/46/70/1115614670.db2.gz TWEWCNZNYJPMHB-UHFFFAOYSA-N 1 0 364.829 4.373 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](O)c2c(F)cccc2Cl)c1O ZINC000761206471 1115621969 /nfs/dbraw/zinc/62/19/69/1115621969.db2.gz HTLSCRFMSJZCAR-ABKXIKBNSA-N 1 0 374.239 4.058 20 10 FICDRO CCC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000761203589 1115623040 /nfs/dbraw/zinc/62/30/40/1115623040.db2.gz WOAFCFAOGGGRSY-QGTPRVQTSA-N 1 0 353.890 4.080 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)CCC2 ZINC000151568095 1118583584 /nfs/dbraw/zinc/58/35/84/1118583584.db2.gz CNVRFOJUCONOHM-SFHVURJKSA-N 1 0 364.533 4.235 20 10 FICDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)s1 ZINC000151592815 1118942300 /nfs/dbraw/zinc/94/23/00/1118942300.db2.gz QLUQMSMTRMWENV-MRXNPFEDSA-N 1 0 358.551 4.370 20 10 FICDRO CCC(=O)N1CC[C@@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000761989625 1120634939 /nfs/dbraw/zinc/63/49/39/1120634939.db2.gz PVVZNBJVWJGRFI-QGZVFWFLSA-N 1 0 360.542 4.088 20 10 FICDRO CC[NH+](CC)CCSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 ZINC000762467957 1120911960 /nfs/dbraw/zinc/91/19/60/1120911960.db2.gz NMFWHMUFECMMLK-SFHVURJKSA-N 1 0 359.539 4.163 20 10 FICDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc(N2CCOCC2)cc1Cl ZINC000765756554 1121059697 /nfs/dbraw/zinc/05/96/97/1121059697.db2.gz XNASRJPOSOQWMN-WBVHZDCISA-N 1 0 356.897 4.167 20 10 FICDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc(N2CCOCC2)cc1Cl ZINC000765756551 1121063057 /nfs/dbraw/zinc/06/30/57/1121063057.db2.gz XNASRJPOSOQWMN-DOTOQJQBSA-N 1 0 356.897 4.167 20 10 FICDRO Cc1cc(C[NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc(C)c1O ZINC000916835949 1121877503 /nfs/dbraw/zinc/87/75/03/1121877503.db2.gz DTHIHOUCBXATDN-IRXDYDNUSA-N 1 0 372.484 4.052 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)c1 ZINC000186230830 1121970821 /nfs/dbraw/zinc/97/08/21/1121970821.db2.gz ZTKKAWUUVCXAAY-CQSZACIVSA-N 1 0 357.450 4.207 20 10 FICDRO CC1CCN([C@H](C[NH2+]Cc2ccc3c(c2)CCO3)c2cccs2)CC1 ZINC000917392607 1122286806 /nfs/dbraw/zinc/28/68/06/1122286806.db2.gz CIPOOQVETWBJMP-LJQANCHMSA-N 1 0 356.535 4.246 20 10 FICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cn1c(=O)oc2ccc(Cl)cc21 ZINC000917411392 1122300505 /nfs/dbraw/zinc/30/05/05/1122300505.db2.gz PTVZCCBGTJSOQH-UHFFFAOYSA-N 1 0 373.884 4.182 20 10 FICDRO CC(C)(C[NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000917641500 1122389616 /nfs/dbraw/zinc/38/96/16/1122389616.db2.gz XPINPBOAKGYYSZ-UHFFFAOYSA-N 1 0 358.913 4.244 20 10 FICDRO CC(C)(C)OC(=O)N[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000918183823 1122584945 /nfs/dbraw/zinc/58/49/45/1122584945.db2.gz UAYJOPFSVMKPAR-INIZCTEOSA-N 1 0 356.466 4.035 20 10 FICDRO CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057229 1123558220 /nfs/dbraw/zinc/55/82/20/1123558220.db2.gz VDSYYXQKPMXYAJ-WMZOPIPTSA-N 1 0 354.494 4.062 20 10 FICDRO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057441 1123558258 /nfs/dbraw/zinc/55/82/58/1123558258.db2.gz WOBKMSXDZWINQS-QZTJIDSGSA-N 1 0 360.542 4.341 20 10 FICDRO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057438 1123558296 /nfs/dbraw/zinc/55/82/96/1123558296.db2.gz WOBKMSXDZWINQS-MSOLQXFVSA-N 1 0 360.542 4.341 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN(c3ccc(Cl)cn3)CC2)cc1C(C)C ZINC000921188927 1123581107 /nfs/dbraw/zinc/58/11/07/1123581107.db2.gz WTIVOVNXWBHPKV-UHFFFAOYSA-N 1 0 359.901 4.195 20 10 FICDRO COc1ccc2[nH]cc(C3CC[NH+](Cc4cc(OC)ccc4O)CC3)c2c1 ZINC000179847197 1124119389 /nfs/dbraw/zinc/11/93/89/1124119389.db2.gz TVKJFSLBYPQFJL-UHFFFAOYSA-N 1 0 366.461 4.270 20 10 FICDRO Oc1ccccc1C[NH2+]C[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000238101984 1124283838 /nfs/dbraw/zinc/28/38/38/1124283838.db2.gz JMNBYOLIGVMQND-HXUWFJFHSA-N 1 0 364.514 4.343 20 10 FICDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(N(C)C)cc1 ZINC000765910240 1124418765 /nfs/dbraw/zinc/41/87/65/1124418765.db2.gz YAGCFGBUCFGTMJ-KPZWWZAWSA-N 1 0 353.293 4.444 20 10 FICDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(N(C)C)cc1 ZINC000765910243 1124418926 /nfs/dbraw/zinc/41/89/26/1124418926.db2.gz YAGCFGBUCFGTMJ-XIKOKIGWSA-N 1 0 353.293 4.444 20 10 FICDRO CCC[N@H+](Cc1coc(-c2ccc(OC)cc2)n1)Cc1ccccc1O ZINC000068973695 1124433235 /nfs/dbraw/zinc/43/32/35/1124433235.db2.gz QDYXAFMBIWUNID-UHFFFAOYSA-N 1 0 352.434 4.468 20 10 FICDRO Cc1noc([C@@H]2CCC[N@H+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)n1 ZINC000068962176 1124437436 /nfs/dbraw/zinc/43/74/36/1124437436.db2.gz CNLPHVUYBVXTPV-CQSZACIVSA-N 1 0 367.449 4.088 20 10 FICDRO C[C@H]([NH2+]Cc1cccc(N(C)C)n1)c1ccc(N2CCCCC2)c(F)c1 ZINC000090851816 1125254814 /nfs/dbraw/zinc/25/48/14/1125254814.db2.gz FDIPWNMIVQHGEW-INIZCTEOSA-N 1 0 356.489 4.128 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OCC(F)(F)F)cc2)c1 ZINC000182345891 1125425741 /nfs/dbraw/zinc/42/57/41/1125425741.db2.gz HSJIJOZVCJABMW-GFCCVEGCSA-N 1 0 355.356 4.193 20 10 FICDRO O=C(CN(Cc1ccco1)Cc1ccccc1O)c1c[nH]c2ccccc21 ZINC000070824010 1125681756 /nfs/dbraw/zinc/68/17/56/1125681756.db2.gz KWRRHYGXZIADLR-UHFFFAOYSA-N 1 0 360.413 4.352 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)c(O)c1C ZINC000274798529 1080081179 /nfs/dbraw/zinc/08/11/79/1080081179.db2.gz UHLMDGSXXKVDPW-YWZLYKJASA-N 1 0 353.441 4.322 20 10 FICDRO COc1ccc(N2CCC[N@H+](C[C@H]3CC[C@H](c4ccccc4)O3)CC2)cc1 ZINC001167107678 1080552098 /nfs/dbraw/zinc/55/20/98/1080552098.db2.gz GIJKPJSBNSJBSQ-DHIUTWEWSA-N 1 0 366.505 4.128 20 10 FICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(Cl)c(F)c1 ZINC001167108278 1080553339 /nfs/dbraw/zinc/55/33/39/1080553339.db2.gz NLDZWFLGYFFLNH-HXUWFJFHSA-N 1 0 364.892 4.489 20 10 FICDRO CCOc1cc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC001167108298 1080553554 /nfs/dbraw/zinc/55/35/54/1080553554.db2.gz OKHZEECCUASOMY-UHFFFAOYSA-N 1 0 371.481 4.470 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccccc1O ZINC000155181211 1080677049 /nfs/dbraw/zinc/67/70/49/1080677049.db2.gz WCFFUOVMUWMMGZ-AUUYWEPGSA-N 1 0 353.466 4.478 20 10 FICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](c2ccc(Br)cc2)C1 ZINC001140055203 1080740433 /nfs/dbraw/zinc/74/04/33/1080740433.db2.gz NRZWKDURYSBRPS-CYBMUJFWSA-N 1 0 350.231 4.283 20 10 FICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(O)cccc1Br ZINC001140103944 1080904422 /nfs/dbraw/zinc/90/44/22/1080904422.db2.gz VDZNICHWKXQUIG-UHFFFAOYSA-N 1 0 350.256 4.185 20 10 FICDRO CCOCc1cc(C[NH2+]Cc2cc(Br)cs2)ccc1OC ZINC001648828491 1081265869 /nfs/dbraw/zinc/26/58/69/1081265869.db2.gz DQKJLLIJZLDXDN-UHFFFAOYSA-N 1 0 370.312 4.346 20 10 FICDRO C[C@H]1CN(c2ccc(C[NH2+]Cc3cc(F)cc(F)c3)cc2F)C[C@H](C)O1 ZINC001648835418 1081277066 /nfs/dbraw/zinc/27/70/66/1081277066.db2.gz NSHVTPYPXASZSM-KBPBESRZSA-N 1 0 364.411 4.007 20 10 FICDRO c1ccc(C[C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000728301027 1082009904 /nfs/dbraw/zinc/00/99/04/1082009904.db2.gz IJJWMXWUCLFTMO-LADGPHEKSA-N 1 0 364.533 4.414 20 10 FICDRO COc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc12 ZINC001167434286 1082136092 /nfs/dbraw/zinc/13/60/92/1082136092.db2.gz HCUGIZXCWFJSAB-UHFFFAOYSA-N 1 0 361.489 4.212 20 10 FICDRO CCSCc1noc(Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)n1 ZINC000581335829 1082471619 /nfs/dbraw/zinc/47/16/19/1082471619.db2.gz GIJNUJSSEKZOFS-UHFFFAOYSA-N 1 0 370.522 4.092 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)c1 ZINC000073005366 1082629862 /nfs/dbraw/zinc/62/98/62/1082629862.db2.gz YFSYRZKSBFECDT-MRXNPFEDSA-N 1 0 361.445 4.199 20 10 FICDRO COc1ccc(C[NH2+][C@H]2CCSc3ccc(Cl)cc32)c(O)c1OC ZINC000892467895 1083531282 /nfs/dbraw/zinc/53/12/82/1083531282.db2.gz BHAFICQQBNSDSW-AWEZNQCLSA-N 1 0 365.882 4.390 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccc(N2CCOC2=O)c1 ZINC000156964785 1084278871 /nfs/dbraw/zinc/27/88/71/1084278871.db2.gz ZONOAAPVIQSRBF-JKSUJKDBSA-N 1 0 353.466 4.121 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC ZINC000157420797 1084379683 /nfs/dbraw/zinc/37/96/83/1084379683.db2.gz FQMRRAGCZXLGKB-HUUCEWRRSA-N 1 0 358.482 4.190 20 10 FICDRO CC[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001167513801 1084387951 /nfs/dbraw/zinc/38/79/51/1084387951.db2.gz XQKHDSTYBQHNCR-ZOZIMZAQSA-N 1 0 360.242 4.268 20 10 FICDRO COC1CCN(c2ccc(C[N@H+](C)[C@H](C)Cc3cccs3)cc2)CC1 ZINC001167607856 1085583655 /nfs/dbraw/zinc/58/36/55/1085583655.db2.gz CVEVRRHDTJGEHY-QGZVFWFLSA-N 1 0 358.551 4.426 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(OC)c1OC)c1ccc(N(C)C)cc1 ZINC000164561852 1085880479 /nfs/dbraw/zinc/88/04/79/1085880479.db2.gz NSSPMLNCFIDTJA-SFHVURJKSA-N 1 0 358.482 4.019 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(Br)cc2)c1 ZINC000314953020 1086563392 /nfs/dbraw/zinc/56/33/92/1086563392.db2.gz UKGMFANTNRIPGU-LBPRGKRZSA-N 1 0 350.256 4.057 20 10 FICDRO COc1ccc2c(c1)CCC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C2 ZINC000728563427 1086643506 /nfs/dbraw/zinc/64/35/06/1086643506.db2.gz IXILEBLXWVQWRA-UHFFFAOYSA-N 1 0 355.478 4.352 20 10 FICDRO Cc1cc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2[nH+]1 ZINC000052457696 1086837616 /nfs/dbraw/zinc/83/76/16/1086837616.db2.gz XBTKJBBFYFCYPT-UHFFFAOYSA-N 1 0 365.452 4.256 20 10 FICDRO Cc1ccc(C)n1-c1ccc(-c2noc(CC3C[C@H]4CC[C@@H](C3)[NH2+]4)n2)cc1 ZINC001211701452 1086855810 /nfs/dbraw/zinc/85/58/10/1086855810.db2.gz XOZBLDTWLNUTJM-JLYLLQBASA-N 1 0 362.477 4.217 20 10 FICDRO Oc1ccccc1C[NH2+]C1(c2cccc(OC(F)(F)F)c2)CCOCC1 ZINC000278467307 1086998706 /nfs/dbraw/zinc/99/87/06/1086998706.db2.gz GMMGDBOWMIVUMI-UHFFFAOYSA-N 1 0 367.367 4.086 20 10 FICDRO COc1cc(O)c(C[NH2+][C@@H](C)c2ccc(Br)cc2)cc1OC ZINC000278599434 1087139802 /nfs/dbraw/zinc/13/98/02/1087139802.db2.gz FPWSXVAFTCWNJC-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO Fc1cc(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)ccc1C(F)F ZINC000892621571 1087875836 /nfs/dbraw/zinc/87/58/36/1087875836.db2.gz LFVYXWFDJFRCAB-UHFFFAOYSA-N 1 0 368.374 4.029 20 10 FICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000162358361 1087929458 /nfs/dbraw/zinc/92/94/58/1087929458.db2.gz LYKNEYCBTGUIGJ-ZWKOTPCHSA-N 1 0 354.494 4.252 20 10 FICDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163607057 1088154678 /nfs/dbraw/zinc/15/46/78/1088154678.db2.gz ULGQAXGCJJACKF-INIZCTEOSA-N 1 0 371.506 4.307 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3cccc(C(C)C)c3)c2)CC1 ZINC001269786974 1088636252 /nfs/dbraw/zinc/63/62/52/1088636252.db2.gz LASVNKZZSNTCIU-UHFFFAOYSA-N 1 0 351.494 4.204 20 10 FICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000122753309 1090045518 /nfs/dbraw/zinc/04/55/18/1090045518.db2.gz LKMBYXGKLQHZKE-HNNXBMFYSA-N 1 0 369.900 4.146 20 10 FICDRO CC(C)(C)c1cc(C[NH2+][C@H]2CCc3n[nH]cc3C2)c(O)c(C(C)(C)C)c1 ZINC000236667403 1090231814 /nfs/dbraw/zinc/23/18/14/1090231814.db2.gz RLCZPXYIRZDWGH-KRWDZBQOSA-N 1 0 355.526 4.357 20 10 FICDRO C[C@@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000182221750 1090337021 /nfs/dbraw/zinc/33/70/21/1090337021.db2.gz ZEPRHTHFFBZATD-OAHLLOKOSA-N 1 0 358.432 4.141 20 10 FICDRO COc1cccc(CC[NH2+][C@@H](C)c2cc(Br)ccc2O)c1 ZINC000756423991 1090398183 /nfs/dbraw/zinc/39/81/83/1090398183.db2.gz SHBSTMHNIJBTMP-LBPRGKRZSA-N 1 0 350.256 4.057 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccccc3C)CCOCC2)c1 ZINC000185126705 1090511114 /nfs/dbraw/zinc/51/11/14/1090511114.db2.gz XTLITRNMLCCBMQ-KRWDZBQOSA-N 1 0 355.478 4.108 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)c(O)c1 ZINC000185428572 1090542225 /nfs/dbraw/zinc/54/22/25/1090542225.db2.gz SVQZCSZENUBDEI-UHFFFAOYSA-N 1 0 367.420 4.409 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)c1 ZINC000185469557 1090546796 /nfs/dbraw/zinc/54/67/96/1090546796.db2.gz CBFNDWJPADVXKS-IRXDYDNUSA-N 1 0 354.494 4.277 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1cc2c(cc1O)CCCC2 ZINC000186113114 1090614373 /nfs/dbraw/zinc/61/43/73/1090614373.db2.gz IKSUBPUFMVEZQZ-CVEARBPZSA-N 1 0 362.477 4.264 20 10 FICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000189365911 1090974961 /nfs/dbraw/zinc/97/49/61/1090974961.db2.gz QZZDLJLQGPSGRO-OXQOHEQNSA-N 1 0 370.468 4.145 20 10 FICDRO [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310074563 1091011190 /nfs/dbraw/zinc/01/11/90/1091011190.db2.gz FTHXCTXGPMTUQX-HNNXBMFYSA-N 1 0 365.304 4.311 20 10 FICDRO CCOc1cccc(C[NH2+]CCc2ccccc2OC(F)(F)F)c1O ZINC000236934631 1092987767 /nfs/dbraw/zinc/98/77/67/1092987767.db2.gz UHOVRNIZLQCBDF-UHFFFAOYSA-N 1 0 355.356 4.022 20 10 FICDRO CCOc1cccc(C[NH2+]C[C@@H](C)CSc2ccccc2OC)c1O ZINC000236935613 1092989442 /nfs/dbraw/zinc/98/94/42/1092989442.db2.gz QBZLWJLKKQJQJV-OAHLLOKOSA-N 1 0 361.507 4.318 20 10 FICDRO CC[C@H]([NH2+]Cc1ccn(-c2ccc(OC)cc2)n1)c1ccc(N(C)C)cc1 ZINC000178712026 1093149495 /nfs/dbraw/zinc/14/94/95/1093149495.db2.gz LYPOMGJXAQPOGS-QFIPXVFZSA-N 1 0 364.493 4.188 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1C(F)(F)F ZINC000067249695 1093808124 /nfs/dbraw/zinc/80/81/24/1093808124.db2.gz LBKYZOIJPLSQJH-OAHLLOKOSA-N 1 0 364.411 4.393 20 10 FICDRO CC(C)[C@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)[NH+]1CCCCC1 ZINC000729305534 1093959165 /nfs/dbraw/zinc/95/91/65/1093959165.db2.gz NWOYETFTAKRVOA-JOCHJYFZSA-N 1 0 371.569 4.146 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)cc1O ZINC000280221084 1094310271 /nfs/dbraw/zinc/31/02/71/1094310271.db2.gz UTJDXWKWXUZPPH-HXUWFJFHSA-N 1 0 372.484 4.042 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)CC(C)(C)C1)c1ccccc1O ZINC000710385589 1094771798 /nfs/dbraw/zinc/77/17/98/1094771798.db2.gz SWTTZYKWLWNBFI-CVEARBPZSA-N 1 0 362.514 4.469 20 10 FICDRO CCOCc1cc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1OC ZINC000273361606 1096255547 /nfs/dbraw/zinc/25/55/47/1096255547.db2.gz CRWRFBXQUKMIQX-RBBKRZOGSA-N 1 0 373.468 4.381 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOC3=O)cc2)c(O)c1C ZINC000273386021 1096257801 /nfs/dbraw/zinc/25/78/01/1096257801.db2.gz JMTFKLHCWNQNJB-HZPDHXFCSA-N 1 0 354.450 4.377 20 10 FICDRO COCC[C@H]([NH2+][C@H](C)c1cc(Br)ccc1O)c1ccco1 ZINC000273495178 1096267703 /nfs/dbraw/zinc/26/77/03/1096267703.db2.gz XRTWRAIXLPVYMQ-RISCZKNCSA-N 1 0 354.244 4.176 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1O ZINC000273799012 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370.493 4.234 20 10 FICDRO C[C@H]1CCCN(C(=O)C2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)C1 ZINC000054471348 1102981799 /nfs/dbraw/zinc/98/17/99/1102981799.db2.gz WFSAVFDAMCZRPR-KRWDZBQOSA-N 1 0 366.505 4.016 20 10 FICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(OCC(C)C)c(OC)c2)c1O ZINC000237230002 1105172436 /nfs/dbraw/zinc/17/24/36/1105172436.db2.gz PGYHUUSPHOVUKD-HNNXBMFYSA-N 1 0 359.466 4.295 20 10 FICDRO Cc1cc(C[N@@H+]2CCc3nc(C4CC4)ncc3C2)c(O)c(C(C)(C)C)c1 ZINC000530102801 1106828312 /nfs/dbraw/zinc/82/83/12/1106828312.db2.gz AFTVSKSUDHEDNU-UHFFFAOYSA-N 1 0 351.494 4.224 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2ccc(Br)c(F)c2F)c1O ZINC000527789852 1109824191 /nfs/dbraw/zinc/82/41/91/1109824191.db2.gz GRSUHTZFSUDAEC-UHFFFAOYSA-N 1 0 372.209 4.121 20 10 FICDRO COCCOc1ccc([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000479452583 1112028105 /nfs/dbraw/zinc/02/81/05/1112028105.db2.gz KXEVXJZXFMNVFX-QGZVFWFLSA-N 1 0 352.478 4.363 20 10 FICDRO CCc1onc(C)c1C[NH2+][C@@H](C)c1cc(Br)c(F)cc1[O-] ZINC000927135254 1112298302 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FICDRO CCC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000151058261 1114280228 /nfs/dbraw/zinc/28/02/28/1114280228.db2.gz LOQNQXMKCGJRNL-JOCHJYFZSA-N 1 0 354.494 4.163 20 10 FICDRO Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CCCO2 ZINC000151072344 1114289595 /nfs/dbraw/zinc/28/95/95/1114289595.db2.gz FILHRPMRDCIEOD-QFIPXVFZSA-N 1 0 366.505 4.144 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccnc2OCC(F)(F)F)cc1 ZINC000151109075 1114297604 /nfs/dbraw/zinc/29/76/04/1114297604.db2.gz DYYAPBHCIDDQLE-CQSZACIVSA-N 1 0 367.415 4.330 20 10 FICDRO CC[C@@H]([NH2+]Cc1c(OC)cc(OC)cc1OC)c1ccc(N(C)C)cc1 ZINC000164417553 1114494878 /nfs/dbraw/zinc/49/48/78/1114494878.db2.gz JAALBRJTWVWBJW-LJQANCHMSA-N 1 0 358.482 4.019 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCC(O)CC3)c(F)c1)CCC2 ZINC000166283669 1114970111 /nfs/dbraw/zinc/97/01/11/1114970111.db2.gz HZFAMNQPFVJBOK-JOCHJYFZSA-N 1 0 368.496 4.262 20 10 FICDRO C[C@@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000166609723 1115053059 /nfs/dbraw/zinc/05/30/59/1115053059.db2.gz HVAIEANQOQZMON-VSDWSMLSSA-N 1 0 350.506 4.376 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000157408732 1115101944 /nfs/dbraw/zinc/10/19/44/1115101944.db2.gz UGBSZTRIVFOAQC-INIZCTEOSA-N 1 0 369.465 4.231 20 10 FICDRO CC(C)(C)OC(=O)NC(C)(C)C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000761183912 1115596549 /nfs/dbraw/zinc/59/65/49/1115596549.db2.gz JDTYTBYDTUJWSX-UHFFFAOYSA-N 1 0 374.481 4.291 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(N(C)c3ccccc3)CC2)c1O ZINC000761194720 1115613267 /nfs/dbraw/zinc/61/32/67/1115613267.db2.gz GIHGCVCQYYKVMJ-UHFFFAOYSA-N 1 0 360.885 4.155 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]C[C@H](OC)c2ccc(Cl)cc2)c1O ZINC000761207618 1115625633 /nfs/dbraw/zinc/62/56/33/1115625633.db2.gz QWPITIRESBFWBX-INIZCTEOSA-N 1 0 356.249 4.185 20 10 FICDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc1 ZINC000151516809 1116278678 /nfs/dbraw/zinc/27/86/78/1116278678.db2.gz ZFLODTMAPLICFT-MRXNPFEDSA-N 1 0 356.485 4.200 20 10 FICDRO COc1ccc2ccc(O)c(C[N@H+](CCc3nccs3)C(C)C)c2c1 ZINC000151533473 1116357413 /nfs/dbraw/zinc/35/74/13/1116357413.db2.gz RQOFKIFEQCQTFA-UHFFFAOYSA-N 1 0 356.491 4.464 20 10 FICDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1C ZINC000151564341 1118532973 /nfs/dbraw/zinc/53/29/73/1118532973.db2.gz UDOYOPHZAZLIDA-LJQANCHMSA-N 1 0 352.522 4.363 20 10 FICDRO CC1(C)Cc2occc2[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)C1 ZINC000151570807 1118787169 /nfs/dbraw/zinc/78/71/69/1118787169.db2.gz UAFXLGRVFMDHMD-OAQYLSRUSA-N 1 0 368.521 4.292 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1F ZINC000151579603 1118938530 /nfs/dbraw/zinc/93/85/30/1118938530.db2.gz UWJIANUPYPYHGU-JOCHJYFZSA-N 1 0 374.475 4.414 20 10 FICDRO Cc1ccc(O)c(C[NH2+]C[C@@H](O)c2cccc(OCc3ccccc3)c2)c1 ZINC000152396445 1119245849 /nfs/dbraw/zinc/24/58/49/1119245849.db2.gz BQONKNHPNOWYHU-HSZRJFAPSA-N 1 0 363.457 4.103 20 10 FICDRO COc1ccc(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)cc1O ZINC000761570697 1119427319 /nfs/dbraw/zinc/42/73/19/1119427319.db2.gz FKGDVEZOECKHQY-UHFFFAOYSA-N 1 0 350.462 4.141 20 10 FICDRO C[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N2CCCCCC2)cc1 ZINC000152797602 1119508258 /nfs/dbraw/zinc/50/82/58/1119508258.db2.gz WVWCNJLUPGDOFD-LJQANCHMSA-N 1 0 366.553 4.493 20 10 FICDRO COc1cc(O)c(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)cc1OC ZINC000762170059 1120755297 /nfs/dbraw/zinc/75/52/97/1120755297.db2.gz DWRMCBAYUIRZCS-IBGZPJMESA-N 1 0 353.462 4.451 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCc3nc(C)ncc3C2)cc1 ZINC000915229153 1120887468 /nfs/dbraw/zinc/88/74/68/1120887468.db2.gz WIJFRWUQVXEGOZ-HXUWFJFHSA-N 1 0 352.526 4.059 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2CCN(CCc3ccccc3)CC2)cc1 ZINC000915229854 1120888693 /nfs/dbraw/zinc/88/86/93/1120888693.db2.gz VDNMNSKFMKFLDJ-UHFFFAOYSA-N 1 0 365.565 4.330 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 ZINC000915680625 1121024203 /nfs/dbraw/zinc/02/42/03/1121024203.db2.gz SJSIHOYVSYDYOR-UHFFFAOYSA-N 1 0 369.465 4.274 20 10 FICDRO Cc1cc(Br)c([O-])c(C[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC001649106448 1121835804 /nfs/dbraw/zinc/83/58/04/1121835804.db2.gz GLUWDPSHVFMIKS-UHFFFAOYSA-N 1 0 369.347 4.209 20 10 FICDRO CCCCOc1ccc(CC[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000916835281 1121877377 /nfs/dbraw/zinc/87/73/77/1121877377.db2.gz XQRPHBDESUMWMX-UHFFFAOYSA-N 1 0 368.521 4.034 20 10 FICDRO Oc1c(CNc2cc(OCC3CC3)cc[nH+]2)cc(Cl)c2cccnc12 ZINC001168522110 1121911541 /nfs/dbraw/zinc/91/15/41/1121911541.db2.gz OZWXBXJPRRVINI-UHFFFAOYSA-N 1 0 355.825 4.390 20 10 FICDRO Cc1cc(CC[NH2+]C[C@H](O)c2cccc(F)c2)c(C)n1-c1ccccc1 ZINC000916989357 1121991635 /nfs/dbraw/zinc/99/16/35/1121991635.db2.gz HJKZLXMQILTZJO-QFIPXVFZSA-N 1 0 352.453 4.099 20 10 FICDRO Cc1ccc(OCCC[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1C ZINC000917020810 1122007571 /nfs/dbraw/zinc/00/75/71/1122007571.db2.gz VGSRYRQNRKBLAS-UHFFFAOYSA-N 1 0 368.521 4.041 20 10 FICDRO C[C@@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccc(F)cc1O ZINC000186288968 1122009308 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Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583087 1122713476 /nfs/dbraw/zinc/71/34/76/1122713476.db2.gz VCDDJEBSDMJSOH-PMACEKPBSA-N 1 0 371.912 4.104 20 10 FICDRO CCOc1ccccc1C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000920180586 1123397595 /nfs/dbraw/zinc/39/75/95/1123397595.db2.gz OWBAYWNMLYIJRR-UHFFFAOYSA-N 1 0 369.465 4.274 20 10 FICDRO c1ccc([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000920183786 1123399444 /nfs/dbraw/zinc/39/94/44/1123399444.db2.gz XPWVKQFLPMPPQQ-GOTSBHOMSA-N 1 0 350.506 4.339 20 10 FICDRO CCc1cc(C[N@@H+]2CCC[C@H](c3nc(C)no3)C2)c(O)c(C(C)(C)C)c1 ZINC000921047560 1123556912 /nfs/dbraw/zinc/55/69/12/1123556912.db2.gz ABZUJSPYHVGXFP-INIZCTEOSA-N 1 0 357.498 4.323 20 10 FICDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CCc2ccccc2C1 ZINC000921197665 1123578452 /nfs/dbraw/zinc/57/84/52/1123578452.db2.gz UECCPWNKRMFQFR-FQEVSTJZSA-N 1 0 363.549 4.213 20 10 FICDRO CC(C)(C)OC(=O)N(CC1CC1)C1CC[NH+](Cc2ccccc2O)CC1 ZINC000179580125 1124007970 /nfs/dbraw/zinc/00/79/70/1124007970.db2.gz OJQMTMWKJUVEKI-UHFFFAOYSA-N 1 0 360.498 4.004 20 10 FICDRO CCOc1cccc(C[N@H+](C)Cc2ccc(Br)s2)c1O ZINC000179696114 1124027731 /nfs/dbraw/zinc/02/77/31/1124027731.db2.gz INTLFCALEDFEBM-UHFFFAOYSA-N 1 0 356.285 4.247 20 10 FICDRO Oc1ccccc1C[NH2+]C[C@@H](c1ccccc1)N1CCc2sccc2C1 ZINC000238102942 1124284014 /nfs/dbraw/zinc/28/40/14/1124284014.db2.gz JMNBYOLIGVMQND-FQEVSTJZSA-N 1 0 364.514 4.343 20 10 FICDRO O=C(Nc1ccc(C[NH2+]Cc2ccccc2O)cc1)c1ccc(F)cc1 ZINC000238106411 1124284755 /nfs/dbraw/zinc/28/47/55/1124284755.db2.gz NPVGAYGZYIDCCG-UHFFFAOYSA-N 1 0 350.393 4.073 20 10 FICDRO COc1ccc(O)c(C[N@@H+]2CCCCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000180696609 1124409650 /nfs/dbraw/zinc/40/96/50/1124409650.db2.gz GCIZNKZLVJPHOC-APWZRJJASA-N 1 0 361.507 4.331 20 10 FICDRO C[C@H]([NH2+]CCN(C)CC(F)(F)F)c1ccc(N2CCCCCC2)cc1 ZINC000765933536 1124724400 /nfs/dbraw/zinc/72/44/00/1124724400.db2.gz YFRDHTUTRFZQON-INIZCTEOSA-N 1 0 357.464 4.212 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)cc1F ZINC000182008615 1125212769 /nfs/dbraw/zinc/21/27/69/1125212769.db2.gz NPKVCAUMVOBVPD-SNVBAGLBSA-N 1 0 351.805 4.247 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCC(=O)Nc2c(C)cccc2C)c1 ZINC000182340301 1125415379 /nfs/dbraw/zinc/41/53/79/1125415379.db2.gz ISFWWVGLOAEZFO-MRXNPFEDSA-N 1 0 356.466 4.087 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2Oc2cccnc2)c1 ZINC000182369203 1125436278 /nfs/dbraw/zinc/43/62/78/1125436278.db2.gz QLVXOFSYVZPXIH-OAHLLOKOSA-N 1 0 350.418 4.439 20 10 FICDRO CCOC[C@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183075620 1125736580 /nfs/dbraw/zinc/73/65/80/1125736580.db2.gz WKBQSQDEGAHLTN-IBGZPJMESA-N 1 0 355.478 4.220 20 10 FICDRO Cc1cccn2cc(C[NH2+]Cc3ccc(OCc4ccccc4)cc3O)nc12 ZINC000183163991 1125767485 /nfs/dbraw/zinc/76/74/85/1125767485.db2.gz DCZUNZVBNQFVPU-UHFFFAOYSA-N 1 0 373.456 4.217 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O[C@H]2CCOC2)cc1 ZINC000246891431 1079983266 /nfs/dbraw/zinc/98/32/66/1079983266.db2.gz DVMQJKFKNWNJFJ-GCJKJVERSA-N 1 0 368.521 4.470 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)c(O)c1C ZINC000274798523 1080081193 /nfs/dbraw/zinc/08/11/93/1080081193.db2.gz UHLMDGSXXKVDPW-QRWLVFNGSA-N 1 0 353.441 4.322 20 10 FICDRO CC[C@H]([NH2+]Cc1cn2ccsc2n1)c1cc(Br)ccc1O ZINC000274820922 1080194985 /nfs/dbraw/zinc/19/49/85/1080194985.db2.gz BQWPSBLONYMWCP-ZDUSSCGKSA-N 1 0 366.284 4.105 20 10 FICDRO C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000246960008 1080650732 /nfs/dbraw/zinc/65/07/32/1080650732.db2.gz HVAIEANQOQZMON-IMRHEYAYSA-N 1 0 350.506 4.376 20 10 FICDRO Cc1cc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)c(C)n1-c1ccccn1 ZINC000120956073 1081083819 /nfs/dbraw/zinc/08/38/19/1081083819.db2.gz URADVVVQSKMVCV-UHFFFAOYSA-N 1 0 374.488 4.337 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2Cc2nc(-c3ccco3)no2)C1 ZINC000556314467 1081287940 /nfs/dbraw/zinc/28/79/40/1081287940.db2.gz JDVVTTNAKMXAAU-UHFFFAOYSA-N 1 0 362.433 4.099 20 10 FICDRO CNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000155833882 1082111282 /nfs/dbraw/zinc/11/12/82/1082111282.db2.gz XYDIXGDKKLQRLB-MRXNPFEDSA-N 1 0 369.484 4.026 20 10 FICDRO C[C@@H]([NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(N(C)C)cc1 ZINC000177937653 1082360585 /nfs/dbraw/zinc/36/05/85/1082360585.db2.gz RBJKAJNIYQKWHJ-QRQCRPRQSA-N 1 0 352.478 4.326 20 10 FICDRO CC(=O)NC1CC[NH+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CC1 ZINC000050899690 1082450554 /nfs/dbraw/zinc/45/05/54/1082450554.db2.gz APEFAWOQPVKYOA-UHFFFAOYSA-N 1 0 360.542 4.088 20 10 FICDRO COc1ccc(C[NH2+][C@H](CNC(=O)OC(C)(C)C)CC(C)C)cc1C ZINC000310642892 1084059353 /nfs/dbraw/zinc/05/93/53/1084059353.db2.gz FVJRIQZKFUJKRB-KRWDZBQOSA-N 1 0 350.503 4.033 20 10 FICDRO COc1cccc([C@H]([NH2+]Cc2ccccc2O)c2cc(F)ccc2OC)c1 ZINC000177562666 1084082898 /nfs/dbraw/zinc/08/28/98/1084082898.db2.gz OCMDJAJWOLEUCA-QFIPXVFZSA-N 1 0 367.420 4.428 20 10 FICDRO COCc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)ccc1OC ZINC000177975066 1084520811 /nfs/dbraw/zinc/52/08/11/1084520811.db2.gz ODEUSQPDKCAACX-QGZVFWFLSA-N 1 0 354.494 4.293 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(=O)NCc1ccccc1 ZINC000161178306 1084753857 /nfs/dbraw/zinc/75/38/57/1084753857.db2.gz JENSFZKKVDLPQR-OALUTQOASA-N 1 0 365.521 4.032 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(=O)NCc1ccccc1 ZINC000161178545 1084753870 /nfs/dbraw/zinc/75/38/70/1084753870.db2.gz JENSFZKKVDLPQR-RBUKOAKNSA-N 1 0 365.521 4.032 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(C)c1OC ZINC000796722371 1084821541 /nfs/dbraw/zinc/82/15/41/1084821541.db2.gz DRDHLZNVKXKHOP-INIZCTEOSA-N 1 0 354.494 4.245 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CC12CCC2 ZINC000313234566 1085289743 /nfs/dbraw/zinc/28/97/43/1085289743.db2.gz TWPXTSYJNSPWJK-IRXDYDNUSA-N 1 0 372.509 4.291 20 10 FICDRO CN(Cc1cccs1)c1ccc(C[NH2+]Cc2ccccc2CO)cc1 ZINC001648917328 1085666445 /nfs/dbraw/zinc/66/64/45/1085666445.db2.gz YQBUTJMIMYJNTI-UHFFFAOYSA-N 1 0 352.503 4.167 20 10 FICDRO c1cncc([C@@H]2CCC[C@@H]([NH2+]Cc3ccc(N4CCSCC4)cc3)C2)c1 ZINC000800222687 1086534537 /nfs/dbraw/zinc/53/45/37/1086534537.db2.gz BXWITJMJUYTCRA-TZIWHRDSSA-N 1 0 367.562 4.451 20 10 FICDRO Cc1cc(C(=O)N(C)CC2CC[NH+](C)CC2)c(C)n1-c1cccc(Cl)c1 ZINC000728881691 1086562724 /nfs/dbraw/zinc/56/27/24/1086562724.db2.gz KQMMRKVWGOWDAO-UHFFFAOYSA-N 1 0 373.928 4.161 20 10 FICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000161668600 1086598767 /nfs/dbraw/zinc/59/87/67/1086598767.db2.gz OHDCMXIAVHEHPZ-KRWDZBQOSA-N 1 0 372.484 4.302 20 10 FICDRO C[C@@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccc(N2CCCCCC2)cc1 ZINC000161790983 1086838668 /nfs/dbraw/zinc/83/86/68/1086838668.db2.gz DHMGWSWWBRWMKA-GOSISDBHSA-N 1 0 358.526 4.403 20 10 FICDRO C[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)c1cncc(F)c1 ZINC000157743315 1086974593 /nfs/dbraw/zinc/97/45/93/1086974593.db2.gz NVHFGKKUDQOQFG-CYBMUJFWSA-N 1 0 365.399 4.142 20 10 FICDRO FC(F)Oc1ccc(N2CCC([NH2+]Cc3cccnc3Cl)CC2)cc1 ZINC000105427996 1088079569 /nfs/dbraw/zinc/07/95/69/1088079569.db2.gz XFMINPVYKOAMGY-UHFFFAOYSA-N 1 0 367.827 4.095 20 10 FICDRO [O-]c1c(Cl)cccc1C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000311048144 1088160012 /nfs/dbraw/zinc/16/00/12/1088160012.db2.gz QDGYAOOCBXTVAT-GOSISDBHSA-N 1 0 358.913 4.438 20 10 FICDRO CC[C@@H]([NH2+]C1CCN([C@H](C)c2ccncc2)CC1)c1ccc(C)cc1O ZINC000280149072 1088550994 /nfs/dbraw/zinc/55/09/94/1088550994.db2.gz QBNNFRTWLIEROL-DYESRHJHSA-N 1 0 353.510 4.362 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(Br)c2[O-])c(OC)c1 ZINC000098039183 1088751647 /nfs/dbraw/zinc/75/16/47/1088751647.db2.gz NZKSHHCZBYNDSJ-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO COc1ccc(N2CCC([NH2+]C3(c4nc(C)cs4)CCC3)CC2)cc1 ZINC000376854342 1088939416 /nfs/dbraw/zinc/93/94/16/1088939416.db2.gz BCYWBPFUEOPVLK-UHFFFAOYSA-N 1 0 357.523 4.098 20 10 FICDRO CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000122566287 1089495897 /nfs/dbraw/zinc/49/58/97/1089495897.db2.gz PTMAIGJQTUQZRO-UHFFFAOYSA-N 1 0 357.885 4.123 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2nccn2-c2ccccc2)c1O ZINC000377868986 1089907559 /nfs/dbraw/zinc/90/75/59/1089907559.db2.gz MYNDMQZGVZNKAP-CYBMUJFWSA-N 1 0 357.841 4.091 20 10 FICDRO COc1ccccc1CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000756351446 1090010218 /nfs/dbraw/zinc/01/02/18/1090010218.db2.gz LHJIEPCAFZNVBN-LBPRGKRZSA-N 1 0 350.256 4.057 20 10 FICDRO CCOc1ccccc1Oc1ccc(C[NH2+]Cc2cc(F)ccc2O)cn1 ZINC000180487558 1090207823 /nfs/dbraw/zinc/20/78/23/1090207823.db2.gz PBJYZSDJXBSQEC-UHFFFAOYSA-N 1 0 368.408 4.407 20 10 FICDRO Cc1cccc(C[NH2+]Cc2ccc(NC(=O)c3ccc(F)cc3)cc2)c1O ZINC000181382857 1090275583 /nfs/dbraw/zinc/27/55/83/1090275583.db2.gz CEHSVSUQYJNBFH-UHFFFAOYSA-N 1 0 364.420 4.382 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c(O)c1OC ZINC000893346230 1091167808 /nfs/dbraw/zinc/16/78/08/1091167808.db2.gz PWNPWJKMOVSPQB-UHFFFAOYSA-N 1 0 357.450 4.021 20 10 FICDRO CN1CCCc2cc(C[NH2+]Cc3cc(Br)cs3)ccc21 ZINC000058477177 1091835095 /nfs/dbraw/zinc/83/50/95/1091835095.db2.gz MQJKECDYFRZIFS-UHFFFAOYSA-N 1 0 351.313 4.183 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN([C@H](C)c3ccc(F)cc3F)CC2)cc1C ZINC000728908600 1091982511 /nfs/dbraw/zinc/98/25/11/1091982511.db2.gz HAIVOWKBBZHCCB-MRXNPFEDSA-N 1 0 360.448 4.166 20 10 FICDRO CC(C)(C)c1cc(C[NH2+]CCCN2CCCC2=O)c(O)c(C(C)(C)C)c1 ZINC000236778573 1092421276 /nfs/dbraw/zinc/42/12/76/1092421276.db2.gz YUAQHNVOHLKJHO-UHFFFAOYSA-N 1 0 360.542 4.089 20 10 FICDRO C[NH+](C)CCOc1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000236977173 1093278529 /nfs/dbraw/zinc/27/85/29/1093278529.db2.gz XPOZYDAAEYTCFV-UHFFFAOYSA-N 1 0 353.510 4.229 20 10 FICDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccc(Br)cc1 ZINC000783517599 1093375831 /nfs/dbraw/zinc/37/58/31/1093375831.db2.gz LPMYUMWNTYWEMW-OLZOCXBDSA-N 1 0 350.256 4.273 20 10 FICDRO Oc1c(C[NH2+]CC[C@@H]2CCC3(CCOCC3)CO2)ccc2ccccc21 ZINC000895800156 1093724807 /nfs/dbraw/zinc/72/48/07/1093724807.db2.gz QMXXPPOSBPVEMP-IBGZPJMESA-N 1 0 355.478 4.001 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]C[C@H](C)CSc2ccccc2OC)c1 ZINC000237047001 1093761945 /nfs/dbraw/zinc/76/19/45/1093761945.db2.gz AUYHGMLBBWROLR-HNNXBMFYSA-N 1 0 361.507 4.318 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 ZINC000710382246 1094772697 /nfs/dbraw/zinc/77/26/97/1094772697.db2.gz MALIULWPXUJDPV-QGZVFWFLSA-N 1 0 362.514 4.216 20 10 FICDRO Cc1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000016386702 1095576620 /nfs/dbraw/zinc/57/66/20/1095576620.db2.gz QCZIXNAFCFNRHT-LJQANCHMSA-N 1 0 365.521 4.444 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)c(O)c1C ZINC000273359462 1096255260 /nfs/dbraw/zinc/25/52/60/1096255260.db2.gz DHYVTCAGRLMNRM-QZTJIDSGSA-N 1 0 353.510 4.280 20 10 FICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)c1ccco1 ZINC000273432566 1096261565 /nfs/dbraw/zinc/26/15/65/1096261565.db2.gz LJDLEKWDEQDLCC-SMDDNHRTSA-N 1 0 354.244 4.176 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccc2c(c1)CC(=O)N2C ZINC000273599650 1096278187 /nfs/dbraw/zinc/27/81/87/1096278187.db2.gz RQRLPDJKNZHLBW-GJZGRUSLSA-N 1 0 360.457 4.476 20 10 FICDRO c1ccc2oc(-c3ccc(N4CC[NH+]([C@H]5C[C@H]6C[C@H]6C5)CC4)cc3)nc2c1 ZINC001167959911 1098562264 /nfs/dbraw/zinc/56/22/64/1098562264.db2.gz UXFKZVMXGORCQZ-RUYXUALKSA-N 1 0 359.473 4.415 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)nc2)c1O ZINC000237398422 1099475401 /nfs/dbraw/zinc/47/54/01/1099475401.db2.gz ZEDMQUPDDLNRBH-UHFFFAOYSA-N 1 0 354.381 4.017 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@H](C)Oc3ccc(Cl)cc3)CC2)cc1 ZINC000760020815 1099570166 /nfs/dbraw/zinc/57/01/66/1099570166.db2.gz YAJUEYVLBXQWKN-INIZCTEOSA-N 1 0 374.912 4.375 20 10 FICDRO O=C(c1c(F)cc(F)cc1F)C1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180161346 1101574341 /nfs/dbraw/zinc/57/43/41/1101574341.db2.gz MWJHKKOEOLDBOW-UHFFFAOYSA-N 1 0 367.342 4.044 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1-n1cc(Cl)cn1)c1ccccc1O ZINC000191524924 1101947419 /nfs/dbraw/zinc/94/74/19/1101947419.db2.gz YAGFONFPCXRWLM-QGZVFWFLSA-N 1 0 356.857 4.176 20 10 FICDRO COc1cc(C)cc(CN[C@@H](C)c2noc(-c3ccc(Cl)cc3)n2)c1O ZINC000894628266 1102653065 /nfs/dbraw/zinc/65/30/65/1102653065.db2.gz DPENISITDJGXTC-LBPRGKRZSA-N 1 0 373.840 4.263 20 10 FICDRO Cc1noc(CCC[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n1 ZINC000729685630 1103291508 /nfs/dbraw/zinc/29/15/08/1103291508.db2.gz DKFGUNBNAOHGFC-UHFFFAOYSA-N 1 0 359.514 4.401 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1ccccc1O ZINC000760040630 1104996575 /nfs/dbraw/zinc/99/65/75/1104996575.db2.gz UESBLLQDOHKSHB-KSEOMHKRSA-N 1 0 357.469 4.346 20 10 FICDRO COc1ccccc1C[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237187978 1105004130 /nfs/dbraw/zinc/00/41/30/1105004130.db2.gz ALYPZFKFZLOPQP-INIZCTEOSA-N 1 0 362.420 4.055 20 10 FICDRO C[C@H](Nc1cc[nH+]c2cc(F)ccc12)c1ccc(N2CCOCC2)cc1 ZINC000301279287 1106979569 /nfs/dbraw/zinc/97/95/69/1106979569.db2.gz PLCOOTIKOQYRIE-HNNXBMFYSA-N 1 0 351.425 4.384 20 10 FICDRO COc1ccc(N2CC[NH+]([C@@H](C)c3ccc4c(c3)CCC4)CC2)cc1F ZINC001168067089 1107394057 /nfs/dbraw/zinc/39/40/57/1107394057.db2.gz DRURJQDIFGWYFG-INIZCTEOSA-N 1 0 354.469 4.206 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000479441656 1112024156 /nfs/dbraw/zinc/02/41/56/1112024156.db2.gz UVDSOLUHCWOTCG-NRFANRHFSA-N 1 0 356.473 4.350 20 10 FICDRO CC(=O)N1CC[C@H]([NH2+]Cc2c(C)c3ccccc3n2C)c2ccccc2C1 ZINC000479466212 1112042168 /nfs/dbraw/zinc/04/21/68/1112042168.db2.gz ZEUCSVDQATUQAN-NRFANRHFSA-N 1 0 361.489 4.070 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000163612298 1114095484 /nfs/dbraw/zinc/09/54/84/1114095484.db2.gz CZXWCMLMGCWSIZ-HXUWFJFHSA-N 1 0 371.506 4.389 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OC[C@@H]1CCCO1)c1ccccc1O ZINC000156336412 1114417398 /nfs/dbraw/zinc/41/73/98/1114417398.db2.gz BPVPRSOOPGTPJM-ICSRJNTNSA-N 1 0 355.478 4.499 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1O ZINC000156446516 1114442164 /nfs/dbraw/zinc/44/21/64/1114442164.db2.gz HCFQLMNOBKGYMQ-HXUWFJFHSA-N 1 0 352.478 4.259 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(O)CC3)c(F)c1)CCC2 ZINC000166283797 1114970286 /nfs/dbraw/zinc/97/02/86/1114970286.db2.gz HZFAMNQPFVJBOK-QFIPXVFZSA-N 1 0 368.496 4.262 20 10 FICDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000157416778 1115103450 /nfs/dbraw/zinc/10/34/50/1115103450.db2.gz DMQXTXSXELFHOU-QZTJIDSGSA-N 1 0 368.521 4.454 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+]Cc1ccccc1Br ZINC000227442036 1115564323 /nfs/dbraw/zinc/56/43/23/1115564323.db2.gz PSXYYYZQCQVHKZ-UHFFFAOYSA-N 1 0 371.072 4.207 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000227436540 1115564346 /nfs/dbraw/zinc/56/43/46/1115564346.db2.gz BKUYUHQFOSVROO-CMPLNLGQSA-N 1 0 352.194 4.365 20 10 FICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1O ZINC000761193960 1115613169 /nfs/dbraw/zinc/61/31/69/1115613169.db2.gz LMXBYHPVUKKNCS-HNNXBMFYSA-N 1 0 361.825 4.120 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](O)c2c(F)cccc2Cl)c1O ZINC000761206472 1115621913 /nfs/dbraw/zinc/62/19/13/1115621913.db2.gz HTLSCRFMSJZCAR-FVMDXXJSSA-N 1 0 374.239 4.058 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](O)c2c(F)cccc2Cl)c1O ZINC000761206474 1115622154 /nfs/dbraw/zinc/62/21/54/1115622154.db2.gz HTLSCRFMSJZCAR-XXFAHNHDSA-N 1 0 374.239 4.058 20 10 FICDRO Fc1cc(C[NH2+]Cc2c(Cl)oc3ccccc32)ccc1N1CCOCC1 ZINC000761295297 1115769106 /nfs/dbraw/zinc/76/91/06/1115769106.db2.gz WUUBWCSOSVTCTJ-UHFFFAOYSA-N 1 0 374.843 4.352 20 10 FICDRO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000171133266 1115840561 /nfs/dbraw/zinc/84/05/61/1115840561.db2.gz LAJGDFDERZWMKQ-QGZVFWFLSA-N 1 0 372.484 4.302 20 10 FICDRO C[NH+]1CCC(N2C(=O)/C(=C/c3ccc4ccccc4c3)SC2=S)CC1 ZINC000063824358 1116114984 /nfs/dbraw/zinc/11/49/84/1116114984.db2.gz JRLIBKCFNIQKFH-AQTBWJFISA-N 1 0 368.527 4.135 20 10 FICDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)s1 ZINC000761433246 1118059390 /nfs/dbraw/zinc/05/93/90/1118059390.db2.gz SXBCJJRSXKNFAF-MJBXVCDLSA-N 1 0 363.502 4.055 20 10 FICDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1 ZINC000151562000 1118528094 /nfs/dbraw/zinc/52/80/94/1118528094.db2.gz QSJRNJZVPLFUTK-SFHVURJKSA-N 1 0 352.522 4.309 20 10 FICDRO Cc1cc(CC[NH2+]C[C@@H](O)c2ccccc2F)c(C)n1-c1ccccc1 ZINC000914580227 1120388919 /nfs/dbraw/zinc/38/89/19/1120388919.db2.gz CYCDBNVVUDTNEN-JOCHJYFZSA-N 1 0 352.453 4.099 20 10 FICDRO COc1cc(C[NH+]2CCC(c3ccncc3)CC2)c(O)c(C(C)(C)C)c1 ZINC000762097584 1120709883 /nfs/dbraw/zinc/70/98/83/1120709883.db2.gz CNOXLMORHUSGJJ-UHFFFAOYSA-N 1 0 354.494 4.473 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cccc(COCc3ccco3)c2)cc1 ZINC000915229605 1120888110 /nfs/dbraw/zinc/88/81/10/1120888110.db2.gz KZGOVJJWEIQVJE-UHFFFAOYSA-N 1 0 350.462 4.352 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]CC2(c3ccccc3)CCOCC2)cc1 ZINC000915229748 1120888750 /nfs/dbraw/zinc/88/87/50/1120888750.db2.gz PIWXZTIIRCEGRR-UHFFFAOYSA-N 1 0 352.522 4.371 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1cc(Cl)ccc1O ZINC000762641292 1120942713 /nfs/dbraw/zinc/94/27/13/1120942713.db2.gz HAXYQOQHXOWMBY-HEHGZKQESA-N 1 0 368.905 4.342 20 10 FICDRO CC(C)[C@H](CCO)[NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000763020222 1121092089 /nfs/dbraw/zinc/09/20/89/1121092089.db2.gz NFDAZIHJMBQJNX-IBGZPJMESA-N 1 0 354.454 4.037 20 10 FICDRO CC(C)[C@@H](CCO)[NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000763020225 1121092179 /nfs/dbraw/zinc/09/21/79/1121092179.db2.gz NFDAZIHJMBQJNX-LJQANCHMSA-N 1 0 354.454 4.037 20 10 FICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1[N+](=O)[O-] ZINC000153818935 1121400213 /nfs/dbraw/zinc/40/02/13/1121400213.db2.gz TXPUTYXXQKYVKZ-OAHLLOKOSA-N 1 0 357.454 4.219 20 10 FICDRO CC[NH+]1CCC(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CC1 ZINC000916160315 1121432232 /nfs/dbraw/zinc/43/22/32/1121432232.db2.gz BEAVEBGLDIFCNH-UHFFFAOYSA-N 1 0 367.537 4.432 20 10 FICDRO CC(C)c1ccc(C[C@@H]2CC[N@H+](Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 ZINC000763392399 1121574756 /nfs/dbraw/zinc/57/47/56/1121574756.db2.gz HLDKWDUXMLCIEJ-HTAPYJJXSA-N 1 0 367.489 4.006 20 10 FICDRO Cc1cc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)cc(C)c1O ZINC000916835947 1121877661 /nfs/dbraw/zinc/87/76/61/1121877661.db2.gz DTHIHOUCBXATDN-CALCHBBNSA-N 1 0 372.484 4.052 20 10 FICDRO CC(C)(C)C1CCC([NH2+]Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 ZINC000917394395 1122286836 /nfs/dbraw/zinc/28/68/36/1122286836.db2.gz OODUBRSPFHLODL-XEVCZEQESA-N 1 0 371.569 4.083 20 10 FICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000917451797 1122318780 /nfs/dbraw/zinc/31/87/80/1122318780.db2.gz LWVLVMDGJKALBS-UHFFFAOYSA-N 1 0 355.441 4.289 20 10 FICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1Cc1c(F)cccc1Cl)OCO2 ZINC000917474254 1122322024 /nfs/dbraw/zinc/32/20/24/1122322024.db2.gz XVDQMRPDHAZJEX-ZDUSSCGKSA-N 1 0 363.816 4.121 20 10 FICDRO C[C@@H]([NH2+]Cc1cccnc1N(C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154728995 1122650539 /nfs/dbraw/zinc/65/05/39/1122650539.db2.gz ZFGHALYYWZASPH-MRXNPFEDSA-N 1 0 356.489 4.128 20 10 FICDRO Oc1cc2c(cc1C[NH+]1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CCC2 ZINC000918736714 1122766643 /nfs/dbraw/zinc/76/66/43/1122766643.db2.gz XNGKWZTUONXOKC-KBPBESRZSA-N 1 0 367.333 4.444 20 10 FICDRO COC(=O)c1cc2ccccc2c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000919952471 1123280159 /nfs/dbraw/zinc/28/01/59/1123280159.db2.gz WCJMKANUIDTWOV-HXUWFJFHSA-N 1 0 362.429 4.064 20 10 FICDRO O=C(C[NH2+]Cc1ccc(N2CCCCC2)cc1)Nc1ccc(Cl)cc1 ZINC000920179728 1123396740 /nfs/dbraw/zinc/39/67/40/1123396740.db2.gz BARJCTGNEXUSKQ-UHFFFAOYSA-N 1 0 357.885 4.059 20 10 FICDRO Cc1cc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c(O)c(C(C)(C)C)c1 ZINC000175254249 1123792895 /nfs/dbraw/zinc/79/28/95/1123792895.db2.gz OCIMOBNQVBVIBF-LJQANCHMSA-N 1 0 361.526 4.158 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@@H](COc2ccccc2F)c2ccccc2)c1 ZINC000180907115 1124465284 /nfs/dbraw/zinc/46/52/84/1124465284.db2.gz WQCRIFBXWCKRMA-FQEVSTJZSA-N 1 0 367.420 4.450 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Br)cc(Cl)c2[O-])cn1 ZINC000756383026 1125015491 /nfs/dbraw/zinc/01/54/91/1125015491.db2.gz VKVXTSKVTMYYKU-SECBINFHSA-N 1 0 371.662 4.063 20 10 FICDRO COc1ccccc1N1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143104223 1125264995 /nfs/dbraw/zinc/26/49/95/1125264995.db2.gz QVZIAZQSVNLRCS-UHFFFAOYSA-N 1 0 354.494 4.021 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(CCc3ccccc3)n2)c1 ZINC000182325694 1125411365 /nfs/dbraw/zinc/41/13/65/1125411365.db2.gz VEIZPKWPGAGKMA-OAHLLOKOSA-N 1 0 368.502 4.493 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(Nc3ccccc3)n2)c1 ZINC000182339103 1125414977 /nfs/dbraw/zinc/41/49/77/1125414977.db2.gz MBALBFODQQJSEH-CYBMUJFWSA-N 1 0 355.463 4.452 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(SC(=O)N(C)C)cc2)c1 ZINC000182348590 1125426167 /nfs/dbraw/zinc/42/61/67/1125426167.db2.gz PTHUIBHPOLYWIE-ZDUSSCGKSA-N 1 0 360.479 4.025 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OCC(F)(F)F)c2)c1 ZINC000182433627 1125503408 /nfs/dbraw/zinc/50/34/08/1125503408.db2.gz KGORITDBCSZXTA-LBPRGKRZSA-N 1 0 355.356 4.193 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(N2CCCOC2=O)cc1 ZINC000922144851 1125542600 /nfs/dbraw/zinc/54/26/00/1125542600.db2.gz IHQJSSIZUWRPSM-MRXNPFEDSA-N 1 0 366.461 4.209 20 10 FICDRO Cc1cccc(C[NH2+]C[C@@H](O)c2cccc(OCc3ccccc3)c2)c1O ZINC000182618781 1125581179 /nfs/dbraw/zinc/58/11/79/1125581179.db2.gz RSSHDQJEKSWWAL-JOCHJYFZSA-N 1 0 363.457 4.103 20 10 FICDRO Oc1cc(OCc2ccccc2)ccc1CN1CCCC[C@@H]1c1ncc[nH]1 ZINC000183028676 1125722445 /nfs/dbraw/zinc/72/24/45/1125722445.db2.gz JQWFRKPYGDQATN-HXUWFJFHSA-N 1 0 363.461 4.422 20 10 FICDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(N2CCOCC2)cc1Cl ZINC000120414488 1080041218 /nfs/dbraw/zinc/04/12/18/1080041218.db2.gz IFWYXFFXTHANJP-RDTXWAMCSA-N 1 0 354.947 4.113 20 10 FICDRO CC(=O)c1cc(Cl)cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1O ZINC001167107622 1080552460 /nfs/dbraw/zinc/55/24/60/1080552460.db2.gz FMZXKTAMVXLHKG-UHFFFAOYSA-N 1 0 372.896 4.479 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000155307775 1080782429 /nfs/dbraw/zinc/78/24/29/1080782429.db2.gz JZUAXAYPKBWWLW-DLBZAZTESA-N 1 0 369.465 4.152 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1F ZINC001648903380 1081360014 /nfs/dbraw/zinc/36/00/14/1081360014.db2.gz OAUVPXNRGJLNNY-PLNGDYQASA-N 1 0 364.468 4.189 20 10 FICDRO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000155495710 1081398579 /nfs/dbraw/zinc/39/85/79/1081398579.db2.gz WATCDVZMBIBZOY-KRWDZBQOSA-N 1 0 351.494 4.486 20 10 FICDRO Oc1ccccc1C[N@@H+](C[C@H](O)Cc1cccc(Cl)c1)C1CCCC1 ZINC001167353147 1081592346 /nfs/dbraw/zinc/59/23/46/1081592346.db2.gz FZLQTQZGHSLEAA-HXUWFJFHSA-N 1 0 359.897 4.394 20 10 FICDRO Cc1ccccc1C1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCOCC1 ZINC001648909456 1081954790 /nfs/dbraw/zinc/95/47/90/1081954790.db2.gz IIICLJFMZGMNTB-UHFFFAOYSA-N 1 0 364.533 4.433 20 10 FICDRO COc1cccc2c1OC[C@@H]([NH2+]Cc1cc(-c3ccccc3)ccc1O)C2 ZINC000728300729 1082013448 /nfs/dbraw/zinc/01/34/48/1082013448.db2.gz YNUJNRZUPFSGOO-FQEVSTJZSA-N 1 0 361.441 4.161 20 10 FICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CN1Cc1ccccc1 ZINC000398086458 1082019157 /nfs/dbraw/zinc/01/91/57/1082019157.db2.gz IFECGFOHACYQBF-OFNKIYASSA-N 1 0 363.549 4.430 20 10 FICDRO C[C@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CCOCC1 ZINC000588382675 1082023693 /nfs/dbraw/zinc/02/36/93/1082023693.db2.gz YKTVDQUEZOEHND-INIZCTEOSA-N 1 0 366.465 4.445 20 10 FICDRO Cc1cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)ccc1OC(C)C ZINC001167437622 1082206215 /nfs/dbraw/zinc/20/62/15/1082206215.db2.gz VWOWTASEJOJXJE-UHFFFAOYSA-N 1 0 353.510 4.146 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CN2CCCC2=O)c2ccccc2)cc1 ZINC000160679186 1082207046 /nfs/dbraw/zinc/20/70/46/1082207046.db2.gz LVWRUTXNIJFQQY-AVRDEDQJSA-N 1 0 365.521 4.157 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]([NH2+]C(C)C)C2)c(C)n1-c1cccc(C)c1 ZINC000728605805 1083544662 /nfs/dbraw/zinc/54/46/62/1083544662.db2.gz JJCXWUIWZVJVLS-LJQANCHMSA-N 1 0 353.510 4.005 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)c2ccccc2)n1 ZINC000277004753 1083706793 /nfs/dbraw/zinc/70/67/93/1083706793.db2.gz BARNQKUENKEZER-QRWLVFNGSA-N 1 0 350.466 4.079 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](Cc2nc(C)no2)c2ccccc2)cc1 ZINC000277046587 1083727057 /nfs/dbraw/zinc/72/70/57/1083727057.db2.gz GQCPSYVEVHKVMQ-KKSFZXQISA-N 1 0 364.493 4.469 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1Cl ZINC000177245881 1083779508 /nfs/dbraw/zinc/77/95/08/1083779508.db2.gz TYBQOERMWFDBBF-MRXNPFEDSA-N 1 0 358.913 4.400 20 10 FICDRO Cc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2cccc(Br)c2)c1O ZINC001140749776 1083906186 /nfs/dbraw/zinc/90/61/86/1083906186.db2.gz MKWWPZKUQNETQY-LBPRGKRZSA-N 1 0 350.256 4.362 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(N(C)C)cc1 ZINC000156964493 1084279434 /nfs/dbraw/zinc/27/94/34/1084279434.db2.gz ZONOAAPVIQSRBF-HOTGVXAUSA-N 1 0 353.466 4.121 20 10 FICDRO Cc1csc(=O)n1CC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176682759 1085176827 /nfs/dbraw/zinc/17/68/27/1085176827.db2.gz IPEVQQLNLAVFDG-QGZVFWFLSA-N 1 0 368.502 4.187 20 10 FICDRO Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178697045 1085879310 /nfs/dbraw/zinc/87/93/10/1085879310.db2.gz XBXZJVGEESCQSF-DLBZAZTESA-N 1 0 358.505 4.308 20 10 FICDRO COc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc(C(F)(F)F)c1 ZINC001143519912 1085939645 /nfs/dbraw/zinc/93/96/45/1085939645.db2.gz ZEXNHXDBDWKLCU-UHFFFAOYSA-N 1 0 352.400 4.412 20 10 FICDRO CC(C)CCn1cccc1C[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000161769427 1086792191 /nfs/dbraw/zinc/79/21/91/1086792191.db2.gz KCPGNZLLMLLRAT-UHFFFAOYSA-N 1 0 369.553 4.033 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2cccc(Cl)c2)SC1=S ZINC000255647252 1087722865 /nfs/dbraw/zinc/72/28/65/1087722865.db2.gz AZYSQNHRGUWTOG-NTEUORMPSA-N 1 0 368.955 4.129 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)c1 ZINC000311310920 1088543567 /nfs/dbraw/zinc/54/35/67/1088543567.db2.gz WFJUIOZVMZTTCA-QGZVFWFLSA-N 1 0 360.498 4.112 20 10 FICDRO C[C@H]([NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000311303172 1088547947 /nfs/dbraw/zinc/54/79/47/1088547947.db2.gz OANJYCHLJFYUHP-WMZOPIPTSA-N 1 0 361.530 4.193 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311305402 1088549547 /nfs/dbraw/zinc/54/95/47/1088549547.db2.gz PSCUNSGBUYIDMR-HRAATJIYSA-N 1 0 362.514 4.388 20 10 FICDRO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000179946607 1090135674 /nfs/dbraw/zinc/13/56/74/1090135674.db2.gz UWZCOPGXTWKBCS-LJQANCHMSA-N 1 0 351.450 4.108 20 10 FICDRO C[C@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000183161945 1090394748 /nfs/dbraw/zinc/39/47/48/1090394748.db2.gz KJRNIXCERZIBCR-IERDGZPVSA-N 1 0 367.445 4.166 20 10 FICDRO Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000184906320 1090489165 /nfs/dbraw/zinc/48/91/65/1090489165.db2.gz FOUBXZUAVLLFNO-CQSZACIVSA-N 1 0 353.441 4.244 20 10 FICDRO COCCOc1ccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cc1 ZINC000185012417 1090495907 /nfs/dbraw/zinc/49/59/07/1090495907.db2.gz FBYXHEOXJOGXIY-INIZCTEOSA-N 1 0 355.478 4.147 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)c(O)c1 ZINC000185566091 1090553978 /nfs/dbraw/zinc/55/39/78/1090553978.db2.gz DZXJMNYZWNHGMA-KRWDZBQOSA-N 1 0 353.510 4.086 20 10 FICDRO COC(=O)N1CCC([C@H](C)[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000186765656 1090685823 /nfs/dbraw/zinc/68/58/23/1090685823.db2.gz LBNWYEHLCVBHOL-MSOLQXFVSA-N 1 0 373.541 4.194 20 10 FICDRO CCOc1cccc(C[NH2+][C@H](C)Cc2ccccc2Br)c1O ZINC000759838325 1091283867 /nfs/dbraw/zinc/28/38/67/1091283867.db2.gz ZSYPDRBSRZDVJR-CYBMUJFWSA-N 1 0 364.283 4.274 20 10 FICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000193995921 1091340925 /nfs/dbraw/zinc/34/09/25/1091340925.db2.gz LMXQIMWXDVPOTO-HRAATJIYSA-N 1 0 374.912 4.215 20 10 FICDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000756637619 1091678484 /nfs/dbraw/zinc/67/84/84/1091678484.db2.gz ODOZFDIEZQGYOL-BBRMVZONSA-N 1 0 364.283 4.063 20 10 FICDRO CCOc1cc2c(cc1C[NH2+]Cc1ccc(N(C)C)cc1C)O[C@H](C)C2 ZINC000236844622 1091840713 /nfs/dbraw/zinc/84/07/13/1091840713.db2.gz XTBFHFRWQWBHSN-MRXNPFEDSA-N 1 0 354.494 4.073 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(Br)cn2)c1O ZINC000279794749 1092046956 /nfs/dbraw/zinc/04/69/56/1092046956.db2.gz MTCHZIVZJQQYHL-VIFPVBQESA-N 1 0 371.662 4.063 20 10 FICDRO COc1ccc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)c(O)c1OC ZINC000895186747 1093144436 /nfs/dbraw/zinc/14/44/36/1093144436.db2.gz AZNPHKRTCZARHU-UHFFFAOYSA-N 1 0 367.367 4.207 20 10 FICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(COC2CCOCC2)cc1 ZINC000126985447 1093579387 /nfs/dbraw/zinc/57/93/87/1093579387.db2.gz ZJXRVMQYXJLYHN-UHFFFAOYSA-N 1 0 361.869 4.031 20 10 FICDRO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000728979350 1093911129 /nfs/dbraw/zinc/91/11/29/1093911129.db2.gz UYISYAGATSNYAZ-INIZCTEOSA-N 1 0 370.493 4.124 20 10 FICDRO CC[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000280267531 1094316640 /nfs/dbraw/zinc/31/66/40/1094316640.db2.gz XRADIZKBSVYULR-PZJWPPBQSA-N 1 0 353.441 4.404 20 10 FICDRO CC[C@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)c1ccsc1 ZINC000840757434 1095911836 /nfs/dbraw/zinc/91/18/36/1095911836.db2.gz KGPGHMOLFXMMNG-KRWDZBQOSA-N 1 0 352.450 4.104 20 10 FICDRO CC[C@@H]([NH2+]C[C@@H]1CSCCN1Cc1ccccc1)c1ccccc1O ZINC000760017664 1096138391 /nfs/dbraw/zinc/13/83/91/1096138391.db2.gz NNKXZDHTSGUJBN-UYAOXDASSA-N 1 0 356.535 4.051 20 10 FICDRO COc1cccc(C[NH2+]CCc2ccc(OCc3ccccc3)cc2)c1O ZINC000237375490 1099442970 /nfs/dbraw/zinc/44/29/70/1099442970.db2.gz XEGWWQQDUGMBPR-UHFFFAOYSA-N 1 0 363.457 4.312 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccccc1N1CCO[C@@H](C)C1 ZINC000459499178 1100237271 /nfs/dbraw/zinc/23/72/71/1100237271.db2.gz DNDMNMRKDHOYPC-KRWDZBQOSA-N 1 0 363.505 4.002 20 10 FICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccccc2OC(F)(F)F)c1O ZINC000219095721 1101366008 /nfs/dbraw/zinc/36/60/08/1101366008.db2.gz XGGIRPSDJLNKHH-UHFFFAOYSA-N 1 0 355.356 4.240 20 10 FICDRO [O-]c1cc(F)c(F)cc1C[N@H+]1C[C@H]2c3ccccc3[C@@H](OCC3CC3)[C@H]2C1 ZINC001142520185 1102138026 /nfs/dbraw/zinc/13/80/26/1102138026.db2.gz CXWVOKZCJCMTCS-NPPFBWRTSA-N 1 0 371.427 4.367 20 10 FICDRO C[C@@H]1CCCN(C(=O)C2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)C1 ZINC000054471345 1102981870 /nfs/dbraw/zinc/98/18/70/1102981870.db2.gz WFSAVFDAMCZRPR-QGZVFWFLSA-N 1 0 366.505 4.016 20 10 FICDRO CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3Br)c(O)c1 ZINC000729685252 1103063152 /nfs/dbraw/zinc/06/31/52/1103063152.db2.gz ADNKODXZFITZRQ-KRWDZBQOSA-N 1 0 362.267 4.331 20 10 FICDRO C[C@H]([NH2+]C[C@@H](O)c1ccccc1C(F)(F)F)c1ccc(Cl)cc1O ZINC000841748387 1103184424 /nfs/dbraw/zinc/18/44/24/1103184424.db2.gz XNYGNYYHCXXUQS-MGPLVRAMSA-N 1 0 359.775 4.449 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c1 ZINC000760037091 1104925911 /nfs/dbraw/zinc/92/59/11/1104925911.db2.gz HETRDOFFOOMZOD-SSKFGXFMSA-N 1 0 357.469 4.264 20 10 FICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000783596610 1107693446 /nfs/dbraw/zinc/69/34/46/1107693446.db2.gz YYGAJCLOCDJXRK-NSHDSACASA-N 1 0 359.779 4.098 20 10 FICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCc4nc(C(C)C)ncc4C3)c2c1 ZINC000527612566 1109787421 /nfs/dbraw/zinc/78/74/21/1109787421.db2.gz ISAVRXVNUMHQOP-UHFFFAOYSA-N 1 0 363.461 4.026 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]Cc2cc(F)c(Br)cc2F)c1 ZINC000527791431 1109824634 /nfs/dbraw/zinc/82/46/34/1109824634.db2.gz LLSAIEMBIJWJHB-UHFFFAOYSA-N 1 0 372.209 4.121 20 10 FICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cc(F)c(Br)cc1F)CC2 ZINC000527977199 1109873471 /nfs/dbraw/zinc/87/34/71/1109873471.db2.gz CPYFHIRXURPSRL-AWEZNQCLSA-N 1 0 354.194 4.210 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cnc3cc(C)nn3c2C)cc1 ZINC000179400813 1113350902 /nfs/dbraw/zinc/35/09/02/1113350902.db2.gz FYBYNLSDDBTMDX-MRXNPFEDSA-N 1 0 351.498 4.043 20 10 FICDRO Cc1c([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cccc1[N+](=O)[O-] ZINC000163607342 1113993955 /nfs/dbraw/zinc/99/39/55/1113993955.db2.gz CVLKXKPWGVKPPI-INIZCTEOSA-N 1 0 371.506 4.307 20 10 FICDRO CCC[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000151058217 1114279917 /nfs/dbraw/zinc/27/99/17/1114279917.db2.gz LOQNQXMKCGJRNL-QFIPXVFZSA-N 1 0 354.494 4.163 20 10 FICDRO N#Cc1ccc2ncc(C[N@@H+](Cc3ccccc3O)C3CCCCC3)n2c1 ZINC000156779067 1114562138 /nfs/dbraw/zinc/56/21/38/1114562138.db2.gz XFVVSMPBDULWEX-UHFFFAOYSA-N 1 0 360.461 4.246 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c(C)n1-c1cc(C)cc(C)c1 ZINC000760766002 1114901742 /nfs/dbraw/zinc/90/17/42/1114901742.db2.gz XCCORDHQUAFYHM-FQEVSTJZSA-N 1 0 367.537 4.267 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000157409205 1115101983 /nfs/dbraw/zinc/10/19/83/1115101983.db2.gz RTMUFHGTVNCXSW-MRXNPFEDSA-N 1 0 369.465 4.231 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)[C@@]12CCCO2 ZINC000760881422 1115120295 /nfs/dbraw/zinc/12/02/95/1115120295.db2.gz ORCVRSRAQMBHQQ-MVWVFHAYSA-N 1 0 358.526 4.054 20 10 FICDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl ZINC000760905895 1115169830 /nfs/dbraw/zinc/16/98/30/1115169830.db2.gz LXMOMSRGAUBACA-WMZOPIPTSA-N 1 0 366.933 4.177 20 10 FICDRO C[C@@H]([NH2+]CCCOC[C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000158225530 1115546122 /nfs/dbraw/zinc/54/61/22/1115546122.db2.gz HQBSMMILNKHMHT-WOJBJXKFSA-N 1 0 360.542 4.161 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000227436546 1115564530 /nfs/dbraw/zinc/56/45/30/1115564530.db2.gz BKUYUHQFOSVROO-JQWIXIFHSA-N 1 0 352.194 4.365 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1O ZINC000761197991 1115617971 /nfs/dbraw/zinc/61/79/71/1115617971.db2.gz JWRBYXDALGDKRQ-OAHLLOKOSA-N 1 0 351.805 4.197 20 10 FICDRO Cc1nn(-c2cc[nH+]cc2)cc1CN1CCCc2cc(OC(F)F)ccc21 ZINC000761221273 1115665996 /nfs/dbraw/zinc/66/59/96/1115665996.db2.gz GXMWKFIAJDKSNH-UHFFFAOYSA-N 1 0 370.403 4.130 20 10 FICDRO COc1ccc(C[C@H](C)C[N@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000761295612 1115769140 /nfs/dbraw/zinc/76/91/40/1115769140.db2.gz ZDQSAUWHGHHUPZ-INIZCTEOSA-N 1 0 350.462 4.260 20 10 FICDRO Oc1ccccc1C[N@H+](Cc1cncc(Br)c1)C1CCCC1 ZINC000171943289 1115894198 /nfs/dbraw/zinc/89/41/98/1115894198.db2.gz PAFZXJIHOBVJMM-UHFFFAOYSA-N 1 0 361.283 4.495 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(CNC(=O)OC(C)(C)C)cc1)c1cc(F)ccc1O ZINC000312200020 1118290707 /nfs/dbraw/zinc/29/07/07/1118290707.db2.gz DARMJJZJAFVRQN-CQSZACIVSA-N 1 0 374.456 4.407 20 10 FICDRO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151567428 1118566570 /nfs/dbraw/zinc/56/65/70/1118566570.db2.gz JBNWGILLLIYDBO-LJQANCHMSA-N 1 0 352.522 4.363 20 10 FICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000151588862 1118942117 /nfs/dbraw/zinc/94/21/17/1118942117.db2.gz RROFNWLZHKLGIJ-GOSISDBHSA-N 1 0 368.521 4.145 20 10 FICDRO COc1ccc(C[C@@H](C)C[NH2+]CCCSc2nccs2)cc1F ZINC000761525489 1119411973 /nfs/dbraw/zinc/41/19/73/1119411973.db2.gz KPRTVOXRSZONKI-CYBMUJFWSA-N 1 0 354.516 4.241 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)CCCO2 ZINC000153142716 1120028337 /nfs/dbraw/zinc/02/83/37/1120028337.db2.gz RAKDEEHNIXTZTK-QFIPXVFZSA-N 1 0 366.505 4.089 20 10 FICDRO CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(C[NH+](CC)CC)cc1 ZINC000915063174 1120772732 /nfs/dbraw/zinc/77/27/32/1120772732.db2.gz FWABIAMFPLSMFQ-UHFFFAOYSA-N 1 0 367.537 4.257 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(OC)c2O)cc1Br ZINC000237229826 1120974963 /nfs/dbraw/zinc/97/49/63/1120974963.db2.gz CIQZMCZMHBOVBF-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO COc1cc(C[N@H+](C)Cc2ccc(OC)c(OC)c2)c(O)c(C(C)(C)C)c1 ZINC000915818249 1121082791 /nfs/dbraw/zinc/08/27/91/1121082791.db2.gz WAKQSOVMAQUMEY-UHFFFAOYSA-N 1 0 373.493 4.348 20 10 FICDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@H]1CCOC1 ZINC000763117302 1121132274 /nfs/dbraw/zinc/13/22/74/1121132274.db2.gz WDHJLYYROXPNIO-CVEARBPZSA-N 1 0 352.438 4.055 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1cc2c(cc1O)CCCC2 ZINC000186183792 1121397246 /nfs/dbraw/zinc/39/72/46/1121397246.db2.gz MRAROHQBGJIVBD-JKSUJKDBSA-N 1 0 362.477 4.264 20 10 FICDRO CC(C)c1ccc(C[C@@H]2CC[N@H+](Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 ZINC000763392403 1121575563 /nfs/dbraw/zinc/57/55/63/1121575563.db2.gz HLDKWDUXMLCIEJ-JTSKRJEESA-N 1 0 367.489 4.006 20 10 FICDRO CC(C)(C)OC(=O)NC[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000139961000 1121586034 /nfs/dbraw/zinc/58/60/34/1121586034.db2.gz FDLQKRMUCADQIR-INIZCTEOSA-N 1 0 370.493 4.282 20 10 FICDRO CN(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001649091635 1121722161 /nfs/dbraw/zinc/72/21/61/1121722161.db2.gz SWZJBYWAVCCOIN-LEWJYISDSA-N 1 0 357.567 4.347 20 10 FICDRO CCc1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 ZINC000916835874 1121876681 /nfs/dbraw/zinc/87/66/81/1121876681.db2.gz BHAIHKLGKHPJRT-IAGOWNOFSA-N 1 0 356.485 4.292 20 10 FICDRO Cc1cc(C[NH2+]C2CCC3(CC2)OCCO3)c(C)n1-c1cccc(C)c1 ZINC000916835023 1121877199 /nfs/dbraw/zinc/87/71/99/1121877199.db2.gz AARGEQAADGVXIJ-UHFFFAOYSA-N 1 0 354.494 4.178 20 10 FICDRO FC(F)(F)CO[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000916836699 1121877709 /nfs/dbraw/zinc/87/77/09/1121877709.db2.gz KJSSRVVOUCPMRS-GOSISDBHSA-N 1 0 356.432 4.220 20 10 FICDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 ZINC000916837796 1121878626 /nfs/dbraw/zinc/87/86/26/1121878626.db2.gz ZNXQPDDJMCIMST-YKTARERQSA-N 1 0 372.484 4.446 20 10 FICDRO C[NH+](C)Cc1ccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 ZINC000916840878 1121883466 /nfs/dbraw/zinc/88/34/66/1121883466.db2.gz IPZZTWCFIPCVTC-UHFFFAOYSA-N 1 0 368.481 4.259 20 10 FICDRO COc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-] ZINC000917019885 1122008125 /nfs/dbraw/zinc/00/81/25/1122008125.db2.gz LCRJPZFILDOCBS-UHFFFAOYSA-N 1 0 369.465 4.226 20 10 FICDRO COc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000917075451 1122070312 /nfs/dbraw/zinc/07/03/12/1122070312.db2.gz VZQOKYOACHKQKU-UHFFFAOYSA-N 1 0 357.454 4.080 20 10 FICDRO Cc1cc(C(=O)N[C@@H](C)Cn2ccnc2)c(C)n1-c1cccc(C(C)C)c1 ZINC000918584895 1122714389 /nfs/dbraw/zinc/71/43/89/1122714389.db2.gz NESPYBJBJGRBFV-INIZCTEOSA-N 1 0 364.493 4.233 20 10 FICDRO C[C@@H]([NH2+]Cc1cccnc1N(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000154781389 1122741171 /nfs/dbraw/zinc/74/11/71/1122741171.db2.gz NKAGPJRDMQXDTF-GOSISDBHSA-N 1 0 352.526 4.379 20 10 FICDRO C[C@@H](c1ccccc1)[N@H+](Cc1cn2cccnc2n1)Cc1ccccc1O ZINC000179645525 1124020506 /nfs/dbraw/zinc/02/05/06/1124020506.db2.gz NHTUGKZQACUMKS-KRWDZBQOSA-N 1 0 358.445 4.198 20 10 FICDRO Cc1cc(C(=O)N2CCC([NH2+]CC3CC3)CC2)c(C)n1-c1cccc(C)c1 ZINC000237887514 1124150183 /nfs/dbraw/zinc/15/01/83/1124150183.db2.gz RIBTYAYOEMDNKF-UHFFFAOYSA-N 1 0 365.521 4.007 20 10 FICDRO CCCN(CCC)c1ccc(C[NH+]2CCC(CC(=O)N(C)C)CC2)cc1 ZINC000180328768 1124298641 /nfs/dbraw/zinc/29/86/41/1124298641.db2.gz LXULSLXTZACXCW-UHFFFAOYSA-N 1 0 359.558 4.003 20 10 FICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C[C@H](O)c2cccs2)c1 ZINC000180648791 1124381257 /nfs/dbraw/zinc/38/12/57/1124381257.db2.gz HVDHCELLMHBHHQ-FQEVSTJZSA-N 1 0 369.486 4.198 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)c1 ZINC000765912418 1124464247 /nfs/dbraw/zinc/46/42/47/1124464247.db2.gz WIYAITGEOOBTAL-JPYJTQIMSA-N 1 0 368.521 4.460 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2coc(-c3c(F)cccc3F)n2)c1 ZINC000182424248 1125475297 /nfs/dbraw/zinc/47/52/97/1125475297.db2.gz GXTCNTFYKKXLNJ-LLVKDONJSA-N 1 0 360.360 4.185 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(CN3CCCC3=O)c2)cc1 ZINC000153914291 1079703066 /nfs/dbraw/zinc/70/30/66/1079703066.db2.gz NDPGPGZSQBHJNN-GOSISDBHSA-N 1 0 365.521 4.116 20 10 FICDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)c1O ZINC000275266702 1080647722 /nfs/dbraw/zinc/64/77/22/1080647722.db2.gz BGDUHTPVPXCZMU-GHMZBOCLSA-N 1 0 367.291 4.116 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccccc1O ZINC000155180896 1080672078 /nfs/dbraw/zinc/67/20/78/1080672078.db2.gz WCFFUOVMUWMMGZ-LIRRHRJNSA-N 1 0 353.466 4.478 20 10 FICDRO Cc1nnc([C@@H](C)N[C@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275324124 1080766420 /nfs/dbraw/zinc/76/64/20/1080766420.db2.gz LLVORQDPUQHWOZ-RKDXNWHRSA-N 1 0 356.289 4.035 20 10 FICDRO CC(C)N(CC1CC1)C(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000683440737 1080984642 /nfs/dbraw/zinc/98/46/42/1080984642.db2.gz JFQNATDODUNFPX-UHFFFAOYSA-N 1 0 367.537 4.055 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1F ZINC001648903381 1081359870 /nfs/dbraw/zinc/35/98/70/1081359870.db2.gz OAUVPXNRGJLNNY-SNAWJCMRSA-N 1 0 364.468 4.189 20 10 FICDRO CCN(C)c1ccc(CN2CC[N@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001167346413 1081542429 /nfs/dbraw/zinc/54/24/29/1081542429.db2.gz ACZPKPSAHFZMBI-UHFFFAOYSA-N 1 0 351.538 4.239 20 10 FICDRO c1ccc(C[C@H]2CCCC[C@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000728301026 1082009624 /nfs/dbraw/zinc/00/96/24/1082009624.db2.gz IJJWMXWUCLFTMO-ISKFKSNPSA-N 1 0 364.533 4.414 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ncc(Cl)c4ccccc43)cc2)CC1 ZINC001167422948 1082041746 /nfs/dbraw/zinc/04/17/46/1082041746.db2.gz HZUNAAWDFCKCDQ-UHFFFAOYSA-N 1 0 366.896 4.252 20 10 FICDRO CC(C)c1cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)nc(C(C)C)n1 ZINC001167431355 1082095541 /nfs/dbraw/zinc/09/55/41/1082095541.db2.gz VAPHVNZUXXJHGR-UHFFFAOYSA-N 1 0 367.541 4.087 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)O[C@H](CC)C(=O)N2)c1ccccc1O ZINC000156160955 1082485055 /nfs/dbraw/zinc/48/50/55/1082485055.db2.gz REVYAEKLYJILNV-IYJAJMOOSA-N 1 0 354.450 4.304 20 10 FICDRO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469548 1082655074 /nfs/dbraw/zinc/65/50/74/1082655074.db2.gz ZGEKEZRRTKRIPZ-PZJWPPBQSA-N 1 0 350.506 4.210 20 10 FICDRO O=C(C[N@@H+]1CC[C@]2(CCOC2)C1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255343735 1082762985 /nfs/dbraw/zinc/76/29/85/1082762985.db2.gz KUKXPWWZKGMCBC-NRFANRHFSA-N 1 0 364.449 4.153 20 10 FICDRO Cc1cc(C[N@H+](C)Cc2ccc([S@](C)=O)cc2)c(O)c(C(C)(C)C)c1 ZINC000176117783 1083488669 /nfs/dbraw/zinc/48/86/69/1083488669.db2.gz NYLCWJWQAKBXIC-VWLOTQADSA-N 1 0 359.535 4.368 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)c2ccccc2)n1 ZINC000277004752 1083707178 /nfs/dbraw/zinc/70/71/78/1083707178.db2.gz BARNQKUENKEZER-MGPUTAFESA-N 1 0 350.466 4.079 20 10 FICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc(Br)ccn1 ZINC001140766016 1084213094 /nfs/dbraw/zinc/21/30/94/1084213094.db2.gz UVDOOKUQBCFJGZ-UHFFFAOYSA-N 1 0 360.299 4.076 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC ZINC000157420363 1084377103 /nfs/dbraw/zinc/37/71/03/1084377103.db2.gz FQMRRAGCZXLGKB-GJZGRUSLSA-N 1 0 358.482 4.190 20 10 FICDRO COCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000177973928 1084516741 /nfs/dbraw/zinc/51/67/41/1084516741.db2.gz CNDMKSHZRZXWJV-GOSISDBHSA-N 1 0 354.494 4.163 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000178082343 1084658633 /nfs/dbraw/zinc/65/86/33/1084658633.db2.gz LGHDEGAPWHVXFX-JTSKRJEESA-N 1 0 354.494 4.070 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C)o2)cc1F ZINC000066906387 1085810254 /nfs/dbraw/zinc/81/02/54/1085810254.db2.gz NIKDYUQWSBCJNM-UHFFFAOYSA-N 1 0 356.445 4.253 20 10 FICDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCc3c2cccc3Br)c1 ZINC000105491786 1086560393 /nfs/dbraw/zinc/56/03/93/1086560393.db2.gz OUCUBNWLTMWVJT-KRWDZBQOSA-N 1 0 362.267 4.331 20 10 FICDRO CC[C@@H]([NH2+]CCc1ccc(OC)c(OC)c1OC)c1ccc(N(C)C)cc1 ZINC000163032973 1086680122 /nfs/dbraw/zinc/68/01/22/1086680122.db2.gz HWJHQJOMUMNQGX-LJQANCHMSA-N 1 0 372.509 4.062 20 10 FICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163628094 1088160118 /nfs/dbraw/zinc/16/01/18/1088160118.db2.gz JPRQYGRPYIRYGT-KRWDZBQOSA-N 1 0 356.535 4.489 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cc2c(s1)CCC2 ZINC000165186265 1088406753 /nfs/dbraw/zinc/40/67/53/1088406753.db2.gz DULNIRGIJMITAH-CQSZACIVSA-N 1 0 360.498 4.063 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2sc(CCOC)nc2C)cc1 ZINC000181384461 1088421513 /nfs/dbraw/zinc/42/15/13/1088421513.db2.gz XTLRLOTWNCAAMZ-HNNXBMFYSA-N 1 0 361.555 4.337 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1O ZINC000311310010 1088539599 /nfs/dbraw/zinc/53/95/99/1088539599.db2.gz SSMCBPQFEKKKOS-OAHLLOKOSA-N 1 0 356.466 4.268 20 10 FICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(OC[C@H]2CCOC2)c1 ZINC000167177727 1088638695 /nfs/dbraw/zinc/63/86/95/1088638695.db2.gz AJSBLFHEBWEHFP-MOPGFXCFSA-N 1 0 368.521 4.327 20 10 FICDRO Cc1cc(O)c(C[NH2+]CCc2nc(-c3ccc(Cl)cc3)no2)cc1C ZINC000174373457 1089370728 /nfs/dbraw/zinc/37/07/28/1089370728.db2.gz CRHRBLWHMUHESV-UHFFFAOYSA-N 1 0 357.841 4.045 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)c1O ZINC000377868987 1089907088 /nfs/dbraw/zinc/90/70/88/1089907088.db2.gz MYNDMQZGVZNKAP-ZDUSSCGKSA-N 1 0 357.841 4.091 20 10 FICDRO CCOCc1cc(C[NH2+]CCc2c[nH]c3cccc(OC)c23)ccc1OC ZINC000180464045 1090205635 /nfs/dbraw/zinc/20/56/35/1090205635.db2.gz IJGUFDQHILWPFC-UHFFFAOYSA-N 1 0 368.477 4.054 20 10 FICDRO COc1ccc(N2CCC[N@@H+]([C@H](C)c3nc4ccccc4o3)CC2)cc1 ZINC000180999351 1090249178 /nfs/dbraw/zinc/24/91/78/1090249178.db2.gz XBTKBOVLRJFTSR-MRXNPFEDSA-N 1 0 351.450 4.110 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2c1O ZINC000185055051 1090500426 /nfs/dbraw/zinc/50/04/26/1090500426.db2.gz SORRPDQUVAFYAJ-QGZVFWFLSA-N 1 0 364.489 4.337 20 10 FICDRO CCOc1ccc(C2(C[NH2+][C@@H](C)c3cc(F)ccc3O)CCOCC2)cc1 ZINC000185127052 1090511047 /nfs/dbraw/zinc/51/10/47/1090511047.db2.gz RDYCARYXGIEFDN-INIZCTEOSA-N 1 0 373.468 4.329 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1cc(F)ccc1O ZINC000185172257 1090517011 /nfs/dbraw/zinc/51/70/11/1090517011.db2.gz KWQRTPNTLJFLOR-ZDUSSCGKSA-N 1 0 354.381 4.227 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1cc2c(cc1O)CCCC2 ZINC000185323338 1090534031 /nfs/dbraw/zinc/53/40/31/1090534031.db2.gz LNESZOCCMWVCRL-OAHLLOKOSA-N 1 0 353.462 4.283 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CCS[C@@H]4CCCC[C@H]43)cc2)CC1 ZINC000828025106 1091021371 /nfs/dbraw/zinc/02/13/71/1091021371.db2.gz DKSHYEYCVDBZQS-NHCUHLMSSA-N 1 0 360.567 4.162 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)c(O)c1OC ZINC000893996820 1092805090 /nfs/dbraw/zinc/80/50/90/1092805090.db2.gz DFACHSHCNHMCFV-NSHDSACASA-N 1 0 371.355 4.159 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1O ZINC000236945735 1093045427 /nfs/dbraw/zinc/04/54/27/1093045427.db2.gz HFYVCIOUHUMFSR-UHFFFAOYSA-N 1 0 357.450 4.036 20 10 FICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000895765862 1093702841 /nfs/dbraw/zinc/70/28/41/1093702841.db2.gz SCROLCIJGTYPTH-UHFFFAOYSA-N 1 0 350.418 4.126 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cn3c4ccccc4oc3=S)CC2)cc1 ZINC000108219657 1093706717 /nfs/dbraw/zinc/70/67/17/1093706717.db2.gz JNQZHEYSJHCGTA-UHFFFAOYSA-N 1 0 369.490 4.142 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCOC2=O)cc1)c1ccc(C)cc1O ZINC000279973841 1093981034 /nfs/dbraw/zinc/98/10/34/1093981034.db2.gz DDXZVZUGWROOLS-DNVCBOLYSA-N 1 0 354.450 4.459 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C(=O)N(CC)CC)cc1)c1ccc(C)cc1O ZINC000280119731 1094291931 /nfs/dbraw/zinc/29/19/31/1094291931.db2.gz OGGKVVGLVHCGCR-FQEVSTJZSA-N 1 0 354.494 4.424 20 10 FICDRO Cc1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000016386704 1095577540 /nfs/dbraw/zinc/57/75/40/1095577540.db2.gz QCZIXNAFCFNRHT-IBGZPJMESA-N 1 0 365.521 4.444 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccnc(N3CCCCCC3)c2)c1 ZINC000273465019 1096264861 /nfs/dbraw/zinc/26/48/61/1096264861.db2.gz DNSXFWJUWBBBRU-INIZCTEOSA-N 1 0 355.482 4.027 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1nnc2n1CCCCC2 ZINC000273613415 1096278668 /nfs/dbraw/zinc/27/86/68/1096278668.db2.gz WTMHLEGGZIEHMA-HNAYVOBHSA-N 1 0 368.525 4.391 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O ZINC000273799003 1096296248 /nfs/dbraw/zinc/29/62/48/1096296248.db2.gz WTTLUFUGYIGIRW-DLBZAZTESA-N 1 0 365.832 4.203 20 10 FICDRO COc1cccc(C[NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 ZINC000237416256 1099490058 /nfs/dbraw/zinc/49/00/58/1099490058.db2.gz HWHAJWCZUCMDML-MRXNPFEDSA-N 1 0 362.420 4.055 20 10 FICDRO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001168164977 1101752887 /nfs/dbraw/zinc/75/28/87/1101752887.db2.gz GTMRBBWUSCQHCT-INIZCTEOSA-N 1 0 358.913 4.231 20 10 FICDRO [O-]c1c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc(Cl)c2cccnc12 ZINC001167965395 1101842227 /nfs/dbraw/zinc/84/22/27/1101842227.db2.gz DVNMWCNVAXADTE-ALOPSCKCSA-N 1 0 371.912 4.089 20 10 FICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC000897994306 1102154750 /nfs/dbraw/zinc/15/47/50/1102154750.db2.gz FLEIYVZEYRGQHE-JOCHJYFZSA-N 1 0 367.537 4.228 20 10 FICDRO CC(C)NC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746279 1103121813 /nfs/dbraw/zinc/12/18/13/1103121813.db2.gz XHOPMWUQQLMBHU-CYBMUJFWSA-N 1 0 361.873 4.426 20 10 FICDRO CCN(CC)c1ccc(CN(C)C(=O)[C@@H](c2ccccc2)[N@H+](C)CC)cc1 ZINC000729512910 1105025163 /nfs/dbraw/zinc/02/51/63/1105025163.db2.gz WMWOOXLGGTVCJQ-JOCHJYFZSA-N 1 0 367.537 4.184 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c2ccccc2)n1 ZINC000760052146 1105218438 /nfs/dbraw/zinc/21/84/38/1105218438.db2.gz PZGQQRRUGZEHTO-DQYPLSBCSA-N 1 0 367.424 4.345 20 10 FICDRO COc1cc([C@H](C)[NH2+]Cc2ccccc2O)ccc1OCc1ccncc1 ZINC000237279436 1107016596 /nfs/dbraw/zinc/01/65/96/1107016596.db2.gz BNGJMWAHYGTFCB-INIZCTEOSA-N 1 0 364.445 4.226 20 10 FICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000783596607 1107693666 /nfs/dbraw/zinc/69/36/66/1107693666.db2.gz YYGAJCLOCDJXRK-LLVKDONJSA-N 1 0 359.779 4.098 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)c(Br)cc2F)c1 ZINC000527977052 1109873387 /nfs/dbraw/zinc/87/33/87/1109873387.db2.gz AKCKAUUPORPAPR-SECBINFHSA-N 1 0 372.209 4.292 20 10 FICDRO CCc1onc(C)c1C[NH2+][C@H](C)c1cc(Br)c(F)cc1[O-] ZINC000927135253 1112298335 /nfs/dbraw/zinc/29/83/35/1112298335.db2.gz RFCZZKMWLMIHGE-MRVPVSSYSA-N 1 0 357.223 4.003 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1[N+](=O)[O-] ZINC000163600747 1113885983 /nfs/dbraw/zinc/88/59/83/1113885983.db2.gz FTPIYVJFIPVIOD-INIZCTEOSA-N 1 0 371.506 4.307 20 10 FICDRO CCSc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151063350 1114288102 /nfs/dbraw/zinc/28/81/02/1114288102.db2.gz RQFCQIZSEDBUMJ-KRWDZBQOSA-N 1 0 356.535 4.486 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000163891893 1114409820 /nfs/dbraw/zinc/40/98/20/1114409820.db2.gz XECBEVNTVHYNCL-NRFANRHFSA-N 1 0 351.494 4.120 20 10 FICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c1 ZINC000164201799 1114443641 /nfs/dbraw/zinc/44/36/41/1114443641.db2.gz PNMJKDJELJMLOE-UHFFFAOYSA-N 1 0 372.896 4.011 20 10 FICDRO CC[C@H]([NH2+]Cc1c(OC)cc(OC)cc1OC)c1ccc(N(C)C)cc1 ZINC000164417458 1114494730 /nfs/dbraw/zinc/49/47/30/1114494730.db2.gz JAALBRJTWVWBJW-IBGZPJMESA-N 1 0 358.482 4.019 20 10 FICDRO Cc1nccn1CCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000164598545 1114523915 /nfs/dbraw/zinc/52/39/15/1114523915.db2.gz VXQTUZMXLLOENT-KRWDZBQOSA-N 1 0 358.505 4.452 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 ZINC000157662362 1115231078 /nfs/dbraw/zinc/23/10/78/1115231078.db2.gz HPQNWAWZIKWMIX-JTSKRJEESA-N 1 0 354.494 4.334 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1Br ZINC000158084222 1115494929 /nfs/dbraw/zinc/49/49/29/1115494929.db2.gz MOAAMSCUDOCLAI-GFCCVEGCSA-N 1 0 350.256 4.323 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1 ZINC000174403022 1116132631 /nfs/dbraw/zinc/13/26/31/1116132631.db2.gz JFTDYNQRMBVLJB-HXUWFJFHSA-N 1 0 374.912 4.254 20 10 FICDRO CC[C@](C)([NH2+]Cc1cc(Br)ccc1O)c1nc(C)cs1 ZINC000174503666 1116139798 /nfs/dbraw/zinc/13/97/98/1116139798.db2.gz ITZKIFIGHZHSJW-HNNXBMFYSA-N 1 0 355.301 4.335 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(s1)CCC2 ZINC000151534979 1116359096 /nfs/dbraw/zinc/35/90/96/1116359096.db2.gz HHZSSGKZWUIPLA-CQSZACIVSA-N 1 0 374.525 4.188 20 10 FICDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)s1 ZINC000761433243 1118059786 /nfs/dbraw/zinc/05/97/86/1118059786.db2.gz SXBCJJRSXKNFAF-HZSPNIEDSA-N 1 0 363.502 4.055 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1F ZINC000151579532 1118938536 /nfs/dbraw/zinc/93/85/36/1118938536.db2.gz UWJIANUPYPYHGU-QFIPXVFZSA-N 1 0 374.475 4.414 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H]3CCCCc4ccccc43)cc2)CC1 ZINC000151586676 1118939388 /nfs/dbraw/zinc/93/93/88/1118939388.db2.gz ISSVWBCYLBENGZ-DEOSSOPVSA-N 1 0 364.533 4.453 20 10 FICDRO O=C(Nc1ccc(F)cc1)C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000130200695 1119123188 /nfs/dbraw/zinc/12/31/88/1119123188.db2.gz YHOBQVMVPICVRJ-UHFFFAOYSA-N 1 0 362.832 4.035 20 10 FICDRO COc1ccc(C2(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)CCOCC2)cc1 ZINC000152659040 1119478169 /nfs/dbraw/zinc/47/81/69/1119478169.db2.gz PGRGCEKUQMFWOG-GOSISDBHSA-N 1 0 368.521 4.160 20 10 FICDRO Cc1cc(C[NH+]2CCN(C(=O)CC(C)(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000914568812 1120374389 /nfs/dbraw/zinc/37/43/89/1120374389.db2.gz CESHSYFSKMKQGQ-UHFFFAOYSA-N 1 0 360.542 4.079 20 10 FICDRO COCc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 ZINC000914797361 1120541587 /nfs/dbraw/zinc/54/15/87/1120541587.db2.gz UXBDXEDNLSEKBL-UHFFFAOYSA-N 1 0 369.465 4.021 20 10 FICDRO C[C@@H](CC(=O)Nc1cccc(Cl)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000915229779 1120888855 /nfs/dbraw/zinc/88/88/55/1120888855.db2.gz QOVZYOWCAWRKLQ-INIZCTEOSA-N 1 0 371.912 4.447 20 10 FICDRO CC[NH+](CC)CCSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 ZINC000762467952 1120912189 /nfs/dbraw/zinc/91/21/89/1120912189.db2.gz NMFWHMUFECMMLK-GOSISDBHSA-N 1 0 359.539 4.163 20 10 FICDRO COc1ccc(O)c(C[NH2+]C2CC(c3cccc(Br)c3)C2)c1 ZINC000762613241 1120938981 /nfs/dbraw/zinc/93/89/81/1120938981.db2.gz LXURCZRGSCXRQY-UHFFFAOYSA-N 1 0 362.267 4.199 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(N(C)C)cc1 ZINC000153657313 1121007989 /nfs/dbraw/zinc/00/79/89/1121007989.db2.gz BHRQHEJRTZBPPI-FQEVSTJZSA-N 1 0 352.457 4.318 20 10 FICDRO COc1cc(C[N@H+](C)Cc2cc(C)cc(C)c2O)ccc1OC(F)F ZINC000915818891 1121086227 /nfs/dbraw/zinc/08/62/27/1121086227.db2.gz DFKZKXFATAKXHP-UHFFFAOYSA-N 1 0 351.393 4.251 20 10 FICDRO Cc1c(Cl)cccc1NC(=O)CC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001649019440 1121191626 /nfs/dbraw/zinc/19/16/26/1121191626.db2.gz AFQOJEXTSUGKSR-WAYWQWQTSA-N 1 0 371.912 4.346 20 10 FICDRO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1c(O)ccc3ccncc31)CCC2 ZINC000763218698 1121292522 /nfs/dbraw/zinc/29/25/22/1121292522.db2.gz GZAUZMZTJAZLOK-QGZVFWFLSA-N 1 0 353.491 4.469 20 10 FICDRO CC[NH+](CC)Cc1cncc(NCc2cc(Cl)c3cccnc3c2O)c1 ZINC001168522157 1121906329 /nfs/dbraw/zinc/90/63/29/1121906329.db2.gz AIKNMTHEDSQOBP-UHFFFAOYSA-N 1 0 370.884 4.443 20 10 FICDRO C[C@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccc(F)cc1O ZINC000186288950 1122009329 /nfs/dbraw/zinc/00/93/29/1122009329.db2.gz JBGGOCGBRPYXQY-INIZCTEOSA-N 1 0 369.484 4.236 20 10 FICDRO Cc1ccccc1OCCC[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000765798757 1122017243 /nfs/dbraw/zinc/01/72/43/1122017243.db2.gz CCWQCOXNPFJLGH-GOSISDBHSA-N 1 0 372.484 4.090 20 10 FICDRO Oc1cc2c(cc1C[NH+]1CCN(Cc3ccncc3)CC1)oc1ccccc12 ZINC000917068549 1122064049 /nfs/dbraw/zinc/06/40/49/1122064049.db2.gz AZUVPJXXYBBRJQ-UHFFFAOYSA-N 1 0 373.456 4.004 20 10 FICDRO Cc1ccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(F)c1 ZINC000917074802 1122068835 /nfs/dbraw/zinc/06/88/35/1122068835.db2.gz GKARWQDTRCZKRW-UHFFFAOYSA-N 1 0 357.473 4.049 20 10 FICDRO COc1ccc2ccc(O)c(C[N@H+](C)CCOc3ccccc3OC)c2c1 ZINC000917486107 1122328136 /nfs/dbraw/zinc/32/81/36/1122328136.db2.gz CJDUDVANUAVFNU-UHFFFAOYSA-N 1 0 367.445 4.073 20 10 FICDRO Cc1cc(Cl)ccc1OCCC[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000920181691 1123398910 /nfs/dbraw/zinc/39/89/10/1123398910.db2.gz LCMYEYALXJOIJD-UHFFFAOYSA-N 1 0 374.912 4.044 20 10 FICDRO C[C@@H](COc1ccccc1C(F)(F)F)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000920182353 1123398980 /nfs/dbraw/zinc/39/89/80/1123398980.db2.gz MLNARZASYQHMFU-ZDUSSCGKSA-N 1 0 351.368 4.197 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(F)c(F)c2)ccc1N1CCCCC1 ZINC000920414809 1123454184 /nfs/dbraw/zinc/45/41/84/1123454184.db2.gz YQDXQGOUTZXEBG-UHFFFAOYSA-N 1 0 361.392 4.153 20 10 FICDRO Cc1cccc(C)c1C(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1 ZINC000175162176 1123749827 /nfs/dbraw/zinc/74/98/27/1123749827.db2.gz JZFHRSYJNFQJEG-UHFFFAOYSA-N 1 0 363.505 4.088 20 10 FICDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000765902721 1124358792 /nfs/dbraw/zinc/35/87/92/1124358792.db2.gz DKXATNBOEGFHLU-QFBILLFUSA-N 1 0 354.469 4.043 20 10 FICDRO COc1ccc([C@@H]([NH2+]Cc2cc(OC)ccc2O)c2ccc(F)cc2)cc1 ZINC000180886484 1124462127 /nfs/dbraw/zinc/46/21/27/1124462127.db2.gz JXAZKSAKQYTBLW-QFIPXVFZSA-N 1 0 367.420 4.428 20 10 FICDRO C[C@@H]([NH2+]CCSc1ccccc1F)c1ccc(N2CCOCC2)cc1 ZINC000765969305 1125233615 /nfs/dbraw/zinc/23/36/15/1125233615.db2.gz SCGIPQXOFPLFBK-MRXNPFEDSA-N 1 0 360.498 4.105 20 10 FICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(Br)s2)c1O ZINC000120417233 1080042395 /nfs/dbraw/zinc/04/23/95/1080042395.db2.gz NOXYYTSZTZYYTC-UHFFFAOYSA-N 1 0 356.285 4.165 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000155307883 1080782738 /nfs/dbraw/zinc/78/27/38/1080782738.db2.gz JZUAXAYPKBWWLW-IRXDYDNUSA-N 1 0 369.465 4.152 20 10 FICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1Br ZINC001140103945 1080904599 /nfs/dbraw/zinc/90/45/99/1080904599.db2.gz VFLRGMXYJKRXBL-UHFFFAOYSA-N 1 0 350.256 4.185 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)Cc2ccccc2Cl)cc1Cn1cccn1 ZINC001648816876 1081238156 /nfs/dbraw/zinc/23/81/56/1081238156.db2.gz LDGDQYOFZAMXRT-MRXNPFEDSA-N 1 0 369.896 4.314 20 10 FICDRO Cc1cc(C)c(/C=C/C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)c(C)c1 ZINC001648835278 1081276665 /nfs/dbraw/zinc/27/66/65/1081276665.db2.gz HFFWQZGBBNRCCP-SNAWJCMRSA-N 1 0 368.496 4.391 20 10 FICDRO Cc1ccc(F)cc1C[NH2+]Cc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 ZINC001648835235 1081277131 /nfs/dbraw/zinc/27/71/31/1081277131.db2.gz FKHBZTQMQFHBJX-HOTGVXAUSA-N 1 0 360.448 4.177 20 10 FICDRO CC1(C)CC([NH2+]Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC(C)(C)C1 ZINC001648889037 1081349297 /nfs/dbraw/zinc/34/92/97/1081349297.db2.gz DPWPYQGPJBWKLV-SFHVURJKSA-N 1 0 371.569 4.083 20 10 FICDRO Oc1cc2c(cc1C[NH2+]C1(c3cccc(F)c3)CCOCC1)CCCC2 ZINC000160520539 1081970034 /nfs/dbraw/zinc/97/00/34/1081970034.db2.gz VDYXMLINQPXMRD-UHFFFAOYSA-N 1 0 355.453 4.206 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3cc(-c4cccs4)ccn3)cc2)CC1 ZINC001167427047 1082055775 /nfs/dbraw/zinc/05/57/75/1082055775.db2.gz VKZATORXMVNHFZ-UHFFFAOYSA-N 1 0 364.518 4.174 20 10 FICDRO CCCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)c1 ZINC000160576261 1082059484 /nfs/dbraw/zinc/05/94/84/1082059484.db2.gz JZYZGPLYGWQDSR-QGZVFWFLSA-N 1 0 353.510 4.133 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCCCc3nc(C)cs3)CC2)cc1 ZINC000160675083 1082207001 /nfs/dbraw/zinc/20/70/01/1082207001.db2.gz YRBHVBWETMHNCY-UHFFFAOYSA-N 1 0 359.539 4.041 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(Br)cc1O ZINC000285636354 1082929160 /nfs/dbraw/zinc/92/91/60/1082929160.db2.gz KRZKBGRHCBWJGA-RKDXNWHRSA-N 1 0 357.198 4.240 20 10 FICDRO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161068377 1083035693 /nfs/dbraw/zinc/03/56/93/1083035693.db2.gz QGBPHENRXYHINL-IRXDYDNUSA-N 1 0 353.510 4.132 20 10 FICDRO C[C@@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1ccc(N2CCCCC2)cc1 ZINC000178364979 1083280678 /nfs/dbraw/zinc/28/06/78/1083280678.db2.gz XPOQYVZFTVNKKP-MRXNPFEDSA-N 1 0 369.475 4.354 20 10 FICDRO Cc1cc(C[N@H+](C)Cc2ccc([S@@](C)=O)cc2)c(O)c(C(C)(C)C)c1 ZINC000176117797 1083301348 /nfs/dbraw/zinc/30/13/48/1083301348.db2.gz NYLCWJWQAKBXIC-RUZDIDTESA-N 1 0 359.535 4.368 20 10 FICDRO COCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000167234545 1083686300 /nfs/dbraw/zinc/68/63/00/1083686300.db2.gz CBGOKAWUNAVHGW-GOSISDBHSA-N 1 0 356.510 4.327 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)c2ccccc2)n1 ZINC000277004755 1083707322 /nfs/dbraw/zinc/70/73/22/1083707322.db2.gz BARNQKUENKEZER-YWZLYKJASA-N 1 0 350.466 4.079 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)c2ccccc2)n1 ZINC000277032459 1083724584 /nfs/dbraw/zinc/72/45/84/1083724584.db2.gz FIBNSQCSKQVAAH-PXAZEXFGSA-N 1 0 357.841 4.372 20 10 FICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000176210982 1083743421 /nfs/dbraw/zinc/74/34/21/1083743421.db2.gz PKUNHPZOLXJUGN-LJQANCHMSA-N 1 0 355.478 4.096 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2cc3ccccc3o2)SC1=S ZINC000066145118 1084124274 /nfs/dbraw/zinc/12/42/74/1084124274.db2.gz LXVFUIQMSNQMSE-YBEGLDIGSA-N 1 0 374.531 4.222 20 10 FICDRO CCOC[C@H]1CC[N@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000177634952 1084183863 /nfs/dbraw/zinc/18/38/63/1084183863.db2.gz SVUKXZLBDRVQIT-ZDUSSCGKSA-N 1 0 364.283 4.166 20 10 FICDRO CCOC[C@@H]1CC[N@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000177634937 1084184228 /nfs/dbraw/zinc/18/42/28/1084184228.db2.gz SVUKXZLBDRVQIT-CYBMUJFWSA-N 1 0 364.283 4.166 20 10 FICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CCCO2 ZINC000177973512 1084517237 /nfs/dbraw/zinc/51/72/37/1084517237.db2.gz RBOVQEQSLCDPPB-OAQYLSRUSA-N 1 0 352.478 4.299 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@@H](C)COCc3ccccc3)CC2)cc1 ZINC000161300530 1085073751 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COc1cc(Cl)cc(CN[C@@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278985278 1086742071 /nfs/dbraw/zinc/74/20/71/1086742071.db2.gz IVNXJKOHYUDBKC-ZETCQYMHSA-N 1 0 366.792 4.380 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2Cc2nc(C3CCC3)no2)C1 ZINC000685241917 1087071263 /nfs/dbraw/zinc/07/12/63/1087071263.db2.gz CLVYZPOWESSXLT-UHFFFAOYSA-N 1 0 350.466 4.107 20 10 FICDRO C[NH+]1CCC(N2C(=O)/C(=C\c3ccc(C(C)(C)C)cc3)SC2=S)CC1 ZINC000255629511 1087696611 /nfs/dbraw/zinc/69/66/11/1087696611.db2.gz YWSBKUKIQQEHFO-GHRIWEEISA-N 1 0 374.575 4.280 20 10 FICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000162370615 1087931320 /nfs/dbraw/zinc/93/13/20/1087931320.db2.gz ORYVLCZLKDRYRR-IAGOWNOFSA-N 1 0 372.484 4.391 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3ccc(CC(C)C)cc3)c2)CC1 ZINC001269776224 1088564003 /nfs/dbraw/zinc/56/40/03/1088564003.db2.gz ASRQCROCOFHNKW-UHFFFAOYSA-N 1 0 365.521 4.279 20 10 FICDRO COc1ccc(O)c(C[NH2+]Cc2cc(Br)ccc2Cl)c1 ZINC000136143803 1088979639 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356.466 4.063 20 10 FICDRO CC1(C)Cc2cc(C[NH2+]Cc3ccc(N4CCSCC4)cc3)ccc2O1 ZINC000236694442 1090894588 /nfs/dbraw/zinc/89/45/88/1090894588.db2.gz PHIKARDZMVFQGW-UHFFFAOYSA-N 1 0 368.546 4.243 20 10 FICDRO C[C@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000311301304 1091351170 /nfs/dbraw/zinc/35/11/70/1091351170.db2.gz RYSVTQGUKLYHSN-AWEZNQCLSA-N 1 0 366.477 4.219 20 10 FICDRO C[N@H+](Cc1ccccc1NC(=O)Cc1ccc(N)cc1)C1CCCCC1 ZINC000237167091 1092466531 /nfs/dbraw/zinc/46/65/31/1092466531.db2.gz UGHWQEIABGEMRQ-UHFFFAOYSA-N 1 0 351.494 4.215 20 10 FICDRO COc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2C)c(O)c1OC ZINC000893929346 1092764259 /nfs/dbraw/zinc/76/42/59/1092764259.db2.gz SXHBTGAHVVPRQJ-UHFFFAOYSA-N 1 0 355.356 4.026 20 10 FICDRO COC1(C[C@@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 ZINC000759989064 1093082593 /nfs/dbraw/zinc/08/25/93/1093082593.db2.gz OXXFUUTXEIHSRI-OAHLLOKOSA-N 1 0 368.468 4.194 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2c(C)nn(C)c2C)cc1 ZINC000236966180 1093159689 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ZINC000273386020 1096257510 /nfs/dbraw/zinc/25/75/10/1096257510.db2.gz JMTFKLHCWNQNJB-HOTGVXAUSA-N 1 0 354.450 4.377 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cccc(OCc3ccccc3C#N)c2)cc1 ZINC000237129850 1096490237 /nfs/dbraw/zinc/49/02/37/1096490237.db2.gz LBIYADLKEGDKIM-UHFFFAOYSA-N 1 0 371.484 4.493 20 10 FICDRO CC[C@H]([NH2+]C1CCC(O)(c2cccnc2)CC1)c1ccc(N(C)C)cc1 ZINC000186344319 1101767202 /nfs/dbraw/zinc/76/72/02/1101767202.db2.gz DICMSLKNVKFQIK-IRQNMHNUSA-N 1 0 353.510 4.019 20 10 FICDRO COCC[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000757653517 1102736932 /nfs/dbraw/zinc/73/69/32/1102736932.db2.gz JGBVQIVPANTQFX-JSGCOSHPSA-N 1 0 368.271 4.046 20 10 FICDRO C[C@@H]([NH2+]C[C@H](O)c1ccccc1C(F)(F)F)c1ccc(Cl)cc1O ZINC000841748386 1103183695 /nfs/dbraw/zinc/18/36/95/1103183695.db2.gz XNYGNYYHCXXUQS-HWPZZCPQSA-N 1 0 359.775 4.449 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC001648956660 1104393856 /nfs/dbraw/zinc/39/38/56/1104393856.db2.gz RBMSKBYMGXRJHQ-SFHVURJKSA-N 1 0 363.505 4.174 20 10 FICDRO C[C@H]([NH2+][C@H]1CCCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 ZINC001648957106 1104454643 /nfs/dbraw/zinc/45/46/43/1104454643.db2.gz YQNWNMSRYKCQKA-AVRDEDQJSA-N 1 0 350.506 4.121 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c1 ZINC000760037088 1104925878 /nfs/dbraw/zinc/92/58/78/1104925878.db2.gz HETRDOFFOOMZOD-KNXBSLHKSA-N 1 0 357.469 4.264 20 10 FICDRO Fc1ccc(Oc2ccc(C[NH2+]Cc3ccc4c(c3)CCO4)cn2)cc1 ZINC000054175754 1104969108 /nfs/dbraw/zinc/96/91/08/1104969108.db2.gz XAANCDPRNACPOH-UHFFFAOYSA-N 1 0 350.393 4.238 20 10 FICDRO COc1cccc(C[NH2+][C@@H](C)c2cc(F)c(Br)cc2F)c1O ZINC000527753761 1109822157 /nfs/dbraw/zinc/82/21/57/1109822157.db2.gz SSSXTORMRYWZQN-VIFPVBQESA-N 1 0 372.209 4.292 20 10 FICDRO CC[C@@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1O ZINC000527997149 1109881314 /nfs/dbraw/zinc/88/13/14/1109881314.db2.gz HELDOWIALWTYKN-ZBFHGGJFSA-N 1 0 364.367 4.015 20 10 FICDRO COCCOc1ccc([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000479452582 1112028344 /nfs/dbraw/zinc/02/83/44/1112028344.db2.gz KXEVXJZXFMNVFX-KRWDZBQOSA-N 1 0 352.478 4.363 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000479449322 1112036610 /nfs/dbraw/zinc/03/66/10/1112036610.db2.gz DUGIRTGDIQTFNT-OAQYLSRUSA-N 1 0 373.504 4.308 20 10 FICDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163627577 1114244699 /nfs/dbraw/zinc/24/46/99/1114244699.db2.gz YJECMIVICVJEEJ-JOCHJYFZSA-N 1 0 368.546 4.416 20 10 FICDRO CC[C@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000151118013 1114297788 /nfs/dbraw/zinc/29/77/88/1114297788.db2.gz HVXQOQIURDJIIJ-KRWDZBQOSA-N 1 0 367.415 4.330 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OC[C@@H]1CCOC1)c1ccccc1O ZINC000156309377 1114382885 /nfs/dbraw/zinc/38/28/85/1114382885.db2.gz DIQYFMXRPJUTPI-XLIONFOSSA-N 1 0 355.478 4.357 20 10 FICDRO CCc1noc(-c2ccc(CC[NH2+][C@@H](CC)c3ccccc3O)cc2)n1 ZINC000156496781 1114452325 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20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCN(c2ncccc2F)C1)c1ccc(N2CCCCC2)cc1 ZINC000168112453 1115425615 /nfs/dbraw/zinc/42/56/15/1115425615.db2.gz KUDRTQFYJXUAFR-IEBWSBKVSA-N 1 0 368.500 4.141 20 10 FICDRO COc1ccc(-c2ccc(C[NH2+]Cc3cc4c(cc3O)OCO4)cc2)cc1 ZINC000174575082 1116142837 /nfs/dbraw/zinc/14/28/37/1116142837.db2.gz RETFTHOXGPCYBF-UHFFFAOYSA-N 1 0 363.413 4.086 20 10 FICDRO CCC[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 ZINC000151509380 1116250214 /nfs/dbraw/zinc/25/02/14/1116250214.db2.gz PANGKQCSJBLIKL-OAQYLSRUSA-N 1 0 356.485 4.418 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1C ZINC000151572613 1118810376 /nfs/dbraw/zinc/81/03/76/1118810376.db2.gz BAHNJCBIWAIPSE-LJQANCHMSA-N 1 0 352.522 4.363 20 10 FICDRO CCC(CC)(CC)C(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC001127268037 1119383060 /nfs/dbraw/zinc/38/30/60/1119383060.db2.gz QBOKBFQKHMLUNC-UHFFFAOYSA-N 1 0 371.569 4.051 20 10 FICDRO CC[C@](C)([NH2+]Cc1cc(Br)cc(OC)c1O)c1nccs1 ZINC000152610833 1119470713 /nfs/dbraw/zinc/47/07/13/1119470713.db2.gz XGQAEEALQWGDDX-HNNXBMFYSA-N 1 0 371.300 4.035 20 10 FICDRO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000153037258 1119835056 /nfs/dbraw/zinc/83/50/56/1119835056.db2.gz QIUJLTOBKRRTGU-OXQOHEQNSA-N 1 0 354.469 4.309 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F ZINC000153227977 1120370791 /nfs/dbraw/zinc/37/07/91/1120370791.db2.gz HODSWBDXYABCOT-HOTGVXAUSA-N 1 0 358.457 4.083 20 10 FICDRO COc1ccc(C)cc1C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000914582589 1120390704 /nfs/dbraw/zinc/39/07/04/1120390704.db2.gz YOSPBTUKYMMYDL-UHFFFAOYSA-N 1 0 369.465 4.192 20 10 FICDRO C[N@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccc(N2CCOCC2)cc1 ZINC000762956245 1121043927 /nfs/dbraw/zinc/04/39/27/1121043927.db2.gz XURVSJFLAJBFIN-UHFFFAOYSA-N 1 0 370.440 4.236 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)C(C)(C)C)C1 ZINC001626060313 1121266233 /nfs/dbraw/zinc/26/62/33/1121266233.db2.gz SRYOQQFCLOCVGW-KRWDZBQOSA-N 1 0 369.553 4.206 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccc(-n2ccnn2)cc1 ZINC000186183775 1121397078 /nfs/dbraw/zinc/39/70/78/1121397078.db2.gz MRAROHQBGJIVBD-CVEARBPZSA-N 1 0 362.477 4.264 20 10 FICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1[N+](=O)[O-] ZINC000153819008 1121400645 /nfs/dbraw/zinc/40/06/45/1121400645.db2.gz TXPUTYXXQKYVKZ-HNNXBMFYSA-N 1 0 357.454 4.219 20 10 FICDRO CCOc1ccc([C@H](C)[NH2+]CCCSc2nccs2)cc1[N+](=O)[O-] ZINC000153874059 1121433433 /nfs/dbraw/zinc/43/34/33/1121433433.db2.gz DTYQYSWHVBTYLX-LBPRGKRZSA-N 1 0 367.496 4.283 20 10 FICDRO c1ccc(C2(C[NH2+]Cc3ccc(N4CCOCC4)cc3)CCCC2)cc1 ZINC000916834480 1121875269 /nfs/dbraw/zinc/87/52/69/1121875269.db2.gz QUVGDLUVDQMSAW-UHFFFAOYSA-N 1 0 350.506 4.125 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@H](C)Cn2cccn2)cc1 ZINC000916839283 1121882522 /nfs/dbraw/zinc/88/25/22/1121882522.db2.gz WWLOYFXJSQEEOI-FQEVSTJZSA-N 1 0 362.521 4.336 20 10 FICDRO CN(C)c1ccc(CN(Cc2nc(-c3ccsc3)no2)C2CC2)cc1 ZINC000917073824 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366.292 4.033 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601894 1122723228 /nfs/dbraw/zinc/72/32/28/1122723228.db2.gz LLDUUOVYSBMEMI-HKUYNNGSSA-N 1 0 371.912 4.104 20 10 FICDRO CC(C)[N@H+](Cc1csc(-c2cnn(C)c2)n1)Cc1ccc(N(C)C)cc1 ZINC000919648413 1123069587 /nfs/dbraw/zinc/06/95/87/1123069587.db2.gz PYDFQYZKEOKCIO-UHFFFAOYSA-N 1 0 369.538 4.020 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984912 1123300039 /nfs/dbraw/zinc/30/00/39/1123300039.db2.gz WGRCOWZFXGFCAD-MSOLQXFVSA-N 1 0 371.912 4.104 20 10 FICDRO COc1ccc(OCCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000920181679 1123399055 /nfs/dbraw/zinc/39/90/55/1123399055.db2.gz JBWNWVGAFZTXLY-UHFFFAOYSA-N 1 0 354.494 4.244 20 10 FICDRO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057444 1123558620 /nfs/dbraw/zinc/55/86/20/1123558620.db2.gz WOBKMSXDZWINQS-ZWKOTPCHSA-N 1 0 360.542 4.341 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3ccccc3OCC3CC3)CC2)cc1 ZINC000237572840 1123986798 /nfs/dbraw/zinc/98/67/98/1123986798.db2.gz JRCBLMNGBXFHEL-UHFFFAOYSA-N 1 0 366.505 4.243 20 10 FICDRO CC[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1cccc(C)c1O ZINC000179565285 1124007070 /nfs/dbraw/zinc/00/70/70/1124007070.db2.gz FRHSIPZIZTUVES-UHFFFAOYSA-N 1 0 366.383 4.180 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)c1O ZINC000179616103 1124018922 /nfs/dbraw/zinc/01/89/22/1124018922.db2.gz YHTNWTYSVVAXLV-JTQLQIEISA-N 1 0 353.340 4.186 20 10 FICDRO Cc1ccsc1C[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237783721 1124076443 /nfs/dbraw/zinc/07/64/43/1124076443.db2.gz KYOLBBZHSBFWQQ-AWEZNQCLSA-N 1 0 352.450 4.417 20 10 FICDRO Fc1cc(C[NH2+]Cc2cc3ccccc3s2)ccc1N1CCOCC1 ZINC000237853903 1124133543 /nfs/dbraw/zinc/13/35/43/1124133543.db2.gz FPZSWJPEPKDNLH-UHFFFAOYSA-N 1 0 356.466 4.167 20 10 FICDRO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000179946594 1124155830 /nfs/dbraw/zinc/15/58/30/1124155830.db2.gz UWZCOPGXTWKBCS-IBGZPJMESA-N 1 0 351.450 4.108 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(O)CC3)c(F)c1)[C@@H](C)C2 ZINC000180214700 1124266237 /nfs/dbraw/zinc/26/62/37/1124266237.db2.gz IAKXKZBYZJNGOU-HJPURHCSSA-N 1 0 368.496 4.118 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)c1 ZINC000765912420 1124464158 /nfs/dbraw/zinc/46/41/58/1124464158.db2.gz WIYAITGEOOBTAL-MBSDFSHPSA-N 1 0 368.521 4.460 20 10 FICDRO CCc1ccc(C(=O)Nc2cccc(N3CC[NH+](CC)CC3)c2)cc1CC ZINC001128206847 1125073206 /nfs/dbraw/zinc/07/32/06/1125073206.db2.gz JLEGTEXJVOBVCJ-UHFFFAOYSA-N 1 0 365.521 4.206 20 10 FICDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 ZINC000069714856 1125121040 /nfs/dbraw/zinc/12/10/40/1125121040.db2.gz DVGIKDRMABRMRS-UHFFFAOYSA-N 1 0 370.440 4.202 20 10 FICDRO CC(C)(C)OC(=O)NCC12CC(C1)C[N@@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001143103388 1125246049 /nfs/dbraw/zinc/24/60/49/1125246049.db2.gz BQYQFLHZMFCXPA-UHFFFAOYSA-N 1 0 374.525 4.179 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@@]12CC[N@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143103386 1125246235 /nfs/dbraw/zinc/24/62/35/1125246235.db2.gz BPHQTOCZHCXHJB-JOCHJYFZSA-N 1 0 374.525 4.275 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3ccccc3C(F)F)c2)CC1 ZINC001128313724 1125275443 /nfs/dbraw/zinc/27/54/43/1125275443.db2.gz UWWJQVXFIXXHNG-UHFFFAOYSA-N 1 0 359.420 4.018 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1 ZINC000182357262 1125424480 /nfs/dbraw/zinc/42/44/80/1125424480.db2.gz WASSKYGLCBYJMJ-AWEZNQCLSA-N 1 0 357.450 4.207 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(Cc3ccccc3)n2)c1 ZINC000182344466 1125426142 /nfs/dbraw/zinc/42/61/42/1125426142.db2.gz MKXCFQQFKHFVLH-AWEZNQCLSA-N 1 0 354.475 4.299 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(SC(=O)N(C)C)c2)c1 ZINC000182436173 1125491988 /nfs/dbraw/zinc/49/19/88/1125491988.db2.gz XYJYUKAOVQFDJC-ZDUSSCGKSA-N 1 0 360.479 4.025 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(SC(=O)N(C)C)c2)c1 ZINC000182436190 1125492121 /nfs/dbraw/zinc/49/21/21/1125492121.db2.gz XYJYUKAOVQFDJC-CYBMUJFWSA-N 1 0 360.479 4.025 20 10 FICDRO CC(C)(C)OC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000382416788 1125575978 /nfs/dbraw/zinc/57/59/78/1125575978.db2.gz HTEXUXZQTOTMEM-RBUKOAKNSA-N 1 0 373.541 4.070 20 10 FICDRO C[N@H+](CCC1CCOCC1)Cc1ccc(OCc2ccccc2)cc1O ZINC000183091423 1125742048 /nfs/dbraw/zinc/74/20/48/1125742048.db2.gz INAMLUOMCVSRTC-UHFFFAOYSA-N 1 0 355.478 4.220 20 10 FICDRO CCOC[C@@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000183075596 1125736472 /nfs/dbraw/zinc/73/64/72/1125736472.db2.gz WKBQSQDEGAHLTN-LJQANCHMSA-N 1 0 355.478 4.220 20 10 FICDRO c1ccc(C(C[NH2+]Cc2ccc(N3CCOCC3)cc2)c2ccccc2)cc1 ZINC000216728369 1080407072 /nfs/dbraw/zinc/40/70/72/1080407072.db2.gz KCCDKWDRBICCJV-UHFFFAOYSA-N 1 0 372.512 4.445 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001167281470 1080967867 /nfs/dbraw/zinc/96/78/67/1080967867.db2.gz BGSNDPFXSJSNAJ-KRWDZBQOSA-N 1 0 371.550 4.292 20 10 FICDRO [O-]c1ccc(Cl)c(F)c1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001648903159 1081359829 /nfs/dbraw/zinc/35/98/29/1081359829.db2.gz IJOUAWYMOYALSJ-UHFFFAOYSA-N 1 0 362.876 4.187 20 10 FICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CN1Cc1ccccc1 ZINC000398086456 1082019217 /nfs/dbraw/zinc/01/92/17/1082019217.db2.gz IFECGFOHACYQBF-NZQKXSOJSA-N 1 0 363.549 4.430 20 10 FICDRO CCCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)c1 ZINC000160576137 1082061474 /nfs/dbraw/zinc/06/14/74/1082061474.db2.gz JZYZGPLYGWQDSR-KRWDZBQOSA-N 1 0 353.510 4.133 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc(-c4ccncc4)cc3)cc2)CC1 ZINC001167434477 1082136027 /nfs/dbraw/zinc/13/60/27/1082136027.db2.gz LVQMOYVPWJWXQA-UHFFFAOYSA-N 1 0 358.489 4.113 20 10 FICDRO COc1cc(C)c(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1Cl ZINC001167434463 1082136113 /nfs/dbraw/zinc/13/61/13/1082136113.db2.gz LCANYHHJUAZNTK-UHFFFAOYSA-N 1 0 359.901 4.021 20 10 FICDRO Cc1cc(OC(C)C)ccc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167437651 1082206056 /nfs/dbraw/zinc/20/60/56/1082206056.db2.gz XMILYBZCOQXTDO-UHFFFAOYSA-N 1 0 353.510 4.146 20 10 FICDRO C[C@@H](CCOCc1ccccc1)[NH2+]Cc1c(O)cccc1Br ZINC000706835352 1082385446 /nfs/dbraw/zinc/38/54/46/1082385446.db2.gz VLUTXLSSNUIKRZ-AWEZNQCLSA-N 1 0 364.283 4.240 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(F)cc3N(C)C)CC2)cc1 ZINC000157427910 1082825154 /nfs/dbraw/zinc/82/51/54/1082825154.db2.gz PJEGDRQOYRNRKY-MRXNPFEDSA-N 1 0 371.500 4.220 20 10 FICDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161068300 1083035677 /nfs/dbraw/zinc/03/56/77/1083035677.db2.gz QGBPHENRXYHINL-SJORKVTESA-N 1 0 353.510 4.132 20 10 FICDRO CC(C)c1noc(CCC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000178512425 1084335029 /nfs/dbraw/zinc/33/50/29/1084335029.db2.gz MCYMSMHGYPVODZ-QGZVFWFLSA-N 1 0 356.514 4.467 20 10 FICDRO C[C@H]([NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(N(C)C)cc1 ZINC000177937643 1084480362 /nfs/dbraw/zinc/48/03/62/1084480362.db2.gz RBJKAJNIYQKWHJ-NYHFZMIOSA-N 1 0 352.478 4.326 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000178082361 1084658420 /nfs/dbraw/zinc/65/84/20/1084658420.db2.gz LGHDEGAPWHVXFX-HTAPYJJXSA-N 1 0 354.494 4.070 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000178082955 1084664636 /nfs/dbraw/zinc/66/46/36/1084664636.db2.gz LYMAHWZTQLTWES-OPAMFIHVSA-N 1 0 372.484 4.209 20 10 FICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000122625820 1086106567 /nfs/dbraw/zinc/10/65/67/1086106567.db2.gz KZQVRSJYAILPEQ-QGZVFWFLSA-N 1 0 372.484 4.050 20 10 FICDRO COc1ccc(C[NH2+]Cc2cc(Br)ccc2Cl)c(O)c1 ZINC000722368394 1086631076 /nfs/dbraw/zinc/63/10/76/1086631076.db2.gz OHPYSFDZUQGJTO-UHFFFAOYSA-N 1 0 356.647 4.107 20 10 FICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000782843472 1088235772 /nfs/dbraw/zinc/23/57/72/1088235772.db2.gz PWUCKWJUXRAGCC-MRXNPFEDSA-N 1 0 352.409 4.123 20 10 FICDRO COc1ccc([C@@H](C)CC[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000166090054 1088525268 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370.493 4.499 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2cccc(Br)c2)c1 ZINC000756483145 1090504286 /nfs/dbraw/zinc/50/42/86/1090504286.db2.gz NSYQWLYKGBETAV-CHWSQXEVSA-N 1 0 364.283 4.445 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(NC(=O)c3cccnc3)cc2)c(O)c1 ZINC000185253828 1090526589 /nfs/dbraw/zinc/52/65/89/1090526589.db2.gz KEUILYUUYOSNFX-INIZCTEOSA-N 1 0 361.445 4.199 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OC)cc2C(F)(F)F)c1 ZINC000185309846 1090532975 /nfs/dbraw/zinc/53/29/75/1090532975.db2.gz PIJYYSLZDMPLTD-LLVKDONJSA-N 1 0 355.356 4.279 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(c3ccccc3OC(F)F)C2)c(O)c1 ZINC000185477318 1090546513 /nfs/dbraw/zinc/54/65/13/1090546513.db2.gz VYIOWMBHQSDHDN-HUUCEWRRSA-N 1 0 362.420 4.232 20 10 FICDRO C[C@H]([NH2+]CCCNC(=O)c1cccs1)c1ccc2ccccc2c1O ZINC000186031706 1090603291 /nfs/dbraw/zinc/60/32/91/1090603291.db2.gz GMHHBKSEZISSDC-AWEZNQCLSA-N 1 0 354.475 4.078 20 10 FICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 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CC(=O)NCCc1ccc([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000479457796 1112030728 /nfs/dbraw/zinc/03/07/28/1112030728.db2.gz SEXHQZMNXPTTBZ-QGZVFWFLSA-N 1 0 363.505 4.016 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CCSC[C@@H]3C3CCC3)cc2)CC1 ZINC000842170527 1112422960 /nfs/dbraw/zinc/42/29/60/1112422960.db2.gz HVRNMFKGCRUBSQ-OAQYLSRUSA-N 1 0 360.567 4.019 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(C)cc1-c1cnn(C)c1 ZINC000554918501 1112561712 /nfs/dbraw/zinc/56/17/12/1112561712.db2.gz DMSKJVYIUVAUFU-UHFFFAOYSA-N 1 0 358.489 4.485 20 10 FICDRO CC[C@@H]([NH2+]Cc1cc(OC)c(OC)c(OC)c1)c1ccc(N(C)C)cc1 ZINC000160652765 1113430513 /nfs/dbraw/zinc/43/05/13/1113430513.db2.gz XARQYGHPUPBXCC-GOSISDBHSA-N 1 0 358.482 4.019 20 10 FICDRO COc1cc(C)c(C[N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)cc1OC ZINC000027529941 1113686812 /nfs/dbraw/zinc/68/68/12/1113686812.db2.gz XYECXRAIQKPHFT-UHFFFAOYSA-N 1 0 373.493 4.353 20 10 FICDRO Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CCCO2 ZINC000151072293 1114289805 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10 FICDRO CC[NH+]1CCC(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 ZINC000915269325 1120904116 /nfs/dbraw/zinc/90/41/16/1120904116.db2.gz PHIAGYYEJVQLKV-UHFFFAOYSA-N 1 0 367.537 4.432 20 10 FICDRO CC(C)(C)OC1CC(CC[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000762456782 1120910682 /nfs/dbraw/zinc/91/06/82/1120910682.db2.gz OZEXQGORKCRFBG-UHFFFAOYSA-N 1 0 356.304 4.228 20 10 FICDRO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000762471025 1120912557 /nfs/dbraw/zinc/91/25/57/1120912557.db2.gz URJILFVGNAFRFZ-GOSISDBHSA-N 1 0 358.482 4.220 20 10 FICDRO CN1CC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000762622932 1120940626 /nfs/dbraw/zinc/94/06/26/1120940626.db2.gz GHDWODHQXJNUFO-LAUBAEHRSA-N 1 0 374.887 4.197 20 10 FICDRO CN(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001649091637 1121722673 /nfs/dbraw/zinc/72/26/73/1121722673.db2.gz SWZJBYWAVCCOIN-RTWAWAEBSA-N 1 0 357.567 4.347 20 10 FICDRO C[N@H+](CCOCCOc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000917019866 1122008029 /nfs/dbraw/zinc/00/80/29/1122008029.db2.gz JJNFDROPEGCCRW-UHFFFAOYSA-N 1 0 368.521 4.204 20 10 FICDRO C[C@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cc(F)ccc1O ZINC000186289036 1122008946 /nfs/dbraw/zinc/00/89/46/1122008946.db2.gz UPUKLSIZXLRHEE-INIZCTEOSA-N 1 0 369.484 4.236 20 10 FICDRO CC(C)[N@H+](CCC(=O)Nc1ccccc1F)Cc1ccc(N(C)C)cc1 ZINC000917075378 1122070580 /nfs/dbraw/zinc/07/05/80/1122070580.db2.gz UMLQNNVHCLSMSH-UHFFFAOYSA-N 1 0 357.473 4.131 20 10 FICDRO COCCOc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000154729169 1122655512 /nfs/dbraw/zinc/65/55/12/1122655512.db2.gz PPACBNJHYVAORL-UHFFFAOYSA-N 1 0 367.445 4.213 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](C(C)(C)C)CC2)c(C)n1-c1cccc(C)c1 ZINC000918653405 1122731945 /nfs/dbraw/zinc/73/19/45/1122731945.db2.gz ILKWNDAWOXYOTK-UHFFFAOYSA-N 1 0 367.537 4.395 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+]C2CCN(C(=O)OCC)CC2)cc1 ZINC000918748799 1122772372 /nfs/dbraw/zinc/77/23/72/1122772372.db2.gz JMPHSNDNTZHBAT-UHFFFAOYSA-N 1 0 361.530 4.024 20 10 FICDRO CO[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000918748871 1122772470 /nfs/dbraw/zinc/77/24/70/1122772470.db2.gz BDZLOYDUHUIIIY-NRFANRHFSA-N 1 0 369.465 4.062 20 10 FICDRO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H](c2ccccc2)O1 ZINC000920306512 1123437292 /nfs/dbraw/zinc/43/72/92/1123437292.db2.gz VZGOLZIMOSFEQG-FOIQADDNSA-N 1 0 355.478 4.357 20 10 FICDRO C[C@@H]([NH2+]CCCc1cccc(F)c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000765899628 1124343685 /nfs/dbraw/zinc/34/36/85/1124343685.db2.gz XOWVOMXYDMUBOU-MRXNPFEDSA-N 1 0 360.448 4.085 20 10 FICDRO COc1cc(O)c(C[N@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)cc1OC ZINC000180617742 1124377838 /nfs/dbraw/zinc/37/78/38/1124377838.db2.gz XKOJEGORNOHFCF-ZDUSSCGKSA-N 1 0 364.511 4.491 20 10 FICDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765968182 1125206456 /nfs/dbraw/zinc/20/64/56/1125206456.db2.gz BQWAYZNMWCXDED-KRWDZBQOSA-N 1 0 369.484 4.495 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1 ZINC000182357283 1125424255 /nfs/dbraw/zinc/42/42/55/1125424255.db2.gz WASSKYGLCBYJMJ-CQSZACIVSA-N 1 0 357.450 4.207 20 10 FICDRO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(-n2ccnc2)cc1 ZINC000070975766 1125752047 /nfs/dbraw/zinc/75/20/47/1125752047.db2.gz VCKSXGUWLOSIHP-UHFFFAOYSA-N 1 0 359.429 4.373 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)c(O)c1C ZINC000274798513 1080081370 /nfs/dbraw/zinc/08/13/70/1080081370.db2.gz UHLMDGSXXKVDPW-FOIQADDNSA-N 1 0 353.441 4.322 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2 ZINC000530518980 1080376218 /nfs/dbraw/zinc/37/62/18/1080376218.db2.gz XZMWUJGCDQWJKG-INIZCTEOSA-N 1 0 350.462 4.499 20 10 FICDRO O=C1O[C@H](C[N@@H+](Cc2ccccc2O)C2CCCC2)CN1C1CCCCC1 ZINC001167353869 1081595577 /nfs/dbraw/zinc/59/55/77/1081595577.db2.gz QQMDXIIGZCITGM-HXUWFJFHSA-N 1 0 372.509 4.290 20 10 FICDRO Cc1cc(C[N@H+](C)CCc2ccc(Br)cc2)ccc1N(C)C ZINC001167360982 1081722653 /nfs/dbraw/zinc/72/26/53/1081722653.db2.gz XCJLMRDFYXHKNZ-UHFFFAOYSA-N 1 0 361.327 4.498 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCCC2)nc1)c1ccc(N(C)C)cc1 ZINC000160526338 1081984383 /nfs/dbraw/zinc/98/43/83/1081984383.db2.gz GJGXWZYTEWQAAB-GOSISDBHSA-N 1 0 352.526 4.379 20 10 FICDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccc2c(c1)CC(=O)N2C ZINC000728302818 1082047029 /nfs/dbraw/zinc/04/70/29/1082047029.db2.gz YFVDWHXRWSPGSS-INIZCTEOSA-N 1 0 372.468 4.429 20 10 FICDRO C[C@@H]([NH2+]CCc1coc(-c2ccc(F)cc2)n1)c1ccc(N(C)C)cc1 ZINC000091739356 1082089947 /nfs/dbraw/zinc/08/99/47/1082089947.db2.gz IVXQRLNMDFYAQF-OAHLLOKOSA-N 1 0 353.441 4.440 20 10 FICDRO CC(C)(C)OC(=O)NC1(C)CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000780492781 1082184682 /nfs/dbraw/zinc/18/46/82/1082184682.db2.gz OQSWQICOUXSWEM-UHFFFAOYSA-N 1 0 374.525 4.150 20 10 FICDRO CCOc1c(C)cc(C)cc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167436817 1082186339 /nfs/dbraw/zinc/18/63/39/1082186339.db2.gz AOAKCZOFJRFXKA-UHFFFAOYSA-N 1 0 353.510 4.066 20 10 FICDRO C[C@@H]([NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(N(C)C)cc1 ZINC000177937630 1082360448 /nfs/dbraw/zinc/36/04/48/1082360448.db2.gz RBJKAJNIYQKWHJ-IVZQSRNASA-N 1 0 352.478 4.326 20 10 FICDRO Cc1ccccc1[C@H]1C[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469546 1082655078 /nfs/dbraw/zinc/65/50/78/1082655078.db2.gz ZGEKEZRRTKRIPZ-CTNGQTDRSA-N 1 0 350.506 4.210 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]([NH2+]C(C)C)C2)c(C)n1-c1ccccc1C ZINC000728605788 1083542910 /nfs/dbraw/zinc/54/29/10/1083542910.db2.gz IOUBFAIRMUDREN-LJQANCHMSA-N 1 0 353.510 4.005 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2sccc2NC(=O)OC(C)(C)C)cc1 ZINC000892474855 1083590999 /nfs/dbraw/zinc/59/09/99/1083590999.db2.gz BZLIIDOIUWOLER-UHFFFAOYSA-N 1 0 361.511 4.451 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2cc3ccccc3o2)SC1=S ZINC000255844889 1083598907 /nfs/dbraw/zinc/59/89/07/1083598907.db2.gz LXVFUIQMSNQMSE-MHWRWJLKSA-N 1 0 374.531 4.222 20 10 FICDRO COc1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c(O)c1OC ZINC000892479233 1083635035 /nfs/dbraw/zinc/63/50/35/1083635035.db2.gz ZOPVVXBJXKGCMV-UHFFFAOYSA-N 1 0 367.367 4.207 20 10 FICDRO COc1cc(Br)cc(C[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000725843966 1083776081 /nfs/dbraw/zinc/77/60/81/1083776081.db2.gz JIYVEWIOTLYBNP-OAHLLOKOSA-N 1 0 368.296 4.466 20 10 FICDRO COc1ccc(C[NH2+][C@@H](CNC(=O)OC(C)(C)C)CC(C)C)cc1C ZINC000310642893 1084060308 /nfs/dbraw/zinc/06/03/08/1084060308.db2.gz FVJRIQZKFUJKRB-QGZVFWFLSA-N 1 0 350.503 4.033 20 10 FICDRO CC[NH+](CC)CCN(Cc1ccccc1)Cc1cc(F)cc(C(C)=O)c1O ZINC001167589679 1085246340 /nfs/dbraw/zinc/24/63/40/1085246340.db2.gz HYRXUAILCHZCJX-UHFFFAOYSA-N 1 0 372.484 4.078 20 10 FICDRO COc1ccc(N2CCC([NH2+]CC3(c4ccc(F)cc4)CC3)CC2)cc1 ZINC000161362188 1085381343 /nfs/dbraw/zinc/38/13/43/1085381343.db2.gz SWQBRSLKOLZJIA-UHFFFAOYSA-N 1 0 354.469 4.125 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)CCC2 ZINC000166284829 1085687408 /nfs/dbraw/zinc/68/74/08/1085687408.db2.gz BHCRBKOSFOBYAI-DEOSSOPVSA-N 1 0 364.533 4.371 20 10 FICDRO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000166609371 1086003844 /nfs/dbraw/zinc/00/38/44/1086003844.db2.gz HVAIEANQOQZMON-PDIWNELESA-N 1 0 350.506 4.376 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000166222264 1088545650 /nfs/dbraw/zinc/54/56/50/1088545650.db2.gz UPSXZPIKAAIWQL-NRFANRHFSA-N 1 0 354.469 4.138 20 10 FICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(OC[C@@H]2CCOC2)c1 ZINC000167177598 1088639095 /nfs/dbraw/zinc/63/90/95/1088639095.db2.gz AJSBLFHEBWEHFP-RTBURBONSA-N 1 0 368.521 4.327 20 10 FICDRO C[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1cc(Cl)ccc1O ZINC000281468475 1089005539 /nfs/dbraw/zinc/00/55/39/1089005539.db2.gz FDNYHJOIWFDRET-JTQLQIEISA-N 1 0 360.763 4.233 20 10 FICDRO Cc1nc([C@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 ZINC000378204044 1090218053 /nfs/dbraw/zinc/21/80/53/1090218053.db2.gz RZSDYMWSFMMCCC-LBPRGKRZSA-N 1 0 367.465 4.373 20 10 FICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000181461625 1090280419 /nfs/dbraw/zinc/28/04/19/1090280419.db2.gz JCQAXEMWAXWKFK-OAHLLOKOSA-N 1 0 353.388 4.061 20 10 FICDRO COc1cccc(-c2nc(C[NH2+][C@@H](C)c3cc(OC)ccc3O)cs2)c1 ZINC000182382140 1090348957 /nfs/dbraw/zinc/34/89/57/1090348957.db2.gz QGVWPBCOSAFHBP-ZDUSSCGKSA-N 1 0 370.474 4.384 20 10 FICDRO COc1ccc(C[NH2+]C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1C ZINC000312203208 1090428101 /nfs/dbraw/zinc/42/81/01/1090428101.db2.gz GMBFBAYOHUBFPO-LJQANCHMSA-N 1 0 370.493 4.359 20 10 FICDRO CCOCc1cc(C[NH2+]C(C)(C)c2nc3ccccc3n2C)ccc1OC ZINC000185635080 1090559760 /nfs/dbraw/zinc/55/97/60/1090559760.db2.gz YCRRPYZDGYMHDK-UHFFFAOYSA-N 1 0 367.493 4.143 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cn(-c2ccccc2)nn1 ZINC000186113095 1090615080 /nfs/dbraw/zinc/61/50/80/1090615080.db2.gz IKSUBPUFMVEZQZ-HOTGVXAUSA-N 1 0 362.477 4.264 20 10 FICDRO COc1cccc(C[NH2+]CCc2cccc(OCc3ccccc3)c2)c1O ZINC000312596432 1090978181 /nfs/dbraw/zinc/97/81/81/1090978181.db2.gz QXRJCJGNLLAITE-UHFFFAOYSA-N 1 0 363.457 4.312 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3nc4ccccc4s3)CC2)cc1 ZINC000053772220 1091653179 /nfs/dbraw/zinc/65/31/79/1091653179.db2.gz MQWYATIFRXUVMG-UHFFFAOYSA-N 1 0 353.491 4.017 20 10 FICDRO c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000236584384 1092397664 /nfs/dbraw/zinc/39/76/64/1092397664.db2.gz ISBPMTFEZFPVLF-GMAHTHKFSA-N 1 0 350.506 4.024 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000237261093 1093456554 /nfs/dbraw/zinc/45/65/54/1093456554.db2.gz PYCQQGWJALRUKD-UHFFFAOYSA-N 1 0 364.411 4.473 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1C(F)(F)F ZINC000067249694 1093807718 /nfs/dbraw/zinc/80/77/18/1093807718.db2.gz LBKYZOIJPLSQJH-HNNXBMFYSA-N 1 0 364.411 4.393 20 10 FICDRO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cn1nccc1-c1ccncc1 ZINC000729264912 1093954024 /nfs/dbraw/zinc/95/40/24/1093954024.db2.gz IQELPBDPPPJHTJ-UHFFFAOYSA-N 1 0 361.493 4.025 20 10 FICDRO COCCSc1ccc([C@H](C)[NH2+]Cc2cc(C)cc(OC)c2O)cc1 ZINC000894234966 1094275752 /nfs/dbraw/zinc/27/57/52/1094275752.db2.gz MRKNPQPADOYWAE-HNNXBMFYSA-N 1 0 361.507 4.299 20 10 FICDRO CC[C@@H]([NH2+][C@@H](Cc1nc(C)no1)c1ccccc1)c1ccc(C)cc1O ZINC000280012993 1094282731 /nfs/dbraw/zinc/28/27/31/1094282731.db2.gz GTLRAYSFQMHIOM-MOPGFXCFSA-N 1 0 351.450 4.417 20 10 FICDRO COc1cc(C[NH2+]C[C@@H](c2ccc(C)cc2)N(C)C)c(O)c(C(C)(C)C)c1 ZINC001648965180 1094299003 /nfs/dbraw/zinc/29/90/03/1094299003.db2.gz JOPYOCDTIWXSNY-NRFANRHFSA-N 1 0 370.537 4.399 20 10 FICDRO CC(=O)Nc1ccc(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)cc1 ZINC000015595155 1094432936 /nfs/dbraw/zinc/43/29/36/1094432936.db2.gz WQLDUXZIXTVJLG-UHFFFAOYSA-N 1 0 361.489 4.385 20 10 FICDRO Cc1cc(CCNC(=O)CC[C@H]2CCCC[N@H+]2C)c(C)n1-c1ccccc1 ZINC001648953181 1095182492 /nfs/dbraw/zinc/18/24/92/1095182492.db2.gz VGHJVOZXTQQBQG-OAQYLSRUSA-N 1 0 367.537 4.017 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)cc1C ZINC000273049834 1096231470 /nfs/dbraw/zinc/23/14/70/1096231470.db2.gz JLZILLMEMJMDHH-GOSISDBHSA-N 1 0 368.521 4.063 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)c(O)c1C ZINC000273359457 1096255444 /nfs/dbraw/zinc/25/54/44/1096255444.db2.gz DHYVTCAGRLMNRM-MSOLQXFVSA-N 1 0 353.510 4.280 20 10 FICDRO COCC[C@@H]([NH2+][C@H](C)c1cc(Br)ccc1O)c1ccco1 ZINC000273495174 1096267404 /nfs/dbraw/zinc/26/74/04/1096267404.db2.gz XRTWRAIXLPVYMQ-BXUZGUMPSA-N 1 0 354.244 4.176 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCCc2nc(C)no2)cc1 ZINC000729685719 1098633913 /nfs/dbraw/zinc/63/39/13/1098633913.db2.gz GTZHXFNMKFSAIB-UHFFFAOYSA-N 1 0 364.493 4.127 20 10 FICDRO Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000017318052 1101045128 /nfs/dbraw/zinc/04/51/28/1101045128.db2.gz NOZVLFMFORETFV-UHFFFAOYSA-N 1 0 368.912 4.249 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000185675722 1101743117 /nfs/dbraw/zinc/74/31/17/1101743117.db2.gz DLHOSCVDAIMRPQ-GJZGRUSLSA-N 1 0 351.450 4.307 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1cc(Cl)nc(Cl)c1)C[C@@H]1CCCO1 ZINC000109761760 1102171984 /nfs/dbraw/zinc/17/19/84/1102171984.db2.gz KUTAKCMEXABYKM-HNNXBMFYSA-N 1 0 367.276 4.275 20 10 FICDRO Cc1cc(CN2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193585 1102274195 /nfs/dbraw/zinc/27/41/95/1102274195.db2.gz RSRQMQSGINIXCZ-WOJBJXKFSA-N 1 0 351.538 4.156 20 10 FICDRO C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 ZINC000127537905 1102731067 /nfs/dbraw/zinc/73/10/67/1102731067.db2.gz YTDMMBFIKFLLSL-ICSRJNTNSA-N 1 0 358.526 4.056 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1COC2(CCCCC2)O1 ZINC001167983416 1102880483 /nfs/dbraw/zinc/88/04/83/1102880483.db2.gz LCFCYCGHAVVBGY-IBGZPJMESA-N 1 0 357.450 4.063 20 10 FICDRO Oc1ccccc1C[N@@H+](C[C@H]1CC[C@H](c2ccccc2)O1)C[C@@H]1CCCO1 ZINC001167984669 1103214653 /nfs/dbraw/zinc/21/46/53/1103214653.db2.gz VNSRXORLRPDMST-QZNHQXDQSA-N 1 0 367.489 4.294 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 ZINC001648957108 1104454498 /nfs/dbraw/zinc/45/44/98/1104454498.db2.gz YQNWNMSRYKCQKA-GCJKJVERSA-N 1 0 350.506 4.121 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c1 ZINC000760037094 1104925798 /nfs/dbraw/zinc/92/57/98/1104925798.db2.gz HETRDOFFOOMZOD-WQTXXOFMSA-N 1 0 357.469 4.264 20 10 FICDRO CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CC[C@@H]([NH3+])c1ccccc1 ZINC000237217358 1105100878 /nfs/dbraw/zinc/10/08/78/1105100878.db2.gz KMDAURGKMNVYEM-JOCHJYFZSA-N 1 0 365.521 4.116 20 10 FICDRO CN(C)c1ccc(CN(C)Cc2cc(F)c(F)cc2Br)cc1 ZINC001142015465 1106823263 /nfs/dbraw/zinc/82/32/63/1106823263.db2.gz OKFBVQKXWAAABT-UHFFFAOYSA-N 1 0 369.253 4.425 20 10 FICDRO OCC1CCN(c2ccc(CNc3cc[nH+]c4cc(F)ccc34)cc2)CC1 ZINC000301253760 1106972461 /nfs/dbraw/zinc/97/24/61/1106972461.db2.gz JWEFFEHFEXAGPS-UHFFFAOYSA-N 1 0 365.452 4.195 20 10 FICDRO Cc1ccc(O)c(C[NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c1 ZINC000529637287 1110297693 /nfs/dbraw/zinc/29/76/93/1110297693.db2.gz BFNGFOVLKVSANK-UHFFFAOYSA-N 1 0 355.482 4.196 20 10 FICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000529666567 1110302438 /nfs/dbraw/zinc/30/24/38/1110302438.db2.gz WIDZCDPNLHACMN-UHFFFAOYSA-N 1 0 357.457 4.285 20 10 FICDRO Clc1ccnc2c1CC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000924707620 1111799582 /nfs/dbraw/zinc/79/95/82/1111799582.db2.gz NKZABAMXVVZRBY-SFHVURJKSA-N 1 0 359.926 4.065 20 10 FICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCSCC3)cc1)CC2 ZINC000163595038 1113875649 /nfs/dbraw/zinc/87/56/49/1113875649.db2.gz LOUKUIFDDXXFJQ-OAQYLSRUSA-N 1 0 354.519 4.026 20 10 FICDRO CC(C)N(CCC[NH2+]Cc1c(O)cccc1Cl)C(=O)OC(C)(C)C ZINC000698118874 1114025490 /nfs/dbraw/zinc/02/54/90/1114025490.db2.gz HZDJJCREPQHVJT-UHFFFAOYSA-N 1 0 356.894 4.171 20 10 FICDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1ccc(N3CCSCC3)cc1)CCC2 ZINC000163619990 1114163421 /nfs/dbraw/zinc/16/34/21/1114163421.db2.gz KZDMIBBGHRFTAK-QGZVFWFLSA-N 1 0 359.564 4.172 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000151043110 1114281332 /nfs/dbraw/zinc/28/13/32/1114281332.db2.gz PHBHCOCRZXKUFP-KRWDZBQOSA-N 1 0 351.494 4.120 20 10 FICDRO COc1cc(C)cc(C[N@H+](C)Cc2csc(Br)c2)c1O ZINC000164211626 1114443418 /nfs/dbraw/zinc/44/34/18/1114443418.db2.gz NEQBORKHBRLIMV-UHFFFAOYSA-N 1 0 356.285 4.165 20 10 FICDRO CC(C)[C@H](C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cccnc1 ZINC000164200016 1114443924 /nfs/dbraw/zinc/44/39/24/1114443924.db2.gz PVTWBLJNXZWRPQ-XLIONFOSSA-N 1 0 371.500 4.148 20 10 FICDRO CCNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)cc1 ZINC000156555683 1114459680 /nfs/dbraw/zinc/45/96/80/1114459680.db2.gz XXIQOEVEHSEXFT-GOSISDBHSA-N 1 0 365.521 4.277 20 10 FICDRO COc1cc(Cl)cc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1O ZINC000761193454 1115613203 /nfs/dbraw/zinc/61/32/03/1115613203.db2.gz DWMPUUPVPKKHMD-INIZCTEOSA-N 1 0 366.933 4.142 20 10 FICDRO CCOCc1cc(C[NH2+]C[C@@H](c2ccc(C)o2)N2CCCC2)ccc1OC ZINC000171133909 1115840401 /nfs/dbraw/zinc/84/04/01/1115840401.db2.gz RXEGCDUNEYJYLE-FQEVSTJZSA-N 1 0 372.509 4.060 20 10 FICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(N2CCCC2=O)cc1 ZINC000171380883 1115863309 /nfs/dbraw/zinc/86/33/09/1115863309.db2.gz OCJYINLWICYSSL-KRWDZBQOSA-N 1 0 363.505 4.047 20 10 FICDRO Oc1ccccc1CN(Cc1ccco1)Cc1ccc(Br)cn1 ZINC000172536766 1115959384 /nfs/dbraw/zinc/95/93/84/1115959384.db2.gz JTAIGUSWEBJMQX-UHFFFAOYSA-N 1 0 373.250 4.345 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)cc1 ZINC000174390976 1116134147 /nfs/dbraw/zinc/13/41/47/1116134147.db2.gz RKFFKAWOYLHTNM-UHFFFAOYSA-N 1 0 356.485 4.467 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(OC)c1 ZINC000151519289 1116328793 /nfs/dbraw/zinc/32/87/93/1116328793.db2.gz IIIZPUUFVPWIMO-OAQYLSRUSA-N 1 0 372.484 4.036 20 10 FICDRO Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c1 ZINC000151524991 1116335176 /nfs/dbraw/zinc/33/51/76/1116335176.db2.gz GFPPHFSHUIJBLK-KRWDZBQOSA-N 1 0 356.485 4.254 20 10 FICDRO Cc1cccc(C(=O)N2CCC[N@H+](Cc3c(O)ccc4ccccc43)CC2)c1 ZINC000029889871 1118938496 /nfs/dbraw/zinc/93/84/96/1118938496.db2.gz RZVIXXNYGISNPR-UHFFFAOYSA-N 1 0 374.484 4.202 20 10 FICDRO COc1cc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)ccc1F ZINC000153017053 1119819323 /nfs/dbraw/zinc/81/93/23/1119819323.db2.gz BULXHGYNYLTPIH-HNNXBMFYSA-N 1 0 360.498 4.238 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 ZINC000915683507 1121021567 /nfs/dbraw/zinc/02/15/67/1121021567.db2.gz RYKGDOYYUASPMU-MRXNPFEDSA-N 1 0 351.494 4.268 20 10 FICDRO C[C@H]([NH2+]Cc1cccnc1OCC(F)F)c1ccc2ccccc2c1O ZINC000186199254 1121642449 /nfs/dbraw/zinc/64/24/49/1121642449.db2.gz ZAZHNCNYOYIFDL-ZDUSSCGKSA-N 1 0 358.388 4.435 20 10 FICDRO COC(=O)CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC001649089973 1121715272 /nfs/dbraw/zinc/71/52/72/1121715272.db2.gz BGVFPFPADNRQTF-LJQANCHMSA-N 1 0 350.462 4.271 20 10 FICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 ZINC000916839562 1121882796 /nfs/dbraw/zinc/88/27/96/1121882796.db2.gz GMIGBZZUBDCCHZ-INIZCTEOSA-N 1 0 369.465 4.445 20 10 FICDRO CC[NH+]1CCN(c2ccc(N[C@@H](C)c3cc(OC)ccc3O)c(C)c2)CC1 ZINC000186237232 1121976345 /nfs/dbraw/zinc/97/63/45/1121976345.db2.gz VXTILIWYJLRVOS-KRWDZBQOSA-N 1 0 369.509 4.024 20 10 FICDRO CC(C)[N@H+](CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000917075100 1122069806 /nfs/dbraw/zinc/06/98/06/1122069806.db2.gz PYYLTNUYELCJLE-IBGZPJMESA-N 1 0 367.537 4.183 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3cc(Cl)ccc3OC)CC2)cc1 ZINC000917090003 1122103215 /nfs/dbraw/zinc/10/32/15/1122103215.db2.gz SNXZTUNSWIGYHJ-UHFFFAOYSA-N 1 0 360.885 4.070 20 10 FICDRO CC1CCN([C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)c2cccs2)CC1 ZINC000917392606 1122285933 /nfs/dbraw/zinc/28/59/33/1122285933.db2.gz CIPOOQVETWBJMP-IBGZPJMESA-N 1 0 356.535 4.246 20 10 FICDRO Clc1ccccc1[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCC1 ZINC000917392797 1122286723 /nfs/dbraw/zinc/28/67/23/1122286723.db2.gz MPNLAAYKQJROFD-HXUWFJFHSA-N 1 0 356.897 4.202 20 10 FICDRO COCCOc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154727050 1122642917 /nfs/dbraw/zinc/64/29/17/1122642917.db2.gz DXIPJJOXRKHMPD-UHFFFAOYSA-N 1 0 367.445 4.213 20 10 FICDRO Cc1cc(C(=O)N2CCC(CC[NH+](C)C)CC2)c(C)n1-c1ccc(F)cc1 ZINC000918705446 1122754809 /nfs/dbraw/zinc/75/48/09/1122754809.db2.gz AWQMOZHIORDVGO-UHFFFAOYSA-N 1 0 371.500 4.037 20 10 FICDRO Oc1cc2c(cc1C[NH+]1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCC2 ZINC000918736718 1122766908 /nfs/dbraw/zinc/76/69/08/1122766908.db2.gz XNGKWZTUONXOKC-ZIAGYGMSSA-N 1 0 367.333 4.444 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984913 1123300366 /nfs/dbraw/zinc/30/03/66/1123300366.db2.gz WGRCOWZFXGFCAD-QZTJIDSGSA-N 1 0 371.912 4.104 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000155187232 1123351664 /nfs/dbraw/zinc/35/16/64/1123351664.db2.gz BURODCRJHJUVNP-CYBMUJFWSA-N 1 0 366.839 4.306 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2ccc3c(c2)OCCO3)cc1 ZINC000920957025 1123542081 /nfs/dbraw/zinc/54/20/81/1123542081.db2.gz UYIUZHFOZJVNGU-UHFFFAOYSA-N 1 0 354.494 4.374 20 10 FICDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000765902718 1124353815 /nfs/dbraw/zinc/35/38/15/1124353815.db2.gz DKXATNBOEGFHLU-LPHOPBHVSA-N 1 0 354.469 4.043 20 10 FICDRO C[NH+]1CCN(c2ccccc2NCc2cc(-c3ccccc3)ccc2O)CC1 ZINC000763498521 1125121578 /nfs/dbraw/zinc/12/15/78/1125121578.db2.gz MQSDJQHVRGQHFX-UHFFFAOYSA-N 1 0 373.500 4.423 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCCCC[C@H]2C)C1 ZINC001128246768 1125123352 /nfs/dbraw/zinc/12/33/52/1125123352.db2.gz CWIPBQNEXIZQNK-GOSISDBHSA-N 1 0 367.537 4.199 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(Nc3ccccc3)n2)c1 ZINC000182339084 1125414945 /nfs/dbraw/zinc/41/49/45/1125414945.db2.gz MBALBFODQQJSEH-ZDUSSCGKSA-N 1 0 355.463 4.452 20 10 FICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1cnn(CC(F)(F)F)c1 ZINC000763517123 1125415372 /nfs/dbraw/zinc/41/53/72/1125415372.db2.gz PTFDTDRZZPVMSC-UHFFFAOYSA-N 1 0 361.367 4.108 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1)c1cc(Br)ccc1O ZINC000019909163 220302874 /nfs/dbraw/zinc/30/28/74/220302874.db2.gz KPMMONOLXLBQNG-INIZCTEOSA-N 1 0 350.256 4.404 20 10 FICDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)c1O ZINC000275266728 1080648093 /nfs/dbraw/zinc/64/80/93/1080648093.db2.gz BGDUHTPVPXCZMU-WDEREUQCSA-N 1 0 367.291 4.116 20 10 FICDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(F)cc(F)c2[O-])cc1 ZINC001648795637 1080804361 /nfs/dbraw/zinc/80/43/61/1080804361.db2.gz SITGKIBEZYGJDH-HNNXBMFYSA-N 1 0 360.448 4.335 20 10 FICDRO CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])c1 ZINC001648826917 1081262830 /nfs/dbraw/zinc/26/28/30/1081262830.db2.gz VQBLTUGYTIBXOT-UHFFFAOYSA-N 1 0 350.865 4.316 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2cn(-c3cccc(F)c3)nc2C)cc1 ZINC001648832753 1081272020 /nfs/dbraw/zinc/27/20/20/1081272020.db2.gz KXFCVJVZLFFILQ-UHFFFAOYSA-N 1 0 366.484 4.456 20 10 FICDRO c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000728301028 1082009719 /nfs/dbraw/zinc/00/97/19/1082009719.db2.gz IJJWMXWUCLFTMO-UPVQGACJSA-N 1 0 364.533 4.414 20 10 FICDRO Cc1ccc2c(C)cc(NCc3ccc(N4CC[NH+](C)CC4)cc3)nc2c1 ZINC001167426957 1082055755 /nfs/dbraw/zinc/05/57/55/1082055755.db2.gz QCWKCZWAUQPBPM-UHFFFAOYSA-N 1 0 360.505 4.216 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000178082916 1082719579 /nfs/dbraw/zinc/71/95/79/1082719579.db2.gz LYMAHWZTQLTWES-AOMKIAJQSA-N 1 0 372.484 4.209 20 10 FICDRO CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000078458366 1082822153 /nfs/dbraw/zinc/82/21/53/1082822153.db2.gz WTSVYNHPCVVERP-KRWDZBQOSA-N 1 0 368.525 4.477 20 10 FICDRO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)c1 ZINC000078974465 1082844845 /nfs/dbraw/zinc/84/48/45/1082844845.db2.gz YVKRQJWTYBYWJI-GOSISDBHSA-N 1 0 354.494 4.161 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(OC[C@H]3CCCCO3)CC2)cc1C(C)C ZINC000176206920 1083750297 /nfs/dbraw/zinc/75/02/97/1083750297.db2.gz LSXORUQFMSZAKA-HXUWFJFHSA-N 1 0 361.526 4.374 20 10 FICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C(C)C)cc1 ZINC000066236463 1084204532 /nfs/dbraw/zinc/20/45/32/1084204532.db2.gz JAUZJSQHYMTVTL-QFIPXVFZSA-N 1 0 354.494 4.019 20 10 FICDRO COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000177973919 1084517169 /nfs/dbraw/zinc/51/71/69/1084517169.db2.gz CNDMKSHZRZXWJV-SFHVURJKSA-N 1 0 354.494 4.163 20 10 FICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)C(C)(C)C ZINC000934287290 1084627825 /nfs/dbraw/zinc/62/78/25/1084627825.db2.gz OENOZNIUODONDG-OAQYLSRUSA-N 1 0 353.510 4.104 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000178082371 1084658680 /nfs/dbraw/zinc/65/86/80/1084658680.db2.gz LGHDEGAPWHVXFX-VGOFRKELSA-N 1 0 354.494 4.070 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@H](C)COCc3ccccc3)CC2)cc1 ZINC000161300455 1085073414 /nfs/dbraw/zinc/07/34/14/1085073414.db2.gz NHJMCSSRUQQEOG-IBGZPJMESA-N 1 0 368.521 4.107 20 10 FICDRO O=C(CC1CCCC1)NC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000066858973 1085188074 /nfs/dbraw/zinc/18/80/74/1085188074.db2.gz KDNUVLVBWUIAII-UHFFFAOYSA-N 1 0 366.505 4.206 20 10 FICDRO C[C@H]([NH2+]CCCOC1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000125245076 1085370465 /nfs/dbraw/zinc/37/04/65/1085370465.db2.gz VEGBLNWCXIKGLW-INIZCTEOSA-N 1 0 366.933 4.177 20 10 FICDRO COc1ccccc1[C@@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178443418 1085774722 /nfs/dbraw/zinc/77/47/22/1085774722.db2.gz HOYAQIBQJJWEGR-UTKZUKDTSA-N 1 0 354.494 4.070 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(C(N)=O)c1)c1ccc(N2CCCCCC2)cc1 ZINC000122264155 1086049717 /nfs/dbraw/zinc/04/97/17/1086049717.db2.gz CJMJZHBTAGZPRE-QGZVFWFLSA-N 1 0 351.494 4.017 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000136742140 1086350651 /nfs/dbraw/zinc/35/06/51/1086350651.db2.gz MYAVQLMXVRACET-HNNXBMFYSA-N 1 0 354.288 4.126 20 10 FICDRO COC(=O)[C@@H](c1ccccc1)N(C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001167799040 1086425919 /nfs/dbraw/zinc/42/59/19/1086425919.db2.gz TYCXLWMFIXXMOT-JOCHJYFZSA-N 1 0 366.505 4.331 20 10 FICDRO COC(=O)[C@H](c1ccccc1)N(C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001167799041 1086426325 /nfs/dbraw/zinc/42/63/25/1086426325.db2.gz TYCXLWMFIXXMOT-QFIPXVFZSA-N 1 0 366.505 4.331 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(OC)c(Br)c2)c1 ZINC000122453587 1089424565 /nfs/dbraw/zinc/42/45/65/1089424565.db2.gz RDSOBOJYNCOONS-NSHDSACASA-N 1 0 366.255 4.023 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)c(O)c1OC ZINC000893133090 1089955398 /nfs/dbraw/zinc/95/53/98/1089955398.db2.gz ZYYWZSKFEJVECI-LLVKDONJSA-N 1 0 371.355 4.159 20 10 FICDRO CC(C)[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)Cc1ccccc1O ZINC000179553239 1090080102 /nfs/dbraw/zinc/08/01/02/1090080102.db2.gz WAQRYKMJGHHWKY-UHFFFAOYSA-N 1 0 366.383 4.260 20 10 FICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000122883871 1090216616 /nfs/dbraw/zinc/21/66/16/1090216616.db2.gz VSEVPPXQGVPPKX-CVEARBPZSA-N 1 0 374.912 4.164 20 10 FICDRO CC(C)(C)c1cc(C[NH2+][C@@H]2CCc3n[nH]cc3C2)c(O)c(C(C)(C)C)c1 ZINC000236667366 1090231775 /nfs/dbraw/zinc/23/17/75/1090231775.db2.gz RLCZPXYIRZDWGH-QGZVFWFLSA-N 1 0 355.526 4.357 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2coc(-c3ccc(F)c(F)c3)n2)c1 ZINC000182368790 1090348174 /nfs/dbraw/zinc/34/81/74/1090348174.db2.gz PSIARYBSSXTEJA-NSHDSACASA-N 1 0 360.360 4.185 20 10 FICDRO CCOc1ccc(C2(C[NH2+][C@@H](C)c3ccccc3O)CCOCC2)cc1 ZINC000183444792 1090415829 /nfs/dbraw/zinc/41/58/29/1090415829.db2.gz JWZCZIASZBHWIM-KRWDZBQOSA-N 1 0 355.478 4.190 20 10 FICDRO C[C@@H]([NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccccc1O ZINC000183472525 1090416143 /nfs/dbraw/zinc/41/61/43/1090416143.db2.gz RVDJXUXFPQFEPP-QGZVFWFLSA-N 1 0 370.456 4.491 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(Br)cc1O ZINC000185120482 1090509747 /nfs/dbraw/zinc/50/97/47/1090509747.db2.gz HXUJPZGDLCEYIJ-NEPJUHHUSA-N 1 0 350.256 4.059 20 10 FICDRO CCc1noc(-c2ccc(CC[NH2+][C@H](C)c3ccc(C)cc3O)cc2)n1 ZINC000185987428 1090598203 /nfs/dbraw/zinc/59/82/03/1090598203.db2.gz IMGFVKFADIAURS-OAHLLOKOSA-N 1 0 351.450 4.206 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CCCCC3)c2)cc1 ZINC000162400671 1090846692 /nfs/dbraw/zinc/84/66/92/1090846692.db2.gz PJTHIHDRJYFDTQ-GOSISDBHSA-N 1 0 352.526 4.379 20 10 FICDRO CC1(C)Cc2cccc(C[NH2+]Cc3ccc(N4CCSCC4)cc3)c2O1 ZINC000236700827 1091449459 /nfs/dbraw/zinc/44/94/59/1091449459.db2.gz ARIZTXNJNWAEHL-UHFFFAOYSA-N 1 0 368.546 4.243 20 10 FICDRO CCOc1cccc(CNc2ccc(OCC[NH+]3CCCC3)c(C)c2)c1O ZINC000236940653 1093027220 /nfs/dbraw/zinc/02/72/20/1093027220.db2.gz GSQWYHOYBKYAEF-UHFFFAOYSA-N 1 0 370.493 4.186 20 10 FICDRO COc1cc([C@@H](C)[NH2+]Cc2ccccc2O)ccc1OCc1ccncc1 ZINC000237255501 1093199832 /nfs/dbraw/zinc/19/98/32/1093199832.db2.gz BNGJMWAHYGTFCB-MRXNPFEDSA-N 1 0 364.445 4.226 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccc4c(c3)OCCO4)CCCC2)c1 ZINC000236974682 1093255742 /nfs/dbraw/zinc/25/57/42/1093255742.db2.gz DLBBQFSNWOXQBX-UHFFFAOYSA-N 1 0 369.461 4.121 20 10 FICDRO COc1cc(C)cc(C[NH2+]Cc2cccc(NC(=O)C3CCCC3)c2)c1O ZINC000894196920 1093906168 /nfs/dbraw/zinc/90/61/68/1093906168.db2.gz IKBUEZYCXYSAGW-UHFFFAOYSA-N 1 0 368.477 4.128 20 10 FICDRO Cc1cc(CCNC(=O)CCCC[NH+]2CCCC2)c(C)n1-c1ccccc1 ZINC000729305724 1093959196 /nfs/dbraw/zinc/95/91/96/1093959196.db2.gz CTMNFPUXVQVTNH-UHFFFAOYSA-N 1 0 367.537 4.019 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc(OC)c1OC ZINC000273401652 1096259073 /nfs/dbraw/zinc/25/90/73/1096259073.db2.gz NEQDCIDHVWIMRE-VXGBXAGGSA-N 1 0 365.857 4.483 20 10 FICDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)c1ccco1 ZINC000273495180 1096267592 /nfs/dbraw/zinc/26/75/92/1096267592.db2.gz XRTWRAIXLPVYMQ-SMDDNHRTSA-N 1 0 354.244 4.176 20 10 FICDRO Cc1nc(CN2CCC(C[NH2+][C@H](C)c3ccc(C)c(C)c3O)CC2)oc1C ZINC000273615745 1096279153 /nfs/dbraw/zinc/27/91/53/1096279153.db2.gz XHHZJFNHWYRBIL-QGZVFWFLSA-N 1 0 371.525 4.177 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCCC2=CCCC2)C1 ZINC000435919592 1098560402 /nfs/dbraw/zinc/56/04/02/1098560402.db2.gz ZJJDMSYQAIFEHY-UHFFFAOYSA-N 1 0 365.521 4.024 20 10 FICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1c1nc3ccccc3s1)OCO2 ZINC000007091977 1101633114 /nfs/dbraw/zinc/63/31/14/1101633114.db2.gz YTKWEQDVSFHDBM-AWEZNQCLSA-N 1 0 354.431 4.068 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)nc2-n2cc(Cl)cn2)c(O)c1 ZINC000191526484 1101947542 /nfs/dbraw/zinc/94/75/42/1101947542.db2.gz LDXLMPIDLBLNPI-AWEZNQCLSA-N 1 0 356.857 4.094 20 10 FICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC000897994307 1102155507 /nfs/dbraw/zinc/15/55/07/1102155507.db2.gz FLEIYVZEYRGQHE-QFIPXVFZSA-N 1 0 367.537 4.228 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1cc(Cl)nc(Cl)c1)C[C@H]1CCCO1 ZINC000109761763 1102172216 /nfs/dbraw/zinc/17/22/16/1102172216.db2.gz KUTAKCMEXABYKM-OAHLLOKOSA-N 1 0 367.276 4.275 20 10 FICDRO C[C@H](COCc1ccccc1)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001167983452 1102887079 /nfs/dbraw/zinc/88/70/79/1102887079.db2.gz MBCJPUNRLUWSGX-SIKLNZKXSA-N 1 0 369.505 4.226 20 10 FICDRO CC(=O)c1cc(Cl)cc(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)c1O ZINC001167990478 1104372382 /nfs/dbraw/zinc/37/23/82/1104372382.db2.gz UPUVXSJNCPOYID-HXUWFJFHSA-N 1 0 373.880 4.120 20 10 FICDRO COC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)c1cccc(C(F)(F)F)c1 ZINC000237176382 1104960676 /nfs/dbraw/zinc/96/06/76/1104960676.db2.gz FLMBMDSZGCRSAC-QGZVFWFLSA-N 1 0 353.384 4.500 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(CO)C[C@@H]1c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000760042078 1105056138 /nfs/dbraw/zinc/05/61/38/1105056138.db2.gz RNUIVTAGGDFOFC-WSTZPKSXSA-N 1 0 363.860 4.392 20 10 FICDRO CCN1CC[C@H]([NH2+]Cc2cccc(C)c2O)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000783595077 1107676840 /nfs/dbraw/zinc/67/68/40/1107676840.db2.gz MJHSMZDTAJZBGW-HKUYNNGSSA-N 1 0 364.411 4.043 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc(Br)s2)c1O ZINC000228670235 1108778734 /nfs/dbraw/zinc/77/87/34/1108778734.db2.gz UPFKBLLNUQRHDG-UHFFFAOYSA-N 1 0 362.676 4.168 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000367396159 1109665308 /nfs/dbraw/zinc/66/53/08/1109665308.db2.gz HEPSKFCEASEFIJ-IERDGZPVSA-N 1 0 351.494 4.291 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000479441660 1112023922 /nfs/dbraw/zinc/02/39/22/1112023922.db2.gz UVDSOLUHCWOTCG-OAQYLSRUSA-N 1 0 356.473 4.350 20 10 FICDRO CSc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1F ZINC000151063001 1114288163 /nfs/dbraw/zinc/28/81/63/1114288163.db2.gz QODCLNBCWNUOIG-HNNXBMFYSA-N 1 0 360.498 4.235 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cc2c(s1)CCCC2 ZINC000151063489 1114288204 /nfs/dbraw/zinc/28/82/04/1114288204.db2.gz FAIXJTPPYHWJEF-MRXNPFEDSA-N 1 0 356.535 4.314 20 10 FICDRO CCOCc1cc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)ccc1OC ZINC000760647472 1114402176 /nfs/dbraw/zinc/40/21/76/1114402176.db2.gz OVGJLUNBJSKADP-UHFFFAOYSA-N 1 0 369.505 4.152 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Br)ccc2Cl)cc1 ZINC000225248914 1115111504 /nfs/dbraw/zinc/11/15/04/1115111504.db2.gz FHPYDWOGDSKCJX-UHFFFAOYSA-N 1 0 353.691 4.458 20 10 FICDRO CC1CCN(c2ccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)cc2)CC1 ZINC000157495135 1115145424 /nfs/dbraw/zinc/14/54/24/1115145424.db2.gz XRCVJBUWBWHBOA-UHFFFAOYSA-N 1 0 369.475 4.039 20 10 FICDRO C[C@@H]([NH2+]CCCOC[C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000158225238 1115546263 /nfs/dbraw/zinc/54/62/63/1115546263.db2.gz HQBSMMILNKHMHT-UXHICEINSA-N 1 0 360.542 4.161 20 10 FICDRO COc1cc(Cl)cc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c1O ZINC000761193455 1115613043 /nfs/dbraw/zinc/61/30/43/1115613043.db2.gz DWMPUUPVPKKHMD-MRXNPFEDSA-N 1 0 366.933 4.142 20 10 FICDRO COc1cc(Cl)cc(C[N@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1O ZINC000761191823 1115613975 /nfs/dbraw/zinc/61/39/75/1115613975.db2.gz XBSDADXEXMPYCX-UHFFFAOYSA-N 1 0 369.852 4.220 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](OC)c2ccccc2F)c1O ZINC000761214234 1115645675 /nfs/dbraw/zinc/64/56/75/1115645675.db2.gz AGMZNXHBKRSIDU-ZMZPIMSZSA-N 1 0 353.821 4.059 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](OC)c2ccc(F)cc2)c1O ZINC000761216692 1115648592 /nfs/dbraw/zinc/64/85/92/1115648592.db2.gz WDQBGBOJAGKWFV-VOJFVSQTSA-N 1 0 353.821 4.059 20 10 FICDRO C[C@@H]([NH2+]Cc1cn2cc(Br)ccc2n1)c1ccc(N(C)C)cc1 ZINC000130051358 1116173214 /nfs/dbraw/zinc/17/32/14/1116173214.db2.gz SZHVKHLFERHZAG-CYBMUJFWSA-N 1 0 373.298 4.014 20 10 FICDRO CCC[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 ZINC000151509310 1116250058 /nfs/dbraw/zinc/25/00/58/1116250058.db2.gz PANGKQCSJBLIKL-NRFANRHFSA-N 1 0 356.485 4.418 20 10 FICDRO CC(C)CCCCC(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC001127268360 1119386812 /nfs/dbraw/zinc/38/68/12/1119386812.db2.gz YXFFOKPOKBGJJD-UHFFFAOYSA-N 1 0 371.569 4.051 20 10 FICDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1cc(Br)ccc1O ZINC000761500063 1119400875 /nfs/dbraw/zinc/40/08/75/1119400875.db2.gz RRZGIWDRSNATIP-WMZOPIPTSA-N 1 0 364.283 4.237 20 10 FICDRO O=C(NC[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1)c1ccccc1 ZINC000176496806 1119540172 /nfs/dbraw/zinc/54/01/72/1119540172.db2.gz AICFVLXJBPYMRQ-GOSISDBHSA-N 1 0 374.484 4.187 20 10 FICDRO Cc1cc(C[NH2+]Cc2cccc(C(=O)N(C)C)c2)c(C)n1-c1ccccc1 ZINC000914795891 1120541503 /nfs/dbraw/zinc/54/15/03/1120541503.db2.gz JFTHMEUSEZBKCQ-UHFFFAOYSA-N 1 0 361.489 4.086 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@]2(O)CCC[C@H](C(F)(F)F)C2)cc1 ZINC000780581505 1120578792 /nfs/dbraw/zinc/57/87/92/1120578792.db2.gz YWTCTIRTPNBHOM-WMZOPIPTSA-N 1 0 358.448 4.106 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F ZINC000153548989 1120912705 /nfs/dbraw/zinc/91/27/05/1120912705.db2.gz KMKHDEVTOHEOGP-UONOGXRCSA-N 1 0 364.411 4.352 20 10 FICDRO COCC[N@H+](C)CCCNC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000915303945 1120916369 /nfs/dbraw/zinc/91/63/69/1120916369.db2.gz NCPBAJDIHVRROR-UHFFFAOYSA-N 1 0 369.469 4.192 20 10 FICDRO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1c(O)ccc3ccncc31)CCC2 ZINC000763218693 1121292780 /nfs/dbraw/zinc/29/27/80/1121292780.db2.gz GZAUZMZTJAZLOK-KRWDZBQOSA-N 1 0 353.491 4.469 20 10 FICDRO CCOc1cc2c(cc1C[NH2+]Cc1ccc3c(c1)CCCO3)O[C@H](C)C2 ZINC001649054814 1121361538 /nfs/dbraw/zinc/36/15/38/1121361538.db2.gz LQRKELPQHLZOQE-OAHLLOKOSA-N 1 0 353.462 4.024 20 10 FICDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1 ZINC000765778675 1121980889 /nfs/dbraw/zinc/98/08/89/1121980889.db2.gz DKJYVPJTMIABEN-CVEARBPZSA-N 1 0 360.448 4.256 20 10 FICDRO O=C(c1cc(F)ccc1F)C1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000917460697 1122313197 /nfs/dbraw/zinc/31/31/97/1122313197.db2.gz IDBBOVTUQZPGRX-UHFFFAOYSA-N 1 0 371.427 4.254 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](c3ccccc3)c3ccccn3)CC2)cc1 ZINC000154622541 1122529108 /nfs/dbraw/zinc/52/91/08/1122529108.db2.gz JMADDMHVRKSGBK-XMMPIXPASA-N 1 0 373.500 4.438 20 10 FICDRO C[N@@H+](Cc1c(O)ccc2cc(Br)ccc21)C[C@@H]1CCCCO1 ZINC000918735302 1122766168 /nfs/dbraw/zinc/76/61/68/1122766168.db2.gz JFASWXLCCGYLCU-HNNXBMFYSA-N 1 0 364.283 4.309 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1ccc(N(C)C)cc1 ZINC000154973780 1122992163 /nfs/dbraw/zinc/99/21/63/1122992163.db2.gz IAELRGXERDUGTP-KRWDZBQOSA-N 1 0 367.415 4.330 20 10 FICDRO CCCCNC(=O)C1CC[NH+](Cc2cc(CC)cc(C(C)(C)C)c2O)CC1 ZINC000919940754 1123274584 /nfs/dbraw/zinc/27/45/84/1123274584.db2.gz MPKMZPXKXFXTOU-UHFFFAOYSA-N 1 0 374.569 4.380 20 10 FICDRO COc1ccc2ccc(O)c(C[N@H+](C)Cc3cc(OC)cc(OC)c3)c2c1 ZINC000919957503 1123283754 /nfs/dbraw/zinc/28/37/54/1123283754.db2.gz RIMKEEWSOKBJHB-UHFFFAOYSA-N 1 0 367.445 4.203 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](O)c2ccccc2C(F)(F)F)cc1 ZINC000921067195 1123555122 /nfs/dbraw/zinc/55/51/22/1123555122.db2.gz NQSZAWFTNJMDSB-LJQANCHMSA-N 1 0 366.427 4.375 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3cccc4c3OC(C)(C)C4)CC2)cc1 ZINC000237572293 1123987048 /nfs/dbraw/zinc/98/70/48/1123987048.db2.gz VVXCBBWMDTYVAF-UHFFFAOYSA-N 1 0 366.505 4.167 20 10 FICDRO CCCN(C(=O)c1cccs1)C1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000180759272 1124418728 /nfs/dbraw/zinc/41/87/28/1124418728.db2.gz MONZCTFIYVLYCS-UHFFFAOYSA-N 1 0 372.534 4.279 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)c1 ZINC000765912417 1124463961 /nfs/dbraw/zinc/46/39/61/1124463961.db2.gz WIYAITGEOOBTAL-FDDCHVKYSA-N 1 0 368.521 4.460 20 10 FICDRO COc1cc(C[N@H+](C)Cc2ccc(Cl)cc2)c(O)cc1Br ZINC001236755063 1125009355 /nfs/dbraw/zinc/00/93/55/1125009355.db2.gz ZCGUAGSMWMGMGV-UHFFFAOYSA-N 1 0 370.674 4.449 20 10 FICDRO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000182242430 1125297590 /nfs/dbraw/zinc/29/75/90/1125297590.db2.gz DTICLPWXSWQYMB-OAHLLOKOSA-N 1 0 358.432 4.141 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCC(=O)Nc2c(C)cccc2C)c1 ZINC000182340285 1125415535 /nfs/dbraw/zinc/41/55/35/1125415535.db2.gz ISFWWVGLOAEZFO-INIZCTEOSA-N 1 0 356.466 4.087 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)ccc2Br)c1 ZINC000038038956 211366047 /nfs/dbraw/zinc/36/60/47/211366047.db2.gz BPOWVKDIOKJWJS-JTQLQIEISA-N 1 0 354.219 4.153 20 10 FICDRO C[C@@H]1C[C@H]1C[N@@H+]1CCc2c(Cl)c(O)c(O)cc2[C@@H](c2ccc(O)cc2)C1 ZINC001209433032 1080680248 /nfs/dbraw/zinc/68/02/48/1080680248.db2.gz SNHQFYQFCDYPFA-UVBSCNOISA-N 1 0 373.880 4.103 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000160272579 1080701077 /nfs/dbraw/zinc/70/10/77/1080701077.db2.gz KVJWYAZLCOZTPI-JLTOFOAXSA-N 1 0 359.491 4.088 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000155308072 1080783442 /nfs/dbraw/zinc/78/34/42/1080783442.db2.gz JZUAXAYPKBWWLW-SJORKVTESA-N 1 0 369.465 4.152 20 10 FICDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)N(C)c1ccccc1 ZINC001648795704 1080805957 /nfs/dbraw/zinc/80/59/57/1080805957.db2.gz URHXPBCUDFSLEH-OAHLLOKOSA-N 1 0 365.443 4.386 20 10 FICDRO Cc1ccc(C)c(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 ZINC001648835317 1081277027 /nfs/dbraw/zinc/27/70/27/1081277027.db2.gz IRIQWXGAACPFOA-QZTJIDSGSA-N 1 0 356.485 4.346 20 10 FICDRO CCN(C)c1ccc(C[NH+]2CCN([C@H](C)c3cccc(OC)c3)CC2)cc1 ZINC001167360841 1081720708 /nfs/dbraw/zinc/72/07/08/1081720708.db2.gz SCQTVDDPXPKORH-LJQANCHMSA-N 1 0 367.537 4.030 20 10 FICDRO Cc1cc(C(=O)N2CCC([NH+]3CCC3)CC2)c(C)n1-c1cccc(Cl)c1 ZINC001167455759 1082490311 /nfs/dbraw/zinc/49/03/11/1082490311.db2.gz YSVQNGOVPHMNPT-UHFFFAOYSA-N 1 0 371.912 4.058 20 10 FICDRO Cc1cccc(OC[C@H](O)C[N@H+](Cc2ccc(N(C)C)c(C)c2)C(C)C)c1 ZINC001167487943 1082982606 /nfs/dbraw/zinc/98/26/06/1082982606.db2.gz ULRLUELQCJTGJG-OAQYLSRUSA-N 1 0 370.537 4.020 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000684559642 1083352781 /nfs/dbraw/zinc/35/27/81/1083352781.db2.gz MVIBENKVKXFSBC-CYBMUJFWSA-N 1 0 358.283 4.495 20 10 FICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000092786067 1083413432 /nfs/dbraw/zinc/41/34/32/1083413432.db2.gz KMPCFSGXOCTSEV-INIZCTEOSA-N 1 0 367.424 4.269 20 10 FICDRO C[NH+](C)C1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000255696368 1083422216 /nfs/dbraw/zinc/42/22/16/1083422216.db2.gz UDNOHCULBDCGMX-UHFFFAOYSA-N 1 0 365.481 4.067 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cnc3cc(C)nn3c2C)cc1 ZINC000179400806 1083449182 /nfs/dbraw/zinc/44/91/82/1083449182.db2.gz FYBYNLSDDBTMDX-INIZCTEOSA-N 1 0 351.498 4.043 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)c1O ZINC000179597477 1083570842 /nfs/dbraw/zinc/57/08/42/1083570842.db2.gz KFCAFIJCUYZDBY-JTQLQIEISA-N 1 0 353.340 4.186 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)c2ccccc2)n1 ZINC000277032463 1083724895 /nfs/dbraw/zinc/72/48/95/1083724895.db2.gz FIBNSQCSKQVAAH-YVEFUNNKSA-N 1 0 357.841 4.372 20 10 FICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F ZINC000162260277 1083922530 /nfs/dbraw/zinc/92/25/30/1083922530.db2.gz TXZPDNSDZLPMNL-HOTGVXAUSA-N 1 0 358.457 4.083 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1cccc(OC)c1 ZINC000155292401 1084194648 /nfs/dbraw/zinc/19/46/48/1084194648.db2.gz YAENZXMQNCDLHV-JTSKRJEESA-N 1 0 354.494 4.334 20 10 FICDRO CC[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccccc1O ZINC000157438322 1084383445 /nfs/dbraw/zinc/38/34/45/1084383445.db2.gz RRWOOAFQNHHREN-NRFANRHFSA-N 1 0 354.494 4.160 20 10 FICDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)COCc1ccccc1 ZINC000177951524 1084486220 /nfs/dbraw/zinc/48/62/20/1084486220.db2.gz HFIYFXLUKRKTHU-UXHICEINSA-N 1 0 368.521 4.027 20 10 FICDRO CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000236713602 1085339294 /nfs/dbraw/zinc/33/92/94/1085339294.db2.gz XMWHFSUVZKHVLX-JOCHJYFZSA-N 1 0 356.485 4.019 20 10 FICDRO O=C(C[N@@H+](CCCCO)C1CC1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000255547539 1085674675 /nfs/dbraw/zinc/67/46/75/1085674675.db2.gz ZSJOVEAXKQGHPL-UHFFFAOYSA-N 1 0 366.465 4.277 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(OC)c2OC)cc1 ZINC000164533304 1085851596 /nfs/dbraw/zinc/85/15/96/1085851596.db2.gz HTUPZDYSJPHAFG-OAHLLOKOSA-N 1 0 358.482 4.019 20 10 FICDRO CC(C)(C)c1csc(C[NH2+]Cc2cc(Br)ccc2O)n1 ZINC000105498415 1086561240 /nfs/dbraw/zinc/56/12/40/1086561240.db2.gz SULTXTGZNFTKEE-UHFFFAOYSA-N 1 0 355.301 4.199 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(OC)c(F)c3)CC2)cc1 ZINC000162283703 1087917947 /nfs/dbraw/zinc/91/79/47/1087917947.db2.gz XMLFOFOFVHWOQB-HNNXBMFYSA-N 1 0 358.457 4.163 20 10 FICDRO [O-]c1c(Cl)cccc1C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000311048147 1088160413 /nfs/dbraw/zinc/16/04/13/1088160413.db2.gz QDGYAOOCBXTVAT-SFHVURJKSA-N 1 0 358.913 4.438 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3cccc(C4CCC4)c3)c2)CC1 ZINC001269787195 1088635976 /nfs/dbraw/zinc/63/59/76/1088635976.db2.gz MFVUYTCGESZMTJ-UHFFFAOYSA-N 1 0 363.505 4.348 20 10 FICDRO CC(C)(C)OC(=O)Nc1ccsc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000892794366 1089081106 /nfs/dbraw/zinc/08/11/06/1089081106.db2.gz SOZDGIIUNFNTFA-UHFFFAOYSA-N 1 0 360.479 4.320 20 10 FICDRO COc1ccc2oc([C@H](C)[NH2+]Cc3ccc(OC)c(OC)c3O)c(C)c2c1 ZINC000892909680 1089279182 /nfs/dbraw/zinc/27/91/82/1089279182.db2.gz JDYLNYVTARFILL-ZDUSSCGKSA-N 1 0 371.433 4.323 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)c1O ZINC000378130635 1090140125 /nfs/dbraw/zinc/14/01/25/1090140125.db2.gz NIVAGXCVGYJJDN-UHFFFAOYSA-N 1 0 358.438 4.343 20 10 FICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(n3ccc(C(F)(F)F)n3)CC2)c1 ZINC000180278081 1090182612 /nfs/dbraw/zinc/18/26/12/1090182612.db2.gz DAHXWDVQEFRNBA-UHFFFAOYSA-N 1 0 353.388 4.061 20 10 FICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000122884292 1090217699 /nfs/dbraw/zinc/21/76/99/1090217699.db2.gz VSEVPPXQGVPPKX-HZPDHXFCSA-N 1 0 374.912 4.164 20 10 FICDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1 ZINC000180937885 1090244774 /nfs/dbraw/zinc/24/47/74/1090244774.db2.gz JARGEPDPPCEHKM-RCLKMUNOSA-N 1 0 366.461 4.124 20 10 FICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000181461601 1090280019 /nfs/dbraw/zinc/28/00/19/1090280019.db2.gz JCQAXEMWAXWKFK-HNNXBMFYSA-N 1 0 353.388 4.061 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(OCC(C)C)c(OC)c2)c1 ZINC000182461297 1090355616 /nfs/dbraw/zinc/35/56/16/1090355616.db2.gz BAOKRFHOGMUDIX-OAHLLOKOSA-N 1 0 359.466 4.295 20 10 FICDRO COc1ccc(C[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)cc1C ZINC000312204963 1090428229 /nfs/dbraw/zinc/42/82/29/1090428229.db2.gz BHMLQWJVAIHJEN-SFHVURJKSA-N 1 0 374.525 4.415 20 10 FICDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)cc1OC(F)F ZINC000185296395 1090531256 /nfs/dbraw/zinc/53/12/56/1090531256.db2.gz CTNFPWPIAQJZLC-ZDUSSCGKSA-N 1 0 351.393 4.204 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H]3CCO[C@H](c4ccccc4)C3)CC2)cc1 ZINC000364047480 1090723813 /nfs/dbraw/zinc/72/38/13/1090723813.db2.gz IRORGZYZDCHMJQ-REWPJTCUSA-N 1 0 366.505 4.174 20 10 FICDRO COc1ccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)c(O)c1OC ZINC000893305037 1090870523 /nfs/dbraw/zinc/87/05/23/1090870523.db2.gz QWVWZYGLJNAXHR-OAHLLOKOSA-N 1 0 363.841 4.066 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CCS[C@H]4CCCC[C@@H]43)cc2)CC1 ZINC000828025108 1091021592 /nfs/dbraw/zinc/02/15/92/1091021592.db2.gz DKSHYEYCVDBZQS-SFTDATJTSA-N 1 0 360.567 4.162 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311298387 1091301457 /nfs/dbraw/zinc/30/14/57/1091301457.db2.gz IGMGRAOYQLWIJG-IKGGRYGDSA-N 1 0 362.514 4.387 20 10 FICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(OC)c(OC)cc2O)cc1 ZINC000159519493 1093033886 /nfs/dbraw/zinc/03/38/86/1093033886.db2.gz WMTMNGYKNDTCTC-SFHVURJKSA-N 1 0 357.450 4.145 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000236958822 1093129001 /nfs/dbraw/zinc/12/90/01/1093129001.db2.gz ZFEOOWQCICWEAI-UHFFFAOYSA-N 1 0 367.537 4.300 20 10 FICDRO C[C@H]([NH2+]Cc1cc2c(cccc2O)s1)c1ccc(N2CCOCC2)cc1 ZINC000894208407 1093950529 /nfs/dbraw/zinc/95/05/29/1093950529.db2.gz HTSVWUWXUIXPCI-HNNXBMFYSA-N 1 0 368.502 4.294 20 10 FICDRO CN(C)C(=O)c1cccc(C[N@H+](Cc2ccccc2O)C2CCCCC2)c1 ZINC000729266412 1093954569 /nfs/dbraw/zinc/95/45/69/1093954569.db2.gz ADHKBKSROGBALK-UHFFFAOYSA-N 1 0 366.505 4.429 20 10 FICDRO CN1CCCc2cc(C[NH2+][C@H]3CN(Cc4ccccc4)C(C)(C)C3)ccc21 ZINC001648951410 1093971717 /nfs/dbraw/zinc/97/17/17/1093971717.db2.gz VHKXKSFRCXKULZ-JOCHJYFZSA-N 1 0 363.549 4.212 20 10 FICDRO CC[C@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1ccc(C)cc1O ZINC000280097395 1094293433 /nfs/dbraw/zinc/29/34/33/1094293433.db2.gz MVMREOFYNGHACP-FQEVSTJZSA-N 1 0 352.478 4.064 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCc3ccccc3C2)nc1)c1ccccc1O ZINC000272858279 1096218262 /nfs/dbraw/zinc/21/82/62/1096218262.db2.gz MKBSHOBBRGSISZ-KRWDZBQOSA-N 1 0 359.473 4.201 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CN2CCCC2=O)c2ccccc2)c(O)c1C ZINC000273362685 1096255309 /nfs/dbraw/zinc/25/53/09/1096255309.db2.gz DHNFEVFNYKDARX-XLIONFOSSA-N 1 0 352.478 4.023 20 10 FICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(Br)cc1O)c1ccco1 ZINC000273432565 1096261807 /nfs/dbraw/zinc/26/18/07/1096261807.db2.gz LJDLEKWDEQDLCC-RISCZKNCSA-N 1 0 354.244 4.176 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccc([S@@](C)=O)cc1 ZINC000273473371 1096265669 /nfs/dbraw/zinc/26/56/69/1096265669.db2.gz KCTMOSXRRJECOI-XSKAOVLVSA-N 1 0 357.519 4.420 20 10 FICDRO Cc1ccc(C(=O)N2CCC([NH2+][C@@H](C)c3ccc(C)c(C)c3O)CC2)cc1 ZINC000273566127 1096273805 /nfs/dbraw/zinc/27/38/05/1096273805.db2.gz JPIJQLLGKJNJMB-SFHVURJKSA-N 1 0 366.505 4.273 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccc2c(c1)CC(=O)N2C ZINC000273599653 1096278322 /nfs/dbraw/zinc/27/83/22/1096278322.db2.gz RQRLPDJKNZHLBW-HUUCEWRRSA-N 1 0 360.457 4.476 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCC(=O)NC(C)(C)C)cc1 ZINC000729685682 1098612231 /nfs/dbraw/zinc/61/22/31/1098612231.db2.gz JYBDSXYAEBQHOE-UHFFFAOYSA-N 1 0 367.537 4.108 20 10 FICDRO C[C@@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)c1ccc2ccccc2c1O ZINC000184967142 1101683205 /nfs/dbraw/zinc/68/32/05/1101683205.db2.gz PZUSFZYALQBPFO-OAHLLOKOSA-N 1 0 364.445 4.094 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)nc2-n2cc(Cl)cn2)c(O)c1 ZINC000191526469 1101947707 /nfs/dbraw/zinc/94/77/07/1101947707.db2.gz LDXLMPIDLBLNPI-CQSZACIVSA-N 1 0 356.857 4.094 20 10 FICDRO C[N@@H+](Cc1cc(F)c(F)cc1[O-])CC1CC[NH+](Cc2ccccc2)CC1 ZINC001142527177 1102157552 /nfs/dbraw/zinc/15/75/52/1102157552.db2.gz NDNWKZUKOVCHQR-UHFFFAOYSA-N 1 0 360.448 4.014 20 10 FICDRO C[C@H](CC[NH2+][C@H](C)c1cc(Br)cc(F)c1[O-])[NH+]1CCCCC1 ZINC000757659034 1102821522 /nfs/dbraw/zinc/82/15/22/1102821522.db2.gz VCTLVDRRLKSXRF-CHWSQXEVSA-N 1 0 373.310 4.209 20 10 FICDRO Cc1cc(C[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1F ZINC000729680047 1103043234 /nfs/dbraw/zinc/04/32/34/1103043234.db2.gz XEUCVFQQXPTQOH-UHFFFAOYSA-N 1 0 364.411 4.494 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(CO)C[C@@H]1c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000760039983 1105016174 /nfs/dbraw/zinc/01/61/74/1105016174.db2.gz HRBXQSOOFSWUQW-FSSWDIPSSA-N 1 0 356.485 4.099 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(CO)C[C@@H]1c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000760042077 1105056010 /nfs/dbraw/zinc/05/60/10/1105056010.db2.gz RNUIVTAGGDFOFC-HBFSDRIKSA-N 1 0 363.860 4.392 20 10 FICDRO COc1ccc(C[NH+]2CCC3(CC2)c2ccccc2N=C3C)c(O)c1OC ZINC000895135312 1105293490 /nfs/dbraw/zinc/29/34/90/1105293490.db2.gz IVBGEKSMMRKYSC-UHFFFAOYSA-N 1 0 366.461 4.049 20 10 FICDRO CCN1CC[C@H]([NH2+]Cc2cccc(C)c2O)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000783595080 1107676740 /nfs/dbraw/zinc/67/67/40/1107676740.db2.gz MJHSMZDTAJZBGW-PKOBYXMFSA-N 1 0 364.411 4.043 20 10 FICDRO CSc1cc(Br)ccc1C[NH2+]CCc1ccc(N)cc1 ZINC000841036560 1109152826 /nfs/dbraw/zinc/15/28/26/1109152826.db2.gz VHRMOSCAYNIQFT-UHFFFAOYSA-N 1 0 351.313 4.086 20 10 FICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]Cc2ccc3cn(C)nc3c2)c1O ZINC000527961451 1109875602 /nfs/dbraw/zinc/87/56/02/1109875602.db2.gz HLCMGKPEUJOJSR-GFCCVEGCSA-N 1 0 374.282 4.201 20 10 FICDRO CC[C@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1O ZINC000527997145 1109881137 /nfs/dbraw/zinc/88/11/37/1109881137.db2.gz HELDOWIALWTYKN-HOCLYGCPSA-N 1 0 364.367 4.015 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Br)c(F)c2F)c1 ZINC000527987561 1109887226 /nfs/dbraw/zinc/88/72/26/1109887226.db2.gz PMRXKORRARIYFG-VIFPVBQESA-N 1 0 372.209 4.292 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)c1O ZINC000237499552 1111691209 /nfs/dbraw/zinc/69/12/09/1111691209.db2.gz GGBWMJKXMXSWQA-UHFFFAOYSA-N 1 0 359.429 4.030 20 10 FICDRO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000155314857 1113554497 /nfs/dbraw/zinc/55/44/97/1113554497.db2.gz VZQMAENKDGYEIC-ROUUACIJSA-N 1 0 354.494 4.334 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1N(C)C ZINC000163622383 1114241473 /nfs/dbraw/zinc/24/14/73/1114241473.db2.gz XPOMAVGPSXRIIA-MRXNPFEDSA-N 1 0 373.541 4.296 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCCc3c[nH]c4ccccc34)CC2)cc1 ZINC000156338943 1114417353 /nfs/dbraw/zinc/41/73/53/1114417353.db2.gz XRTBWSRNUMQPQF-UHFFFAOYSA-N 1 0 363.505 4.368 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@H](c3cccnc3)C(C)C)CC2)cc1 ZINC000164157111 1114442912 /nfs/dbraw/zinc/44/29/12/1114442912.db2.gz RUSLNEISLFOJPC-QFIPXVFZSA-N 1 0 353.510 4.088 20 10 FICDRO Cc1cc(-c2nnc(C[N@H+](Cc3ccc(N(C)C)cc3)C(C)C)o2)c(C)o1 ZINC000760816756 1115046155 /nfs/dbraw/zinc/04/61/55/1115046155.db2.gz IVGFNQRYHSGNOQ-UHFFFAOYSA-N 1 0 368.481 4.423 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(OC)cc3F)CC2)cc1 ZINC000157356749 1115095575 /nfs/dbraw/zinc/09/55/75/1115095575.db2.gz PGDLZAFKLMBXTB-HNNXBMFYSA-N 1 0 358.457 4.163 20 10 FICDRO CC[C@@H](Nc1cccc(N2CC[NH+](C(C)C)CC2)c1)c1ccccc1O ZINC000157483248 1115143338 /nfs/dbraw/zinc/14/33/38/1115143338.db2.gz JKHBJGGNSSABSF-OAQYLSRUSA-N 1 0 353.510 4.486 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+]CCCOc2ccccc2)ccc1N1CCCCC1 ZINC000760984845 1115246879 /nfs/dbraw/zinc/24/68/79/1115246879.db2.gz OHJDRJWNJFCDRA-UHFFFAOYSA-N 1 0 369.465 4.144 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000226036691 1115272248 /nfs/dbraw/zinc/27/22/48/1115272248.db2.gz CAJVROQVBNNRSP-CQSZACIVSA-N 1 0 350.281 4.481 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc(Br)cc2)c1O ZINC000228672484 1115706578 /nfs/dbraw/zinc/70/65/78/1115706578.db2.gz LCVHKVQUZZSTEB-UHFFFAOYSA-N 1 0 356.647 4.107 20 10 FICDRO CN(Cc1cscn1)Cc1c(O)ccc2cc(Br)ccc21 ZINC000063127387 1116013628 /nfs/dbraw/zinc/01/36/28/1116013628.db2.gz BUEHJUHMNJFICZ-UHFFFAOYSA-N 1 0 363.280 4.396 20 10 FICDRO C[NH+]1CCC(N2C(=O)/C(=C/c3cccc4ccccc34)SC2=S)CC1 ZINC000063823948 1116114995 /nfs/dbraw/zinc/11/49/95/1116114995.db2.gz AFQTWZUWPIVMMA-AQTBWJFISA-N 1 0 368.527 4.135 20 10 FICDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc1 ZINC000151516884 1116278668 /nfs/dbraw/zinc/27/86/68/1116278668.db2.gz ZFLODTMAPLICFT-INIZCTEOSA-N 1 0 356.485 4.200 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000151560231 1118500217 /nfs/dbraw/zinc/50/02/17/1118500217.db2.gz ODYKISZGKKEGNH-XMMPIXPASA-N 1 0 364.533 4.006 20 10 FICDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1C ZINC000151564410 1118532899 /nfs/dbraw/zinc/53/28/99/1118532899.db2.gz UDOYOPHZAZLIDA-IBGZPJMESA-N 1 0 352.522 4.363 20 10 FICDRO CC(C)COc1cccc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000152506298 1119432320 /nfs/dbraw/zinc/43/23/20/1119432320.db2.gz OLPYAYAVKFXGOW-IBGZPJMESA-N 1 0 368.521 4.409 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3occc32)ccc1N1CCCCC1 ZINC000915228532 1120884392 /nfs/dbraw/zinc/88/43/92/1120884392.db2.gz CMXIZZCUJOGUHH-KRWDZBQOSA-N 1 0 355.438 4.345 20 10 FICDRO Cc1cccc(C[NH2+]C(C)(C)[C@H](O)c2ccc(Br)cc2)c1O ZINC000762787996 1120962635 /nfs/dbraw/zinc/96/26/35/1120962635.db2.gz RVNUOTWHSHQUBS-QGZVFWFLSA-N 1 0 364.283 4.065 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3cc(Cl)cc4c3OCC4)CC2)cc1 ZINC001649029331 1121366519 /nfs/dbraw/zinc/36/65/19/1121366519.db2.gz SPDYSOFSZRBREK-UHFFFAOYSA-N 1 0 372.896 4.042 20 10 FICDRO COc1ccc([C@@H]2C[C@H]([NH2+]Cc3ccc(N4CCCC4)cc3)CCO2)cc1 ZINC001168586297 1121535689 /nfs/dbraw/zinc/53/56/89/1121535689.db2.gz SNNLTBCVXRGMBQ-OFNKIYASSA-N 1 0 366.505 4.305 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@@H](C)Cn2cccn2)cc1 ZINC000916839284 1121882499 /nfs/dbraw/zinc/88/24/99/1121882499.db2.gz WWLOYFXJSQEEOI-HXUWFJFHSA-N 1 0 362.521 4.336 20 10 FICDRO COc1ccccc1OCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000917020498 1122007020 /nfs/dbraw/zinc/00/70/20/1122007020.db2.gz QCLSDNAWRHIJAY-UHFFFAOYSA-N 1 0 354.494 4.196 20 10 FICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000917019867 1122007446 /nfs/dbraw/zinc/00/74/46/1122007446.db2.gz JLZYZCHUYMFBIT-UHFFFAOYSA-N 1 0 357.454 4.082 20 10 FICDRO C[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765800052 1122021302 /nfs/dbraw/zinc/02/13/02/1122021302.db2.gz MIQZZIHHGRSFSL-FXAWDEMLSA-N 1 0 356.485 4.070 20 10 FICDRO COc1ccc(O)c([C@@H](C)Nc2cccc(C[NH+]3CCSCC3)c2)c1 ZINC000186342985 1122039934 /nfs/dbraw/zinc/03/99/34/1122039934.db2.gz FNRYTYKEUYZJKU-OAHLLOKOSA-N 1 0 358.507 4.123 20 10 FICDRO Cc1ccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)c1 ZINC000917075413 1122070177 /nfs/dbraw/zinc/07/01/77/1122070177.db2.gz VLZKVDKIMVRLTN-UHFFFAOYSA-N 1 0 353.510 4.219 20 10 FICDRO CC(C)c1ccc(OC2CC[NH+](Cc3cc4c(cc3O)OCO4)CC2)cc1 ZINC000917468311 1122328214 /nfs/dbraw/zinc/32/82/14/1122328214.db2.gz STZDMJKHJILOLU-UHFFFAOYSA-N 1 0 369.461 4.288 20 10 FICDRO C[C@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000918748899 1122772736 /nfs/dbraw/zinc/77/27/36/1122772736.db2.gz DKXWIIPWIQXVIN-OAHLLOKOSA-N 1 0 359.495 4.367 20 10 FICDRO CC(C)(C)OC(=O)NC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000154854971 1122836655 /nfs/dbraw/zinc/83/66/55/1122836655.db2.gz BRXWCCQYCDQUAH-UHFFFAOYSA-N 1 0 373.541 4.166 20 10 FICDRO COC(=O)c1cc2ccccc2c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000919952470 1123280480 /nfs/dbraw/zinc/28/04/80/1123280480.db2.gz WCJMKANUIDTWOV-FQEVSTJZSA-N 1 0 362.429 4.064 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)n1-c1cccc(Cl)c1 ZINC000919981873 1123299034 /nfs/dbraw/zinc/29/90/34/1123299034.db2.gz AWDHVLSWCOANPN-PMACEKPBSA-N 1 0 371.912 4.104 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000155187122 1123351015 /nfs/dbraw/zinc/35/10/15/1123351015.db2.gz BURODCRJHJUVNP-ZDUSSCGKSA-N 1 0 366.839 4.306 20 10 FICDRO c1ccc([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000920183787 1123399537 /nfs/dbraw/zinc/39/95/37/1123399537.db2.gz XPWVKQFLPMPPQQ-PKTZIBPZSA-N 1 0 350.506 4.339 20 10 FICDRO COc1cc(O)c(C[N@H+](Cc2ccco2)Cc2ccccc2)cc1OC ZINC000179582637 1124008056 /nfs/dbraw/zinc/00/80/56/1124008056.db2.gz ZFFSAHBCPUPSOO-UHFFFAOYSA-N 1 0 353.418 4.205 20 10 FICDRO O=C(c1ccccc1)C1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000179877682 1124129106 /nfs/dbraw/zinc/12/91/06/1124129106.db2.gz ZFPUZUPZGWRYDI-UHFFFAOYSA-N 1 0 374.278 4.250 20 10 FICDRO Cn1c2ccccc2nc1CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000237848944 1124132484 /nfs/dbraw/zinc/13/24/84/1124132484.db2.gz ONHQPBRCMUZOEP-UHFFFAOYSA-N 1 0 362.521 4.286 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1F ZINC000180215032 1124265836 /nfs/dbraw/zinc/26/58/36/1124265836.db2.gz AHMMZKACLDQYRJ-JOCHJYFZSA-N 1 0 356.485 4.275 20 10 FICDRO CC1CCN(c2ccc(C[NH2+]C3CCC(O)(C(F)(F)F)CC3)cc2)CC1 ZINC000765874310 1124304158 /nfs/dbraw/zinc/30/41/58/1124304158.db2.gz PZBMAOHDUHTIOB-UHFFFAOYSA-N 1 0 370.459 4.249 20 10 FICDRO CC[N@H+](CCCC1CCOCC1)Cc1cc(Br)ccc1O ZINC000765920169 1124597019 /nfs/dbraw/zinc/59/70/19/1124597019.db2.gz LDWATKDRFDWPQS-UHFFFAOYSA-N 1 0 356.304 4.183 20 10 FICDRO CCN(CC)C(=O)C1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000120231965 1079840289 /nfs/dbraw/zinc/84/02/89/1079840289.db2.gz GABHWCLFLORLKE-UHFFFAOYSA-N 1 0 360.542 4.079 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(C(=O)NC3CCCCC3)CC2)cc1C(C)C ZINC000748084566 1080194975 /nfs/dbraw/zinc/19/49/75/1080194975.db2.gz QZZXDNWXMRAOLO-UHFFFAOYSA-N 1 0 372.553 4.485 20 10 FICDRO Cc1nnc([C@H](C)N[C@@H](C)c2cc(Br)cc(C)c2O)s1 ZINC000275324117 1080766063 /nfs/dbraw/zinc/76/60/63/1080766063.db2.gz LLVORQDPUQHWOZ-IUCAKERBSA-N 1 0 356.289 4.035 20 10 FICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]Cc2cn3ccsc3n2)c1O ZINC000275362271 1080832907 /nfs/dbraw/zinc/83/29/07/1080832907.db2.gz SZRDQQNKTFAUER-SNVBAGLBSA-N 1 0 366.284 4.023 20 10 FICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc(OC(F)F)c1 ZINC001648799457 1080906043 /nfs/dbraw/zinc/90/60/43/1080906043.db2.gz NUZOBKSKQLMTOT-NSHDSACASA-N 1 0 356.363 4.483 20 10 FICDRO CN(Cc1cccs1)c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC001648819242 1081244360 /nfs/dbraw/zinc/24/43/60/1081244360.db2.gz UFKYLXPWXKJDTB-LEWJYISDSA-N 1 0 355.551 4.101 20 10 FICDRO CN(Cc1cccs1)c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC001648819243 1081244955 /nfs/dbraw/zinc/24/49/55/1081244955.db2.gz UFKYLXPWXKJDTB-NHCUHLMSSA-N 1 0 355.551 4.101 20 10 FICDRO Cc1ccc(F)cc1C[NH2+]Cc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1 ZINC001648835237 1081276674 /nfs/dbraw/zinc/27/66/74/1081276674.db2.gz FKHBZTQMQFHBJX-IYBDPMFKSA-N 1 0 360.448 4.177 20 10 FICDRO CCN(C)c1ccc(C[NH+]2CCN([C@@H](C)c3cccc(OC)c3)CC2)cc1 ZINC001167360840 1081721230 /nfs/dbraw/zinc/72/12/30/1081721230.db2.gz SCQTVDDPXPKORH-IBGZPJMESA-N 1 0 367.537 4.030 20 10 FICDRO CC(C)c1cnc(C(C)C)c(NCc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC001167427146 1082056254 /nfs/dbraw/zinc/05/62/54/1082056254.db2.gz ZWVJBDNQEKYHNZ-UHFFFAOYSA-N 1 0 367.541 4.087 20 10 FICDRO CNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000155833785 1082110901 /nfs/dbraw/zinc/11/09/01/1082110901.db2.gz XYDIXGDKKLQRLB-INIZCTEOSA-N 1 0 369.484 4.026 20 10 FICDRO COc1cccc(C[NH+]2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1O ZINC000179345633 1083389476 /nfs/dbraw/zinc/38/94/76/1083389476.db2.gz JIXREOHDFIZZKD-UHFFFAOYSA-N 1 0 359.853 4.149 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1O ZINC000278790811 1083714271 /nfs/dbraw/zinc/71/42/71/1083714271.db2.gz QPKFZVNAUYXKEF-UHFFFAOYSA-N 1 0 370.327 4.008 20 10 FICDRO CC[C@H]([NH2+][C@H](Cc1nc(C)no1)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000277028509 1083723718 /nfs/dbraw/zinc/72/37/18/1083723718.db2.gz FAUVPNDKWLTRBR-LEWJYISDSA-N 1 0 364.493 4.469 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](Cc2nc(C)no2)c2ccccc2)cc1 ZINC000277046579 1083727554 /nfs/dbraw/zinc/72/75/54/1083727554.db2.gz GQCPSYVEVHKVMQ-IIBYNOLFSA-N 1 0 364.493 4.469 20 10 FICDRO C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000178089991 1084668842 /nfs/dbraw/zinc/66/88/42/1084668842.db2.gz UFDVYDCRTSVANT-XOBRGWDASA-N 1 0 358.432 4.140 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(OC)c1O)c1ccccc1OC(F)F ZINC000892561718 1084837579 /nfs/dbraw/zinc/83/75/79/1084837579.db2.gz RQGFZZLRQJMHJI-CQSZACIVSA-N 1 0 367.392 4.252 20 10 FICDRO COCC1=CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000588513415 1084885727 /nfs/dbraw/zinc/88/57/27/1084885727.db2.gz LRIAFFHQFMLBIN-UHFFFAOYSA-N 1 0 364.449 4.319 20 10 FICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC001167567734 1084918487 /nfs/dbraw/zinc/91/84/87/1084918487.db2.gz JNBRXFQTUKNWPL-HSZRJFAPSA-N 1 0 352.522 4.366 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000159056685 1085087335 /nfs/dbraw/zinc/08/73/35/1085087335.db2.gz XQCKTOPRJWLSIM-HOTGVXAUSA-N 1 0 366.509 4.448 20 10 FICDRO COC1CCN(c2ccc(C[N@H+](CCC(F)(F)F)CC3CC3)cc2)CC1 ZINC000828020001 1085209255 /nfs/dbraw/zinc/20/92/55/1085209255.db2.gz CPDBKSCGOZLQKT-UHFFFAOYSA-N 1 0 370.459 4.466 20 10 FICDRO COc1ccccc1[C@@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178444215 1085781167 /nfs/dbraw/zinc/78/11/67/1085781167.db2.gz IEYIVQBPCKCQHH-KKSFZXQISA-N 1 0 372.484 4.209 20 10 FICDRO COCc1ccccc1C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000122036024 1086119418 /nfs/dbraw/zinc/11/94/18/1086119418.db2.gz BHOYMXUFNGNSCK-INIZCTEOSA-N 1 0 374.912 4.174 20 10 FICDRO CC[NH+](CC)Cc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 ZINC000106158632 1086583862 /nfs/dbraw/zinc/58/38/62/1086583862.db2.gz FNFYBDFYZLBBOX-UHFFFAOYSA-N 1 0 365.521 4.059 20 10 FICDRO Clc1ccc(C2([NH2+]Cc3ccc(N4CCOCC4)cc3)CCC2)cc1 ZINC000125973000 1086756698 /nfs/dbraw/zinc/75/66/98/1086756698.db2.gz AUCGVXYLKKCTPK-UHFFFAOYSA-N 1 0 356.897 4.346 20 10 FICDRO CCOCc1cc(C[NH2+]CCc2c[nH]c3cccc(C)c23)ccc1OC ZINC000728592911 1087521601 /nfs/dbraw/zinc/52/16/01/1087521601.db2.gz COXRGLJSOXHQBX-UHFFFAOYSA-N 1 0 352.478 4.354 20 10 FICDRO Cc1cc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc(OC(F)(F)F)c1 ZINC001143472611 1087939441 /nfs/dbraw/zinc/93/94/41/1087939441.db2.gz RRWCCRDNTFQUKY-UHFFFAOYSA-N 1 0 367.367 4.253 20 10 FICDRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cc(OC)ccc2O)cc1OC ZINC000180896076 1088155228 /nfs/dbraw/zinc/15/52/28/1088155228.db2.gz YXAIFOHNQVEWFU-OAHLLOKOSA-N 1 0 359.466 4.439 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2CCN(Cc3ccccc3)CC2)cc1 ZINC000010315383 1088900108 /nfs/dbraw/zinc/90/01/08/1088900108.db2.gz PAPGOBSMTCIEOJ-UHFFFAOYSA-N 1 0 351.538 4.287 20 10 FICDRO Cc1occc1C(=O)NC1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000066795760 1089625291 /nfs/dbraw/zinc/62/52/91/1089625291.db2.gz BPKTZBQBVTWHMC-UHFFFAOYSA-N 1 0 370.493 4.120 20 10 FICDRO COc1cc(O)c(CN(C)Cc2c(Cl)cccc2Cl)c(OC)c1 ZINC001141028141 1089838284 /nfs/dbraw/zinc/83/82/84/1089838284.db2.gz CJUFTWJOJQTAQD-UHFFFAOYSA-N 1 0 356.249 4.348 20 10 FICDRO Cc1nc([C@@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 ZINC000378203732 1090222887 /nfs/dbraw/zinc/22/28/87/1090222887.db2.gz RZSDYMWSFMMCCC-GFCCVEGCSA-N 1 0 367.465 4.373 20 10 FICDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000122883678 1090223437 /nfs/dbraw/zinc/22/34/37/1090223437.db2.gz VSEVPPXQGVPPKX-HOTGVXAUSA-N 1 0 374.912 4.164 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c1O ZINC000181891372 1090315631 /nfs/dbraw/zinc/31/56/31/1090315631.db2.gz DTAHNHRENJKAHG-AWEZNQCLSA-N 1 0 356.441 4.185 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)c1O ZINC000181910725 1090316434 /nfs/dbraw/zinc/31/64/34/1090316434.db2.gz LHUMGZLZXXDNJP-SNVBAGLBSA-N 1 0 371.330 4.483 20 10 FICDRO C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)c1nccs1 ZINC000378394140 1090340731 /nfs/dbraw/zinc/34/07/31/1090340731.db2.gz JLNFWMUYESLMLE-LBPRGKRZSA-N 1 0 353.438 4.064 20 10 FICDRO CCN(C)c1ccc([C@H](C)Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000182637525 1090365183 /nfs/dbraw/zinc/36/51/83/1090365183.db2.gz VWUNXZGIAKVWRU-SFHVURJKSA-N 1 0 352.526 4.068 20 10 FICDRO CC[C@@H](Nc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(N(C)C)cc1 ZINC000182632885 1090365351 /nfs/dbraw/zinc/36/53/51/1090365351.db2.gz PZNHUHVFNWPBPP-JOCHJYFZSA-N 1 0 352.526 4.068 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000185401900 1090540162 /nfs/dbraw/zinc/54/01/62/1090540162.db2.gz FPVXNBIHJNHOBP-KRWDZBQOSA-N 1 0 354.494 4.488 20 10 FICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000162358760 1090739986 /nfs/dbraw/zinc/73/99/86/1090739986.db2.gz LYKNEYCBTGUIGJ-MSOLQXFVSA-N 1 0 354.494 4.252 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc(N(C)C)cc1 ZINC000162428056 1090914167 /nfs/dbraw/zinc/91/41/67/1090914167.db2.gz ZQIDHJXOGHTTAF-OAQYLSRUSA-N 1 0 352.526 4.379 20 10 FICDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)c1cc(Br)ccc1O ZINC000756608345 1091370259 /nfs/dbraw/zinc/37/02/59/1091370259.db2.gz ALUADSUNQINBKX-SPGJAERMSA-N 1 0 354.288 4.009 20 10 FICDRO COC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1O)c1ccc(Cl)cc1 ZINC000194549388 1091391542 /nfs/dbraw/zinc/39/15/42/1091391542.db2.gz CSRMNRDGJISKKM-OAHLLOKOSA-N 1 0 356.249 4.185 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(c3nc(-c4ccccc4)no3)CC2)cc1C ZINC000728906794 1091944052 /nfs/dbraw/zinc/94/40/52/1091944052.db2.gz HFQOCNYCAMQBOX-UHFFFAOYSA-N 1 0 363.461 4.439 20 10 FICDRO C[C@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)c1nnc2n1CCC2 ZINC000237562396 1092509515 /nfs/dbraw/zinc/50/95/15/1092509515.db2.gz PNFQCVDFHCCODS-AWEZNQCLSA-N 1 0 370.541 4.376 20 10 FICDRO COC1(C[C@H](C)[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 ZINC000759989061 1093082287 /nfs/dbraw/zinc/08/22/87/1093082287.db2.gz OXXFUUTXEIHSRI-HNNXBMFYSA-N 1 0 368.468 4.194 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ccccc2CO)cc1 ZINC000236966709 1093238225 /nfs/dbraw/zinc/23/82/25/1093238225.db2.gz KJPAHRRXBHWEQA-UHFFFAOYSA-N 1 0 360.501 4.495 20 10 FICDRO C[C@@H]([NH2+]Cc1cc2c(cccc2O)s1)c1ccc(N2CCOCC2)cc1 ZINC000894208413 1093950928 /nfs/dbraw/zinc/95/09/28/1093950928.db2.gz HTSVWUWXUIXPCI-OAHLLOKOSA-N 1 0 368.502 4.294 20 10 FICDRO CC(C)[C@@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)[NH+]1CCCCC1 ZINC000729305535 1093959297 /nfs/dbraw/zinc/95/92/97/1093959297.db2.gz NWOYETFTAKRVOA-QFIPXVFZSA-N 1 0 371.569 4.146 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOC2=O)cc1)c1ccc(C)cc1O ZINC000279973847 1093980760 /nfs/dbraw/zinc/98/07/60/1093980760.db2.gz DDXZVZUGWROOLS-HNAYVOBHSA-N 1 0 354.450 4.459 20 10 FICDRO CN(C)c1ccc(C[NH2+]CCCOc2ccc(F)cc2)c(C(F)(F)F)c1 ZINC001648951508 1093990688 /nfs/dbraw/zinc/99/06/88/1093990688.db2.gz XDNJDPGEIBJCMT-UHFFFAOYSA-N 1 0 370.390 4.469 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 ZINC000710382202 1094771976 /nfs/dbraw/zinc/77/19/76/1094771976.db2.gz MALIULWPXUJDPV-KRWDZBQOSA-N 1 0 362.514 4.216 20 10 FICDRO Cc1cc(C)cc(C(=O)Nc2cccc(N3CC[NH+](CC4CC4)CC3)c2)c1 ZINC000108900126 1095730501 /nfs/dbraw/zinc/73/05/01/1095730501.db2.gz DACCGMNBBOOUBH-UHFFFAOYSA-N 1 0 363.505 4.088 20 10 FICDRO CCOCc1cc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1OC ZINC000273361607 1096255753 /nfs/dbraw/zinc/25/57/53/1096255753.db2.gz CRWRFBXQUKMIQX-UNMCSNQZSA-N 1 0 373.468 4.381 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOC3=O)cc2)c(O)c1C ZINC000273386022 1096258022 /nfs/dbraw/zinc/25/80/22/1096258022.db2.gz JMTFKLHCWNQNJB-JKSUJKDBSA-N 1 0 354.450 4.377 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3F)CC2)c(O)c1C ZINC000273405951 1096259940 /nfs/dbraw/zinc/25/99/40/1096259940.db2.gz OMDJBTHWNKIXRN-MRXNPFEDSA-N 1 0 370.468 4.104 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000185675738 1101742490 /nfs/dbraw/zinc/74/24/90/1101742490.db2.gz DLHOSCVDAIMRPQ-HUUCEWRRSA-N 1 0 351.450 4.307 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000760326405 1101916352 /nfs/dbraw/zinc/91/63/52/1101916352.db2.gz OTALVZDELPKLEO-QGZVFWFLSA-N 1 0 363.274 4.431 20 10 FICDRO [O-]c1cc(F)c(F)cc1C[N@H+]1C[C@H]2c3ccccc3[C@H](OCC3CC3)[C@H]2C1 ZINC001142520186 1102137754 /nfs/dbraw/zinc/13/77/54/1102137754.db2.gz CXWVOKZCJCMTCS-SPEDKVCISA-N 1 0 371.427 4.367 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 ZINC000127538121 1102731042 /nfs/dbraw/zinc/73/10/42/1102731042.db2.gz YTDMMBFIKFLLSL-QUCCMNQESA-N 1 0 358.526 4.056 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(CO)C[C@H]1c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000760039978 1105015863 /nfs/dbraw/zinc/01/58/63/1105015863.db2.gz HRBXQSOOFSWUQW-FDFHNCONSA-N 1 0 356.485 4.099 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2coc3ccccc23)SC1=S ZINC000178983863 1105057650 /nfs/dbraw/zinc/05/76/50/1105057650.db2.gz UFZOWDZPEPQHQL-CXUHLZMHSA-N 1 0 374.531 4.222 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN([C@@H](C)c3ccc(F)cc3F)CC2)cc1C ZINC000728908598 1110125169 /nfs/dbraw/zinc/12/51/69/1110125169.db2.gz HAIVOWKBBZHCCB-INIZCTEOSA-N 1 0 360.448 4.166 20 10 FICDRO CC(=O)N1CC[C@@H]([NH2+]Cc2c(C)c3ccccc3n2C)c2ccccc2C1 ZINC000479466213 1112042328 /nfs/dbraw/zinc/04/23/28/1112042328.db2.gz ZEUCSVDQATUQAN-OAQYLSRUSA-N 1 0 361.489 4.070 20 10 FICDRO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CCC(O)CC1)c1ccccc1O ZINC000155828096 1113887386 /nfs/dbraw/zinc/88/73/86/1113887386.db2.gz RGNZFTRHEMMISN-QRWLVFNGSA-N 1 0 372.484 4.294 20 10 FICDRO Cc1cccc(N2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)c1 ZINC000028788126 1114060833 /nfs/dbraw/zinc/06/08/33/1114060833.db2.gz URZVMAFAGKFERL-UHFFFAOYSA-N 1 0 354.494 4.026 20 10 FICDRO c1ccc2c(c1)CCSC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163624006 1114243142 /nfs/dbraw/zinc/24/31/42/1114243142.db2.gz KZOOVEJZQCUWKZ-OAQYLSRUSA-N 1 0 370.587 4.360 20 10 FICDRO CCOc1ncccc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000151178848 1114308789 /nfs/dbraw/zinc/30/87/89/1114308789.db2.gz BCMOAQNKOXUACA-MRXNPFEDSA-N 1 0 357.473 4.461 20 10 FICDRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000237535819 1114637484 /nfs/dbraw/zinc/63/74/84/1114637484.db2.gz MEYWTAAXSWLGSI-LBPRGKRZSA-N 1 0 368.458 4.404 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1C ZINC000057104721 1114875781 /nfs/dbraw/zinc/87/57/81/1114875781.db2.gz BJWHSHWYCWDOSM-UHFFFAOYSA-N 1 0 372.896 4.011 20 10 FICDRO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000166041201 1114926665 /nfs/dbraw/zinc/92/66/65/1114926665.db2.gz NITKEMNUQRNVPL-QGZVFWFLSA-N 1 0 359.558 4.221 20 10 FICDRO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000166041080 1114926904 /nfs/dbraw/zinc/92/69/04/1114926904.db2.gz NITKEMNUQRNVPL-KRWDZBQOSA-N 1 0 359.558 4.221 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(OC)cc3F)CC2)cc1 ZINC000157356905 1115095308 /nfs/dbraw/zinc/09/53/08/1115095308.db2.gz PGDLZAFKLMBXTB-OAHLLOKOSA-N 1 0 358.457 4.163 20 10 FICDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC001649010139 1115225070 /nfs/dbraw/zinc/22/50/70/1115225070.db2.gz PQTSCRDEKLVYMT-UHFFFAOYSA-N 1 0 350.374 4.080 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)cc1 ZINC000157677548 1115229101 /nfs/dbraw/zinc/22/91/01/1115229101.db2.gz XMWZILYVBNMIGO-KKSFZXQISA-N 1 0 372.484 4.473 20 10 FICDRO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cc(Cl)cc(C(C)=O)c1O ZINC001168414836 1115795110 /nfs/dbraw/zinc/79/51/10/1115795110.db2.gz UNCAWFGEQBXMJK-SFHVURJKSA-N 1 0 361.869 4.021 20 10 FICDRO CC[C@H]([NH2+]CCc1nc(C)cs1)c1cc(Br)ccc1O ZINC000063132526 1116011473 /nfs/dbraw/zinc/01/14/73/1116011473.db2.gz AZRAGFNICVKSOR-ZDUSSCGKSA-N 1 0 355.301 4.203 20 10 FICDRO CC[C@@](C)([NH2+]Cc1cc(Br)ccc1O)c1nc(C)cs1 ZINC000174503679 1116139717 /nfs/dbraw/zinc/13/97/17/1116139717.db2.gz ITZKIFIGHZHSJW-OAHLLOKOSA-N 1 0 355.301 4.335 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cccc(OC)c1 ZINC000151564694 1118535887 /nfs/dbraw/zinc/53/58/87/1118535887.db2.gz KGHAKVKGWFXQLN-HSZRJFAPSA-N 1 0 368.521 4.145 20 10 FICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c1 ZINC000152350485 1119217630 /nfs/dbraw/zinc/21/76/30/1119217630.db2.gz KEWBKYHPISOTST-UHFFFAOYSA-N 1 0 364.420 4.382 20 10 FICDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N2CCOCC2)cc1Cl ZINC000130314248 1120309712 /nfs/dbraw/zinc/30/97/12/1120309712.db2.gz SGBGPQKWUQBNET-XOBRGWDASA-N 1 0 372.896 4.220 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCc3occc32)ccc1N1CCCCC1 ZINC000915228533 1120883796 /nfs/dbraw/zinc/88/37/96/1120883796.db2.gz CMXIZZCUJOGUHH-QGZVFWFLSA-N 1 0 355.438 4.345 20 10 FICDRO C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1cc(Cl)ccc1O ZINC000762641296 1120942587 /nfs/dbraw/zinc/94/25/87/1120942587.db2.gz HAXYQOQHXOWMBY-XEZPLFJOSA-N 1 0 368.905 4.342 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000153701617 1121038519 /nfs/dbraw/zinc/03/85/19/1121038519.db2.gz DKNZNOPTSKOPGL-OAHLLOKOSA-N 1 0 352.457 4.237 20 10 FICDRO C[C@H]([NH2+]Cc1cccnc1OCC(F)F)c1cc2c(cc1O)CCCC2 ZINC000186199302 1121642692 /nfs/dbraw/zinc/64/26/92/1121642692.db2.gz HKKOVPTWGLPTHU-ZDUSSCGKSA-N 1 0 362.420 4.161 20 10 FICDRO CC[NH+]1CCN(c2ccc(N[C@H](C)c3cc(OC)ccc3O)c(C)c2)CC1 ZINC000186237251 1121976245 /nfs/dbraw/zinc/97/62/45/1121976245.db2.gz VXTILIWYJLRVOS-QGZVFWFLSA-N 1 0 369.509 4.024 20 10 FICDRO C[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765800058 1122021287 /nfs/dbraw/zinc/02/12/87/1122021287.db2.gz MIQZZIHHGRSFSL-XLIONFOSSA-N 1 0 356.485 4.070 20 10 FICDRO COc1ccc(N2CCC[N@H+](CCSc3ccccc3F)CC2)cc1 ZINC000917088512 1122100175 /nfs/dbraw/zinc/10/01/75/1122100175.db2.gz ZXUMZWMVYPADDN-UHFFFAOYSA-N 1 0 360.498 4.139 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1C(C)C ZINC000917456885 1122321608 /nfs/dbraw/zinc/32/16/08/1122321608.db2.gz NDQQHSDVJCUSCM-UHFFFAOYSA-N 1 0 369.465 4.054 20 10 FICDRO C[N@H+](CCCOc1ccc(Cl)cc1)Cc1c(O)ccc2ccncc21 ZINC000917487161 1122332726 /nfs/dbraw/zinc/33/27/26/1122332726.db2.gz SRGTZZRDPZQMPF-UHFFFAOYSA-N 1 0 356.853 4.495 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583088 1122713759 /nfs/dbraw/zinc/71/37/59/1122713759.db2.gz VCDDJEBSDMJSOH-UXHICEINSA-N 1 0 371.912 4.104 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCCC[C@H]23)c(C)n1-c1ccc(Cl)cc1 ZINC000918583089 1122714107 /nfs/dbraw/zinc/71/41/07/1122714107.db2.gz VCDDJEBSDMJSOH-VQTJNVASSA-N 1 0 371.912 4.104 20 10 FICDRO Cc1cc(C(=O)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1ccc(Cl)cc1 ZINC000918601900 1122723239 /nfs/dbraw/zinc/72/32/39/1122723239.db2.gz LLDUUOVYSBMEMI-MJGOQNOKSA-N 1 0 371.912 4.104 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3cc(-c4ccccc4)on3)CC2)cc1 ZINC000154790312 1122751651 /nfs/dbraw/zinc/75/16/51/1122751651.db2.gz CZNWKHLVNGMAOV-UHFFFAOYSA-N 1 0 363.461 4.109 20 10 FICDRO CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000921057443 1123558551 /nfs/dbraw/zinc/55/85/51/1123558551.db2.gz WOBKMSXDZWINQS-ROUUACIJSA-N 1 0 360.542 4.341 20 10 FICDRO CCC[N@H+](Cc1cn(C)nc1-c1ccc(C#N)cc1)Cc1ccccc1O ZINC000180016015 1124198672 /nfs/dbraw/zinc/19/86/72/1124198672.db2.gz AMPWIESZXNIMBE-UHFFFAOYSA-N 1 0 360.461 4.077 20 10 FICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCC(O)CC3)c(F)c1)[C@H](C)C2 ZINC000180214668 1124265791 /nfs/dbraw/zinc/26/57/91/1124265791.db2.gz IAKXKZBYZJNGOU-MWTRTKDXSA-N 1 0 368.496 4.118 20 10 FICDRO COc1cc(C[NH2+]Cc2cc(F)ccc2O)ccc1OCc1ccccc1 ZINC000180387332 1124311117 /nfs/dbraw/zinc/31/11/17/1124311117.db2.gz CCOGGRMTPWAMDU-UHFFFAOYSA-N 1 0 367.420 4.409 20 10 FICDRO C[NH+](C)/C=C/c1ccncc1NCc1cc(Cl)c2cccnc2c1O ZINC001168525745 1124436974 /nfs/dbraw/zinc/43/69/74/1124436974.db2.gz JMABORJRMUNNIQ-RMKNXTFCSA-N 1 0 354.841 4.133 20 10 FICDRO Cc1noc([C@H]2CCC[N@H+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)n1 ZINC000068962179 1124437157 /nfs/dbraw/zinc/43/71/57/1124437157.db2.gz CNLPHVUYBVXTPV-AWEZNQCLSA-N 1 0 367.449 4.088 20 10 FICDRO C[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1ccc(N2CCCCCC2)cc1 ZINC000765933538 1124724329 /nfs/dbraw/zinc/72/43/29/1124724329.db2.gz YFRDHTUTRFZQON-MRXNPFEDSA-N 1 0 357.464 4.212 20 10 FICDRO Cc1cccc(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)c1O ZINC000181349525 1124878173 /nfs/dbraw/zinc/87/81/73/1124878173.db2.gz VLUJTRNHMLBTEE-UHFFFAOYSA-N 1 0 370.456 4.238 20 10 FICDRO CCC[N@H+](CC)Cc1ccc(-c2nc(Cc3ccc(N)cc3)no2)cc1 ZINC000843160148 1124957970 /nfs/dbraw/zinc/95/79/70/1124957970.db2.gz DYCQOLWJUCVWMT-UHFFFAOYSA-N 1 0 350.466 4.142 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)c1O ZINC000181910707 1125178051 /nfs/dbraw/zinc/17/80/51/1125178051.db2.gz LHUMGZLZXXDNJP-JTQLQIEISA-N 1 0 371.330 4.483 20 10 FICDRO Oc1ccccc1C[NH+]1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000019361792 211217697 /nfs/dbraw/zinc/21/76/97/211217697.db2.gz WWXZPNJGLCBJPZ-UHFFFAOYSA-N 1 0 358.485 4.299 20 10 FICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000183007556 1125717536 /nfs/dbraw/zinc/71/75/36/1125717536.db2.gz DVRVETHXPAZGFI-GOSISDBHSA-N 1 0 363.461 4.074 20 10 FICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000183007535 1125717615 /nfs/dbraw/zinc/71/76/15/1125717615.db2.gz DVRVETHXPAZGFI-SFHVURJKSA-N 1 0 363.461 4.074 20 10 FICDRO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000183002493 1125720489 /nfs/dbraw/zinc/72/04/89/1125720489.db2.gz RYZBXUZCMZTZHQ-UHFFFAOYSA-N 1 0 352.434 4.208 20 10 FICDRO COc1ccc(N2CCC[N@H+](C[C@@H]3CC[C@H](c4ccccc4)O3)CC2)cc1 ZINC001167107681 1080552321 /nfs/dbraw/zinc/55/23/21/1080552321.db2.gz GIJKPJSBNSJBSQ-XZOQPEGZSA-N 1 0 366.505 4.128 20 10 FICDRO Cc1cc(C(=O)NC(C)(C)C[NH+](C)C)c(C)n1-c1ccc(C(C)C)cc1 ZINC001625836804 1080582343 /nfs/dbraw/zinc/58/23/43/1080582343.db2.gz GMZQINWNGDEPIX-UHFFFAOYSA-N 1 0 355.526 4.288 20 10 FICDRO C[C@@H]1C[C@@H]1C[N@@H+]1CCc2c(Cl)c(O)c(O)cc2[C@@H](c2ccc(O)cc2)C1 ZINC001209433030 1080680406 /nfs/dbraw/zinc/68/04/06/1080680406.db2.gz SNHQFYQFCDYPFA-RVZJWNSFSA-N 1 0 373.880 4.103 20 10 FICDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(F)cc(F)c2[O-])cc1 ZINC001648795638 1080805201 /nfs/dbraw/zinc/80/52/01/1080805201.db2.gz SITGKIBEZYGJDH-OAHLLOKOSA-N 1 0 360.448 4.335 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(N2CCOCC2)cc1 ZINC000155392306 1080884119 /nfs/dbraw/zinc/88/41/19/1080884119.db2.gz BKSYULQYMYJQHH-OXJNMPFZSA-N 1 0 354.519 4.411 20 10 FICDRO CC[C@](C)([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)c1nc(C)cs1 ZINC000177357041 1081211754 /nfs/dbraw/zinc/21/17/54/1081211754.db2.gz KOCMJUAOEULIID-KRWDZBQOSA-N 1 0 352.887 4.428 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)Cc2ccccc2Cl)cc1Cn1cccn1 ZINC001648816875 1081238263 /nfs/dbraw/zinc/23/82/63/1081238263.db2.gz LDGDQYOFZAMXRT-INIZCTEOSA-N 1 0 369.896 4.314 20 10 FICDRO CC[C@H]([NH2+]Cc1cc2c(c(Br)c1)OCO2)c1ccccc1O ZINC000121097475 1081429659 /nfs/dbraw/zinc/42/96/59/1081429659.db2.gz IKJRUSQYLKSIHS-AWEZNQCLSA-N 1 0 364.239 4.124 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc(-c4ccccc4)nc3)cc2)CC1 ZINC001167434270 1082135764 /nfs/dbraw/zinc/13/57/64/1082135764.db2.gz FUNFKWOJIHVIHJ-UHFFFAOYSA-N 1 0 358.489 4.113 20 10 FICDRO CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)O[C@H](CC)C(=O)N2)c1ccccc1O ZINC000156160716 1082485290 /nfs/dbraw/zinc/48/52/90/1082485290.db2.gz REVYAEKLYJILNV-ACWOFJMJSA-N 1 0 354.450 4.304 20 10 FICDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1ccc(N2CCCCC2)cc1 ZINC000178210352 1082983245 /nfs/dbraw/zinc/98/32/45/1082983245.db2.gz OOUJRKPKFGIZMJ-KRWDZBQOSA-N 1 0 352.478 4.299 20 10 FICDRO CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000179737079 1083612198 /nfs/dbraw/zinc/61/21/98/1083612198.db2.gz RSLZAJXFHVTHMZ-IBGZPJMESA-N 1 0 373.541 4.024 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](Cc2nc(C)no2)c2ccccc2)cc1 ZINC000277046563 1083727083 /nfs/dbraw/zinc/72/70/83/1083727083.db2.gz GQCPSYVEVHKVMQ-HRAATJIYSA-N 1 0 364.493 4.469 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)c2ccccc2)n1 ZINC000277152010 1083858660 /nfs/dbraw/zinc/85/86/60/1083858660.db2.gz QJNVTFRPUQPYQU-DNVCBOLYSA-N 1 0 351.450 4.335 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(N2CCOCC2)c(F)c1 ZINC000177862721 1084393326 /nfs/dbraw/zinc/39/33/26/1084393326.db2.gz PPCWXKNMUCMVKK-GFCCVEGCSA-N 1 0 354.878 4.228 20 10 FICDRO CCC[N@H+](CCOc1ccccc1Br)Cc1ccccc1O ZINC001167521852 1084438985 /nfs/dbraw/zinc/43/89/85/1084438985.db2.gz KPJXVUVYXWPDBT-UHFFFAOYSA-N 1 0 364.283 4.446 20 10 FICDRO Cc1cccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1C ZINC000177974412 1084520293 /nfs/dbraw/zinc/52/02/93/1084520293.db2.gz HPOFOEAOLLPPAS-GOSISDBHSA-N 1 0 365.521 4.411 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccsc1 ZINC000178189546 1084848343 /nfs/dbraw/zinc/84/83/43/1084848343.db2.gz GXFHPXQCWQZNSC-CYBMUJFWSA-N 1 0 370.440 4.454 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000159056826 1085087301 /nfs/dbraw/zinc/08/73/01/1085087301.db2.gz XQCKTOPRJWLSIM-CVEARBPZSA-N 1 0 366.509 4.448 20 10 FICDRO CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC001648916772 1085311158 /nfs/dbraw/zinc/31/11/58/1085311158.db2.gz KGPSWNZGVRPVDE-HKUYNNGSSA-N 1 0 362.533 4.481 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(OC)c(OC)c2OC)cc1 ZINC000164533432 1085851215 /nfs/dbraw/zinc/85/12/15/1085851215.db2.gz HTUPZDYSJPHAFG-HNNXBMFYSA-N 1 0 358.482 4.019 20 10 FICDRO CCC[N@@H+]1CCC[C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 ZINC001625905087 1085944646 /nfs/dbraw/zinc/94/46/46/1085944646.db2.gz GXCLVGQNEBDICC-HXUWFJFHSA-N 1 0 371.569 4.194 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cnc2ccsc2c1 ZINC000165192100 1086396588 /nfs/dbraw/zinc/39/65/88/1086396588.db2.gz MZBXEYAKYKZGNQ-AWEZNQCLSA-N 1 0 371.481 4.123 20 10 FICDRO C[C@@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccc(N2CCCCC2)c(F)c1 ZINC000161731322 1086732835 /nfs/dbraw/zinc/73/28/35/1086732835.db2.gz VLNGBFUTMZQCFD-MRXNPFEDSA-N 1 0 362.489 4.152 20 10 FICDRO Oc1ccccc1C[N@H+](Cc1nnc(C2CC2)n1C1CC1)C1CCCC1 ZINC000782929030 1088658381 /nfs/dbraw/zinc/65/83/81/1088658381.db2.gz ADTUQNHXSKMSQK-UHFFFAOYSA-N 1 0 352.482 4.141 20 10 FICDRO CC(C)N(C(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2)C(C)C ZINC000435855117 1089975727 /nfs/dbraw/zinc/97/57/27/1089975727.db2.gz IHKRQAMVWMGRSN-UHFFFAOYSA-N 1 0 355.526 4.053 20 10 FICDRO COc1ccc(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)cc1C ZINC000312204961 1090428197 /nfs/dbraw/zinc/42/81/97/1090428197.db2.gz BHMLQWJVAIHJEN-GOSISDBHSA-N 1 0 374.525 4.415 20 10 FICDRO CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000312212998 1090430691 /nfs/dbraw/zinc/43/06/91/1090430691.db2.gz LYEAIWZDTWWWJQ-IBGZPJMESA-N 1 0 373.541 4.166 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2cccc(Br)c2)c1 ZINC000756483147 1090505038 /nfs/dbraw/zinc/50/50/38/1090505038.db2.gz NSYQWLYKGBETAV-QWHCGFSZSA-N 1 0 364.283 4.445 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(c3ccccc3OC(F)F)C2)c(O)c1 ZINC000185477356 1090545805 /nfs/dbraw/zinc/54/58/05/1090545805.db2.gz VYIOWMBHQSDHDN-CABCVRRESA-N 1 0 362.420 4.232 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccsc2)cc1F ZINC000780524069 1090575350 /nfs/dbraw/zinc/57/53/50/1090575350.db2.gz CCINCQYTVIRVRE-UHFFFAOYSA-N 1 0 358.486 4.413 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)c1ccc(N(C)C)cc1 ZINC000162636715 1091177172 /nfs/dbraw/zinc/17/71/72/1091177172.db2.gz AVVGPAJCAVCPHS-GOSISDBHSA-N 1 0 368.521 4.299 20 10 FICDRO C[C@@H](CC[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 ZINC000194265286 1091367236 /nfs/dbraw/zinc/36/72/36/1091367236.db2.gz BTBUOWDTGKEWMB-IBGZPJMESA-N 1 0 352.522 4.179 20 10 FICDRO CSc1ccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000178592039 1092108661 /nfs/dbraw/zinc/10/86/61/1092108661.db2.gz JKXDGJCLTRTDLN-OAHLLOKOSA-N 1 0 360.498 4.235 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C2CCN(C3CC3)CC2)cc1 ZINC000236970749 1093247895 /nfs/dbraw/zinc/24/78/95/1093247895.db2.gz QCRSVCGJWWTIBA-UHFFFAOYSA-N 1 0 363.549 4.430 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]CCCc2cn(-c3ccccc3)nc2C)c1 ZINC000237071444 1093817692 /nfs/dbraw/zinc/81/76/92/1093817692.db2.gz LUNIBACNVOVJCJ-UHFFFAOYSA-N 1 0 365.477 4.007 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)c(O)c1C ZINC000281151697 1095496349 /nfs/dbraw/zinc/49/63/49/1095496349.db2.gz AXPGLBYSCXNTPO-ZDUSSCGKSA-N 1 0 354.372 4.196 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccc([S@](C)=O)cc1 ZINC000273473367 1096265503 /nfs/dbraw/zinc/26/55/03/1096265503.db2.gz KCTMOSXRRJECOI-XHQUFGICSA-N 1 0 357.519 4.420 20 10 FICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ncc(Br)s1 ZINC000179232360 1099472918 /nfs/dbraw/zinc/47/29/18/1099472918.db2.gz FMJNMQISKIALRS-QMMMGPOBSA-N 1 0 364.359 4.195 20 10 FICDRO Oc1cc2c(cc1C[NH+]1CCC(O)(C(F)(F)F)CC1)oc1ccccc12 ZINC000760286325 1100100517 /nfs/dbraw/zinc/10/05/17/1100100517.db2.gz ZHCBDBSAQCJKRF-UHFFFAOYSA-N 1 0 365.351 4.181 20 10 FICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)c2ccccc2n1 ZINC000729679452 1101902294 /nfs/dbraw/zinc/90/22/94/1101902294.db2.gz JFUBOWONKBZUPK-GOSISDBHSA-N 1 0 361.489 4.231 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)nc2-n2cc(Cl)cn2)c1 ZINC000191531188 1101947716 /nfs/dbraw/zinc/94/77/16/1101947716.db2.gz HFQPATLGBWVQBO-CQSZACIVSA-N 1 0 356.857 4.094 20 10 FICDRO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001168179544 1102022662 /nfs/dbraw/zinc/02/26/62/1102022662.db2.gz KYQFPZPWSYMRRF-KRWDZBQOSA-N 1 0 358.913 4.240 20 10 FICDRO Cc1cc(CN2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193583 1102273207 /nfs/dbraw/zinc/27/32/07/1102273207.db2.gz RSRQMQSGINIXCZ-UXHICEINSA-N 1 0 351.538 4.156 20 10 FICDRO Cc1cc(CN2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001168193584 1102273428 /nfs/dbraw/zinc/27/34/28/1102273428.db2.gz RSRQMQSGINIXCZ-VQTJNVASSA-N 1 0 351.538 4.156 20 10 FICDRO COc1cccc(C[NH2+]Cc2sccc2NC(=O)OC(C)(C)C)c1O ZINC000894458822 1102371504 /nfs/dbraw/zinc/37/15/04/1102371504.db2.gz XJSKFWXCBVTSCU-UHFFFAOYSA-N 1 0 364.467 4.099 20 10 FICDRO COc1cccc(-c2csc(C[NH2+][C@H](C)c3cc(OC)ccc3O)n2)c1 ZINC000894501724 1102472866 /nfs/dbraw/zinc/47/28/66/1102472866.db2.gz FTTZPIFKSJGYFF-CYBMUJFWSA-N 1 0 370.474 4.384 20 10 FICDRO COc1cc(C)cc(CN[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)c1O ZINC000894628265 1102653361 /nfs/dbraw/zinc/65/33/61/1102653361.db2.gz DPENISITDJGXTC-GFCCVEGCSA-N 1 0 373.840 4.263 20 10 FICDRO C[C@@H](COCc1ccccc1)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001167983450 1102885117 /nfs/dbraw/zinc/88/51/17/1102885117.db2.gz MBCJPUNRLUWSGX-DENIHFKCSA-N 1 0 369.505 4.226 20 10 FICDRO CC(C)(C)OC(=O)NCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000729679349 1103029427 /nfs/dbraw/zinc/02/94/27/1103029427.db2.gz WEAXNIAFMPTGCI-UHFFFAOYSA-N 1 0 356.466 4.064 20 10 FICDRO CCn1nc(C)c(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)c1C ZINC000729678844 1103035356 /nfs/dbraw/zinc/03/53/56/1103035356.db2.gz RWVBFNOLTVLOQD-UHFFFAOYSA-N 1 0 350.510 4.260 20 10 FICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)c1ccccc1O ZINC000188595524 1104743451 /nfs/dbraw/zinc/74/34/51/1104743451.db2.gz PCHDRODMPRTJCC-HNNXBMFYSA-N 1 0 368.477 4.494 20 10 FICDRO CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CC[C@H]([NH3+])c1ccccc1 ZINC000237217385 1105101294 /nfs/dbraw/zinc/10/12/94/1105101294.db2.gz KMDAURGKMNVYEM-QFIPXVFZSA-N 1 0 365.521 4.116 20 10 FICDRO COc1cc(O)c(C[NH+]2CCC3(CC2)c2ccccc2N=C3C)cc1OC ZINC000895132022 1105235526 /nfs/dbraw/zinc/23/55/26/1105235526.db2.gz XDBDCJIKCVSHEY-UHFFFAOYSA-N 1 0 366.461 4.049 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3C[C@@H](C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000827986278 1107515159 /nfs/dbraw/zinc/51/51/59/1107515159.db2.gz SDSZHPHJAOAKPA-WZONZLPQSA-N 1 0 350.506 4.495 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](C(C)(C)C)CC2)c(C)n1-c1ccccc1C ZINC000303057760 1107521638 /nfs/dbraw/zinc/52/16/38/1107521638.db2.gz ZMXKCLCYEQWRMW-UHFFFAOYSA-N 1 0 367.537 4.395 20 10 FICDRO COc1ccc(O)c(C[NH2+]CC2(N(C)Cc3ccccc3)CCCCC2)c1 ZINC000714236203 1108398244 /nfs/dbraw/zinc/39/82/44/1108398244.db2.gz DGNHZCIKKZFDCW-UHFFFAOYSA-N 1 0 368.521 4.325 20 10 FICDRO CCOc1cccc(C[NH2+]Cc2cc(F)c(Br)cc2F)c1O ZINC000527790755 1109824069 /nfs/dbraw/zinc/82/40/69/1109824069.db2.gz KHTBWEQTGQSHRP-UHFFFAOYSA-N 1 0 372.209 4.121 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(OC)cc(C(F)(F)F)c2)c1 ZINC000529568551 1110289997 /nfs/dbraw/zinc/28/99/97/1110289997.db2.gz BOIDYNYYIXPYHA-LLVKDONJSA-N 1 0 355.356 4.279 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc(N(C)C)cc1 ZINC000163594004 1113867798 /nfs/dbraw/zinc/86/77/98/1113867798.db2.gz YQNNFJBVJVZTDW-QGZVFWFLSA-N 1 0 355.551 4.157 20 10 FICDRO CCc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(N3CCSCC3)cc1)CCC2 ZINC000163608507 1113997560 /nfs/dbraw/zinc/99/75/60/1113997560.db2.gz ZCELLQWLRINVHN-KRWDZBQOSA-N 1 0 373.591 4.426 20 10 FICDRO c1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163615078 1114115142 /nfs/dbraw/zinc/11/51/42/1114115142.db2.gz VHKKHRQYABXKAG-HXUWFJFHSA-N 1 0 354.519 4.243 20 10 FICDRO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151071054 1114289001 /nfs/dbraw/zinc/28/90/01/1114289001.db2.gz RDZONXRIMNHTOG-HNNXBMFYSA-N 1 0 373.566 4.436 20 10 FICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1 ZINC000163634407 1114314313 /nfs/dbraw/zinc/31/43/13/1114314313.db2.gz BCCZBHKSNCIVEN-QGZVFWFLSA-N 1 0 356.535 4.489 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC[C@@H]1CCCO1)c1ccccc1O ZINC000156336546 1114417730 /nfs/dbraw/zinc/41/77/30/1114417730.db2.gz BPVPRSOOPGTPJM-AZUAARDMSA-N 1 0 355.478 4.499 20 10 FICDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)c1cccnc1 ZINC000164199668 1114444309 /nfs/dbraw/zinc/44/43/09/1114444309.db2.gz PVTWBLJNXZWRPQ-FXAWDEMLSA-N 1 0 371.500 4.148 20 10 FICDRO COc1cc(C)cc(C[NH+]2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1O ZINC000164197871 1114444387 /nfs/dbraw/zinc/44/43/87/1114444387.db2.gz PFYZVDLWRPKGBT-UHFFFAOYSA-N 1 0 373.880 4.458 20 10 FICDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1cn(-c2ccccc2)nn1 ZINC000760714039 1114669399 /nfs/dbraw/zinc/66/93/99/1114669399.db2.gz RVZXRSDKZUQHKP-KRWDZBQOSA-N 1 0 370.456 4.491 20 10 FICDRO CCC(CC)C(=O)N1CCC([NH2+][C@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000166065297 1114928522 /nfs/dbraw/zinc/92/85/22/1114928522.db2.gz YXTLBDQWBUVTEQ-OAQYLSRUSA-N 1 0 359.558 4.221 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000157409352 1115102058 /nfs/dbraw/zinc/10/20/58/1115102058.db2.gz RTMUFHGTVNCXSW-INIZCTEOSA-N 1 0 369.465 4.231 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn3cc(Br)cc(C)c3n2)c(O)c1 ZINC000760879588 1115126584 /nfs/dbraw/zinc/12/65/84/1115126584.db2.gz GGQKKAMQWGGIJC-CYBMUJFWSA-N 1 0 374.282 4.270 20 10 FICDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl ZINC000760905883 1115169474 /nfs/dbraw/zinc/16/94/74/1115169474.db2.gz LXMOMSRGAUBACA-AEFFLSMTSA-N 1 0 366.933 4.177 20 10 FICDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl ZINC000760905893 1115169620 /nfs/dbraw/zinc/16/96/20/1115169620.db2.gz LXMOMSRGAUBACA-SJLPKXTDSA-N 1 0 366.933 4.177 20 10 FICDRO C[C@H]1C[C@@H]([NH2+]C2CCC(O)(c3ccccc3)CC2)c2c1c(F)ccc2O ZINC000760909845 1115170954 /nfs/dbraw/zinc/17/09/54/1115170954.db2.gz WZXOWUWUTXFJQR-KJIVCWLOSA-N 1 0 355.453 4.500 20 10 FICDRO C[C@@H]1C[C@H]([NH2+]C2CCC(O)(c3ccccc3)CC2)c2c1c(F)ccc2O ZINC000760909857 1115171500 /nfs/dbraw/zinc/17/15/00/1115171500.db2.gz WZXOWUWUTXFJQR-UEZCOGKGSA-N 1 0 355.453 4.500 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)cc1 ZINC000157677967 1115229058 /nfs/dbraw/zinc/22/90/58/1115229058.db2.gz XMWZILYVBNMIGO-IIBYNOLFSA-N 1 0 372.484 4.473 20 10 FICDRO FC(F)Oc1ccc(N2CCC[C@@H]([NH2+]Cc3cccnc3Cl)C2)cc1 ZINC000174621264 1116181644 /nfs/dbraw/zinc/18/16/44/1116181644.db2.gz ZTTNGUQILMWQFN-CQSZACIVSA-N 1 0 367.827 4.095 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cccc(OC)c1 ZINC000151564656 1118532911 /nfs/dbraw/zinc/53/29/11/1118532911.db2.gz KGHAKVKGWFXQLN-QHCPKHFHSA-N 1 0 368.521 4.145 20 10 FICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)c1 ZINC000151575914 1118830672 /nfs/dbraw/zinc/83/06/72/1118830672.db2.gz UBLZUHDPSKZJJV-SFHVURJKSA-N 1 0 368.521 4.145 20 10 FICDRO O=C(Nc1ccc(F)cc1)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000152344880 1119213779 /nfs/dbraw/zinc/21/37/79/1119213779.db2.gz BXKUFIRSMQEQDZ-UHFFFAOYSA-N 1 0 350.393 4.073 20 10 FICDRO C[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000152744114 1119493847 /nfs/dbraw/zinc/49/38/47/1119493847.db2.gz PGAWVAILRXZVLD-QGZVFWFLSA-N 1 0 370.516 4.242 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)CCCO2 ZINC000153142811 1120028575 /nfs/dbraw/zinc/02/85/75/1120028575.db2.gz RAKDEEHNIXTZTK-JOCHJYFZSA-N 1 0 366.505 4.089 20 10 FICDRO Cc1ccc(O)c(C[NH2+]C(C)(C)[C@@H](O)c2ccc(Br)cc2)c1 ZINC000762788899 1120962965 /nfs/dbraw/zinc/96/29/65/1120962965.db2.gz ZBPPTXXGCQJHKZ-KRWDZBQOSA-N 1 0 364.283 4.065 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(N(C)C)cc1 ZINC000153657429 1121007870 /nfs/dbraw/zinc/00/78/70/1121007870.db2.gz BHRQHEJRTZBPPI-HXUWFJFHSA-N 1 0 352.457 4.318 20 10 FICDRO Cc1c(Cl)cccc1NC(=O)CC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001649019439 1121191746 /nfs/dbraw/zinc/19/17/46/1121191746.db2.gz AFQOJEXTSUGKSR-AATRIKPKSA-N 1 0 371.912 4.346 20 10 FICDRO O=C(OCCCn1ccnc1)c1ccccc1NN=C1C=CC(=O)C=C1 ZINC000763286281 1121317286 /nfs/dbraw/zinc/31/72/86/1121317286.db2.gz BQJINXMGNRRSRH-UHFFFAOYSA-N 1 0 350.378 4.251 20 10 FICDRO Cc1cc(CC[NH2+]C[C@H](O)c2ccc(F)c(F)c2)c(C)n1-c1ccccc1 ZINC000916989390 1121992243 /nfs/dbraw/zinc/99/22/43/1121992243.db2.gz HXKHYIGIEJMOSQ-QFIPXVFZSA-N 1 0 370.443 4.238 20 10 FICDRO CC(C)[N@H+](CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccc(N(C)C)cc1 ZINC000917074942 1122068980 /nfs/dbraw/zinc/06/89/80/1122068980.db2.gz MHGKLPCEHOLNBB-IFMALSPDSA-N 1 0 371.569 4.144 20 10 FICDRO CC(=O)N[C@H]1CCC[N@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000917470184 1122327968 /nfs/dbraw/zinc/32/79/68/1122327968.db2.gz QRHWPFARVHBODM-SFHVURJKSA-N 1 0 360.542 4.088 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCc2c1cc(F)cc2F)c1ccc(N2CCOCC2)cc1 ZINC000154637261 1122544324 /nfs/dbraw/zinc/54/43/24/1122544324.db2.gz DQMSYIUBIWQOPL-SZNDQCEHSA-N 1 0 358.432 4.140 20 10 FICDRO CCC[NH+]1CCC(N(C)C(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 ZINC000918704475 1122754280 /nfs/dbraw/zinc/75/42/80/1122754280.db2.gz HELABNZBJLQXRD-UHFFFAOYSA-N 1 0 367.537 4.349 20 10 FICDRO CO[C@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000918748872 1122772349 /nfs/dbraw/zinc/77/23/49/1122772349.db2.gz BDZLOYDUHUIIIY-OAQYLSRUSA-N 1 0 369.465 4.062 20 10 FICDRO CCOC(=O)N1CCC([NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)CC1 ZINC000918748826 1122772798 /nfs/dbraw/zinc/77/27/98/1122772798.db2.gz LEZACBZCMSZFEW-UHFFFAOYSA-N 1 0 369.509 4.113 20 10 FICDRO CN(C)[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1cccc(F)c1 ZINC000920956890 1123542157 /nfs/dbraw/zinc/54/21/57/1123542157.db2.gz ZQSRNBAYWRCJAS-QFIPXVFZSA-N 1 0 355.501 4.209 20 10 FICDRO Cc1cccc(C[N@@H+]2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1O ZINC000179958048 1124163045 /nfs/dbraw/zinc/16/30/45/1124163045.db2.gz CJPJHGRHKKPZBD-QGZVFWFLSA-N 1 0 367.424 4.269 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(N3CCC(OC)CC3)CCCC2)cc1 ZINC000765859872 1124292121 /nfs/dbraw/zinc/29/21/21/1124292121.db2.gz LZECTRNPYUTHEH-LJQANCHMSA-N 1 0 373.585 4.217 20 10 FICDRO O=C(Nc1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1)c1ccc(F)cc1 ZINC000180573793 1124372640 /nfs/dbraw/zinc/37/26/40/1124372640.db2.gz VPARXSRYHXTYEX-UHFFFAOYSA-N 1 0 368.383 4.213 20 10 FICDRO COc1cccc(C[NH2+]Cc2ccc(OC)c(OCCC(C)C)c2)c1O ZINC000733900862 1125071904 /nfs/dbraw/zinc/07/19/04/1125071904.db2.gz NNNWDCHFMHYVMF-UHFFFAOYSA-N 1 0 359.466 4.124 20 10 FICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)nc2)cc1 ZINC000069712308 1125121449 /nfs/dbraw/zinc/12/14/49/1125121449.db2.gz NVOGTANBMWCCPF-UHFFFAOYSA-N 1 0 351.425 4.369 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)n1)c1ccc(N2CCCCC2)c(F)c1 ZINC000090851818 1125254893 /nfs/dbraw/zinc/25/48/93/1125254893.db2.gz FDIPWNMIVQHGEW-MRXNPFEDSA-N 1 0 356.489 4.128 20 10 FICDRO CCOc1ccc(-c2nc(C[NH2+][C@H](C)c3cc(OC)ccc3O)co2)cc1 ZINC000182471879 1125518448 /nfs/dbraw/zinc/51/84/48/1125518448.db2.gz JBGIJNBHAILCCO-CQSZACIVSA-N 1 0 368.433 4.305 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000182572299 1125569398 /nfs/dbraw/zinc/56/93/98/1125569398.db2.gz SMANTQQOJWTUQB-QHCPKHFHSA-N 1 0 368.496 4.202 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000182572280 1125569432 /nfs/dbraw/zinc/56/94/32/1125569432.db2.gz SMANTQQOJWTUQB-HSZRJFAPSA-N 1 0 368.496 4.202 20 10 FICDRO COc1cc(O)c(C[NH2+]C(C)(C)c2ccc(OCC(C)C)cc2)cc1OC ZINC000160171021 1079543102 /nfs/dbraw/zinc/54/31/02/1079543102.db2.gz ZNSOMMRAOVOPKJ-UHFFFAOYSA-N 1 0 373.493 4.469 20 10 FICDRO COC[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccc(C)o1 ZINC000183159066 1125762798 /nfs/dbraw/zinc/76/27/98/1125762798.db2.gz JOWCJOISNALKFU-FQEVSTJZSA-N 1 0 367.445 4.350 20 10 FICDRO Cc1ccsc1C[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000120813371 1080712560 /nfs/dbraw/zinc/71/25/60/1080712560.db2.gz ODPDRRNPRVJWDO-UHFFFAOYSA-N 1 0 370.440 4.202 20 10 FICDRO Cc1ccc(F)cc1C[NH2+]Cc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 ZINC001648835236 1081276864 /nfs/dbraw/zinc/27/68/64/1081276864.db2.gz FKHBZTQMQFHBJX-HZPDHXFCSA-N 1 0 360.448 4.177 20 10 FICDRO Cc1cccc(C)c1OC[C@@H](C)[NH2+]Cc1c(O)cccc1Br ZINC001648909682 1082027532 /nfs/dbraw/zinc/02/75/32/1082027532.db2.gz NXHPJPCFLDIXLK-CQSZACIVSA-N 1 0 364.283 4.329 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc(CC(F)(F)F)cc3)cc2)CC1 ZINC001167431353 1082095292 /nfs/dbraw/zinc/09/52/92/1082095292.db2.gz UXPYUEJZNSNTCT-UHFFFAOYSA-N 1 0 363.427 4.155 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3cccnc3-c3ccccc3)cc2)CC1 ZINC001167434913 1082142174 /nfs/dbraw/zinc/14/21/74/1082142174.db2.gz ZFYFWOFEAYXOMY-UHFFFAOYSA-N 1 0 358.489 4.113 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)NCCC4(C)C)cc2)CC1 ZINC001167436876 1082189417 /nfs/dbraw/zinc/18/94/17/1082189417.db2.gz DQSZWFOHOLTNQA-UHFFFAOYSA-N 1 0 364.537 4.144 20 10 FICDRO CCN(CC)c1ccc(C)c(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001167437385 1082199600 /nfs/dbraw/zinc/19/96/00/1082199600.db2.gz TYUKQOCXIAKWBL-UHFFFAOYSA-N 1 0 366.553 4.205 20 10 FICDRO CC[C@@H]([NH2+][C@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000160721923 1082274522 /nfs/dbraw/zinc/27/45/22/1082274522.db2.gz ZHIYLXPVRKTBNX-FGZHOGPDSA-N 1 0 365.521 4.157 20 10 FICDRO Cc1cccc(OC[C@@H](O)C[N@H+](Cc2ccc(N(C)C)c(C)c2)C(C)C)c1 ZINC001167487940 1082982463 /nfs/dbraw/zinc/98/24/63/1082982463.db2.gz ULRLUELQCJTGJG-NRFANRHFSA-N 1 0 370.537 4.020 20 10 FICDRO CCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000177880251 1084408834 /nfs/dbraw/zinc/40/88/34/1084408834.db2.gz YEBMXDHAAIAJAY-GOSISDBHSA-N 1 0 365.521 4.277 20 10 FICDRO CCC[N@H+](CC(=O)N(C1CC1)C1CCC(C)CC1)Cc1ccccc1O ZINC001167521753 1084439404 /nfs/dbraw/zinc/43/94/04/1084439404.db2.gz ILFBWHBYFCJSOC-UHFFFAOYSA-N 1 0 358.526 4.174 20 10 FICDRO C[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccc(N2CCOCC2)cc1 ZINC000177951536 1084486659 /nfs/dbraw/zinc/48/66/59/1084486659.db2.gz HFIYFXLUKRKTHU-VQTJNVASSA-N 1 0 368.521 4.027 20 10 FICDRO Cc1cccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1C ZINC000177974423 1084519956 /nfs/dbraw/zinc/51/99/56/1084519956.db2.gz HPOFOEAOLLPPAS-SFHVURJKSA-N 1 0 365.521 4.411 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC2(C)CCCC2)C1 ZINC001126053513 1085484138 /nfs/dbraw/zinc/48/41/38/1085484138.db2.gz CYULJTRPUISJHS-UHFFFAOYSA-N 1 0 367.537 4.104 20 10 FICDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Br)cc2O)CCO1 ZINC000756865540 1086472824 /nfs/dbraw/zinc/47/28/24/1086472824.db2.gz QJVCOPNBLXQEIU-VHDGCEQUSA-N 1 0 356.304 4.399 20 10 FICDRO CCOc1cccc(C[NH2+][C@H]2CCc3c2cccc3Br)c1O ZINC000105491804 1086560703 /nfs/dbraw/zinc/56/07/03/1086560703.db2.gz VGPUQWUEIUHHCP-INIZCTEOSA-N 1 0 362.267 4.331 20 10 FICDRO Clc1ccc(Br)cc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000722368248 1086628568 /nfs/dbraw/zinc/62/85/68/1086628568.db2.gz VJRYKZMZQYVCCF-UHFFFAOYSA-N 1 0 352.659 4.327 20 10 FICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000162370756 1087931757 /nfs/dbraw/zinc/93/17/57/1087931757.db2.gz ORYVLCZLKDRYRR-SJORKVTESA-N 1 0 372.484 4.391 20 10 FICDRO CCCc1ccc(C(=O)Nc2cccc(N3CC[NH+](CC)CC3)c2)cc1 ZINC001269779714 1088569228 /nfs/dbraw/zinc/56/92/28/1088569228.db2.gz ZCWCRJFICVGMKX-UHFFFAOYSA-N 1 0 351.494 4.033 20 10 FICDRO CC(C)CCn1cccc1C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000236642069 1089038798 /nfs/dbraw/zinc/03/87/98/1089038798.db2.gz WDSTYDNPAJKELY-UHFFFAOYSA-N 1 0 357.567 4.377 20 10 FICDRO COc1ccc(C[NH2+]Cc2cccc(COC(C)(C)C)c2)c(O)c1OC ZINC000892793974 1089071506 /nfs/dbraw/zinc/07/15/06/1089071506.db2.gz PPSKSHLNLFDYGT-UHFFFAOYSA-N 1 0 359.466 4.014 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)c(O)c1OC ZINC000892906488 1089264296 /nfs/dbraw/zinc/26/42/96/1089264296.db2.gz QJMMQVDITZRCHJ-CYBMUJFWSA-N 1 0 370.474 4.384 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2Oc2cccnc2)c1 ZINC000182369188 1090348121 /nfs/dbraw/zinc/34/81/21/1090348121.db2.gz QLVXOFSYVZPXIH-HNNXBMFYSA-N 1 0 350.418 4.439 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OCc3ccccn3)cc2)c1 ZINC000182391330 1090349473 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CC[C@H]([NH2+]Cc1sc(C)nc1C)c1cc(Br)ccc1O ZINC000312884321 1091723124 /nfs/dbraw/zinc/72/31/24/1091723124.db2.gz VTCDIZFFBDIIGN-ZDUSSCGKSA-N 1 0 355.301 4.469 20 10 FICDRO c1ccc(C[C@H]2CCC[C@@H]2[NH2+]Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000236593634 1092399919 /nfs/dbraw/zinc/39/99/19/1092399919.db2.gz ISBPMTFEZFPVLF-GGAORHGYSA-N 1 0 350.506 4.024 20 10 FICDRO CCCCOc1ccc([C@H](C)[NH2+]Cc2cccc(OC)c2O)cc1OC ZINC000236710047 1092415174 /nfs/dbraw/zinc/41/51/74/1092415174.db2.gz JEMJWBGWFZJZSO-HNNXBMFYSA-N 1 0 359.466 4.439 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1 ZINC000237049948 1093763705 /nfs/dbraw/zinc/76/37/05/1093763705.db2.gz LIFHWEDQUHPYMN-UHFFFAOYSA-N 1 0 357.450 4.036 20 10 FICDRO Clc1nccc2cc(C[NH2+]Cc3ccc(N4CCOCC4)cc3)sc21 ZINC000894200801 1093910141 /nfs/dbraw/zinc/91/01/41/1093910141.db2.gz RGFMXWIRWZFIEA-UHFFFAOYSA-N 1 0 373.909 4.076 20 10 FICDRO CCN1CC[C@H]([NH2+][C@H](C)c2ccccc2O)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000783533699 1094435982 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C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 ZINC000127537712 1102730481 /nfs/dbraw/zinc/73/04/81/1102730481.db2.gz YTDMMBFIKFLLSL-UYAOXDASSA-N 1 0 358.526 4.056 20 10 FICDRO CCCn1c(C)nn(CN(Cc2ccc(N(C)C)cc2)C(C)C)c1=S ZINC000760268014 1103068110 /nfs/dbraw/zinc/06/81/10/1103068110.db2.gz UKQATUAMFMZGNS-UHFFFAOYSA-N 1 0 361.559 4.067 20 10 FICDRO CC(C)NC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746280 1103121991 /nfs/dbraw/zinc/12/19/91/1103121991.db2.gz XHOPMWUQQLMBHU-ZDUSSCGKSA-N 1 0 361.873 4.426 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1ccccc1O ZINC000760040626 1104996444 /nfs/dbraw/zinc/99/64/44/1104996444.db2.gz UESBLLQDOHKSHB-BVSLBCMMSA-N 1 0 357.469 4.346 20 10 FICDRO C[C@H]([NH2+]C[C@]1(CO)C[C@@H]1c1ccc(F)cc1)c1cc2c(cc1O)CCCC2 ZINC000760041223 1105037363 /nfs/dbraw/zinc/03/73/63/1105037363.db2.gz NYCUQBWBIDOWHW-XFEAKLGESA-N 1 0 369.480 4.227 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c2ccccc2)n1 ZINC000760052149 1105218547 /nfs/dbraw/zinc/21/85/47/1105218547.db2.gz PZGQQRRUGZEHTO-OAUYIBNBSA-N 1 0 367.424 4.345 20 10 FICDRO C[N@H+](Cc1cc2cc(F)ccc2o1)Cc1ccc(N2CCOCC2)cc1 ZINC000121294256 1106854202 /nfs/dbraw/zinc/85/42/02/1106854202.db2.gz NNGQSMXSJYNCRJ-UHFFFAOYSA-N 1 0 354.425 4.041 20 10 FICDRO Cc1cc(O)c(C[N@@H+](C)C2CCN(CCC(F)(F)F)CC2)c(Cl)c1 ZINC000840952557 1107919689 /nfs/dbraw/zinc/91/96/89/1107919689.db2.gz FASBFAXOFUXXCX-UHFFFAOYSA-N 1 0 364.839 4.203 20 10 FICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Br)c(F)c1F)CC2 ZINC000527986980 1109887151 /nfs/dbraw/zinc/88/71/51/1109887151.db2.gz MVWAHTPPDQZFGW-LBPRGKRZSA-N 1 0 354.194 4.210 20 10 FICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(Br)c(F)c1F)CC2 ZINC000527986978 1109887355 /nfs/dbraw/zinc/88/73/55/1109887355.db2.gz MVWAHTPPDQZFGW-GFCCVEGCSA-N 1 0 354.194 4.210 20 10 FICDRO Cc1cc(C[N@H+](Cc2ccccc2)CC2(O)CCCC2)ccc1N(C)C ZINC001168114551 1110223740 /nfs/dbraw/zinc/22/37/40/1110223740.db2.gz PEAGTXABRSPXKR-UHFFFAOYSA-N 1 0 352.522 4.368 20 10 FICDRO CCOc1ccc(C[NH2+]Cc2cc(Br)ccc2C)c(O)c1 ZINC000783995291 1113458429 /nfs/dbraw/zinc/45/84/29/1113458429.db2.gz XDHLRRZLIZEQEQ-UHFFFAOYSA-N 1 0 350.256 4.152 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000151077014 1114289843 /nfs/dbraw/zinc/28/98/43/1114289843.db2.gz UUCVYARCRNPOPQ-LJQANCHMSA-N 1 0 373.500 4.436 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000151329629 1114344196 /nfs/dbraw/zinc/34/41/96/1114344196.db2.gz HAZFXGNNMCHFOX-HRAATJIYSA-N 1 0 354.469 4.391 20 10 FICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)[C@]12CCCO2 ZINC000760882479 1115121687 /nfs/dbraw/zinc/12/16/87/1115121687.db2.gz XENWNYNZAYHCHM-XSEFMFLKSA-N 1 0 372.553 4.444 20 10 FICDRO Cc1cc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c(C)n1-c1ccccc1C ZINC000761147142 1115568932 /nfs/dbraw/zinc/56/89/32/1115568932.db2.gz XQTFMPNLOWASRS-UHFFFAOYSA-N 1 0 365.521 4.103 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)c1O ZINC000761195240 1115616892 /nfs/dbraw/zinc/61/68/92/1115616892.db2.gz LBVPZNHPFQTMEA-UHFFFAOYSA-N 1 0 365.832 4.237 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](OC)c2ccc(F)cc2)c1O ZINC000761216688 1115648646 /nfs/dbraw/zinc/64/86/46/1115648646.db2.gz WDQBGBOJAGKWFV-ADLMAVQZSA-N 1 0 353.821 4.059 20 10 FICDRO CC[C@H]([NH2+]C[C@H]1CSCCS1)c1cc(Br)ccc1O ZINC000229583424 1115857526 /nfs/dbraw/zinc/85/75/26/1115857526.db2.gz GITVQIIJEJGGFF-AAEUAGOBSA-N 1 0 362.358 4.044 20 10 FICDRO Cc1cc(O)c(C[NH2+]CCc2nc(-c3cccc(Cl)c3)no2)cc1C ZINC000174397367 1116134567 /nfs/dbraw/zinc/13/45/67/1116134567.db2.gz MTSIVVNZVZIXRW-UHFFFAOYSA-N 1 0 357.841 4.045 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)cc1 ZINC000174647066 1116325429 /nfs/dbraw/zinc/32/54/29/1116325429.db2.gz CPUMYHCCPYUVMN-UHFFFAOYSA-N 1 0 356.485 4.467 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1 ZINC000151588393 1118939716 /nfs/dbraw/zinc/93/97/16/1118939716.db2.gz VTSVNRMEYVQDND-QFIPXVFZSA-N 1 0 356.485 4.275 20 10 FICDRO COc1ccc(C2(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCOCC2)cc1 ZINC000152658939 1119478259 /nfs/dbraw/zinc/47/82/59/1119478259.db2.gz PGRGCEKUQMFWOG-SFHVURJKSA-N 1 0 368.521 4.160 20 10 FICDRO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000153156339 1120044839 /nfs/dbraw/zinc/04/48/39/1120044839.db2.gz GEZOREOGAAVWRN-IERDGZPVSA-N 1 0 368.496 4.433 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)c(F)c2)cc1 ZINC000153642379 1121004141 /nfs/dbraw/zinc/00/41/41/1121004141.db2.gz CAAMAOGBCUFHDK-MRXNPFEDSA-N 1 0 352.457 4.318 20 10 FICDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc(N2CCOCC2)cc1Cl ZINC000765756553 1121059787 /nfs/dbraw/zinc/05/97/87/1121059787.db2.gz XNASRJPOSOQWMN-RDJZCZTQSA-N 1 0 356.897 4.167 20 10 FICDRO CCOc1cc2c(cc1C[NH2+]Cc1ccc3c(c1)CCCO3)O[C@@H](C)C2 ZINC001649054813 1121361638 /nfs/dbraw/zinc/36/16/38/1121361638.db2.gz LQRKELPQHLZOQE-HNNXBMFYSA-N 1 0 353.462 4.024 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(Cl)cc43)cc2)CC1 ZINC000763395266 1121572186 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FICDRO Oc1cc(OCc2ccccc2)ccc1CN1CCCC[C@H]1c1ncc[nH]1 ZINC000183028698 1125722428 /nfs/dbraw/zinc/72/24/28/1125722428.db2.gz JQWFRKPYGDQATN-FQEVSTJZSA-N 1 0 363.461 4.422 20 10 FICDRO CC(C)(C)c1ncc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)s1 ZINC000160195385 1079586936 /nfs/dbraw/zinc/58/69/36/1079586936.db2.gz QMMKNXKEDRVQHV-MRXNPFEDSA-N 1 0 360.523 4.327 20 10 FICDRO C[C@@](O)(C[NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccsc1 ZINC000183157812 1125761935 /nfs/dbraw/zinc/76/19/35/1125761935.db2.gz UUCIHPNNBNPXIK-OAQYLSRUSA-N 1 0 369.486 4.030 20 10 FICDRO CCc1cc(C[NH+]2CCN(Cc3cscn3)CC2)c(O)c(C(C)(C)C)c1 ZINC000748069789 1079780986 /nfs/dbraw/zinc/78/09/86/1079780986.db2.gz QRMYLEAVBQWHNH-UHFFFAOYSA-N 1 0 373.566 4.026 20 10 FICDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(N2CCOCC2)cc1Cl ZINC000120414341 1080041059 /nfs/dbraw/zinc/04/10/59/1080041059.db2.gz IFWYXFFXTHANJP-KBXCAEBGSA-N 1 0 354.947 4.113 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000160272704 1080701189 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CN(C)c1ccc(C[NH2+]Cc2ccc(Br)c(Cl)c2)cc1 ZINC000234265554 1082134742 /nfs/dbraw/zinc/13/47/42/1082134742.db2.gz FSCJWURGHFPTAJ-UHFFFAOYSA-N 1 0 353.691 4.458 20 10 FICDRO COc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1C(C)C ZINC001167437676 1082205632 /nfs/dbraw/zinc/20/56/32/1082205632.db2.gz YZYXGOMTRTVURX-UHFFFAOYSA-N 1 0 353.510 4.183 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc(-c4cccs4)nc3)cc2)CC1 ZINC001167437649 1082205720 /nfs/dbraw/zinc/20/57/20/1082205720.db2.gz XIRJSFAYTRUKHF-UHFFFAOYSA-N 1 0 364.518 4.174 20 10 FICDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1 ZINC000588405944 1082439830 /nfs/dbraw/zinc/43/98/30/1082439830.db2.gz JARGEPDPPCEHKM-LJEUOOAZSA-N 1 0 366.461 4.124 20 10 FICDRO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469549 1082654745 /nfs/dbraw/zinc/65/47/45/1082654745.db2.gz ZGEKEZRRTKRIPZ-TZIWHRDSSA-N 1 0 350.506 4.210 20 10 FICDRO CC[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@H](C)c1cccc(OC)c1 ZINC000179470095 1083472115 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/nfs/dbraw/zinc/29/35/09/1094293509.db2.gz MVMREOFYNGHACP-HXUWFJFHSA-N 1 0 352.478 4.064 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(C)cc1O ZINC000280278023 1094324102 /nfs/dbraw/zinc/32/41/02/1094324102.db2.gz YIEYAIMPDWZYND-HNAYVOBHSA-N 1 0 354.450 4.459 20 10 FICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)c(O)c1C ZINC000273361159 1096255591 /nfs/dbraw/zinc/25/55/91/1096255591.db2.gz DAANMSQRMQZADD-MRXNPFEDSA-N 1 0 355.482 4.390 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc(OC)c1OC ZINC000273401636 1096259140 /nfs/dbraw/zinc/25/91/40/1096259140.db2.gz NEQDCIDHVWIMRE-NEPJUHHUSA-N 1 0 365.857 4.483 20 10 FICDRO C[C@@H]([NH2+]Cc1cccc(C(=O)NC2CC2)c1)c1ccc2ccccc2c1O ZINC000273607363 1096278341 /nfs/dbraw/zinc/27/83/41/1096278341.db2.gz UPORSEIGLJNFJD-OAHLLOKOSA-N 1 0 360.457 4.288 20 10 FICDRO COc1cccc(C[NH2+][C@H](COc2ccccc2F)c2ccccc2)c1O ZINC000237421430 1099495158 /nfs/dbraw/zinc/49/51/58/1099495158.db2.gz HSBAVIIGZDAVHJ-LJQANCHMSA-N 1 0 367.420 4.450 20 10 FICDRO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1cc(Cl)ccc1O ZINC000186643123 1101775163 /nfs/dbraw/zinc/77/51/63/1101775163.db2.gz RAPYTGBRIZWZFX-HXPMCKFVSA-N 1 0 359.832 4.358 20 10 FICDRO Cc1cc(C[NH2+]Cc2ccc(-n3cncn3)cc2)c(C)n1-c1cccc(C)c1 ZINC000729681301 1103045482 /nfs/dbraw/zinc/04/54/82/1103045482.db2.gz PLZBJHUJFRNLNK-UHFFFAOYSA-N 1 0 371.488 4.273 20 10 FICDRO CCOC(=O)N(C)C1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000726966644 1104753063 /nfs/dbraw/zinc/75/30/63/1104753063.db2.gz MWITYELFFPMTBQ-UHFFFAOYSA-N 1 0 362.514 4.051 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c1 ZINC000760037092 1104926031 /nfs/dbraw/zinc/92/60/31/1104926031.db2.gz HETRDOFFOOMZOD-USCONSEESA-N 1 0 357.469 4.264 20 10 FICDRO CC[C@H]([NH2+]C[C@]1(CO)C[C@H]1c1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000760039981 1105015744 /nfs/dbraw/zinc/01/57/44/1105015744.db2.gz HRBXQSOOFSWUQW-FKBYEOEOSA-N 1 0 356.485 4.099 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@]2(CO)C[C@H]2c2ccc(F)cc2)cc1 ZINC000760040433 1105016622 /nfs/dbraw/zinc/01/66/22/1105016622.db2.gz KCOLBTDCYDEOMZ-SSKFGXFMSA-N 1 0 356.485 4.099 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c(O)c1 ZINC000760041110 1105036623 /nfs/dbraw/zinc/03/66/23/1105036623.db2.gz VUTMBKNEXVRWJM-WQTXXOFMSA-N 1 0 357.469 4.264 20 10 FICDRO Clc1ccnc2c1CC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000924707619 1111799734 /nfs/dbraw/zinc/79/97/34/1111799734.db2.gz NKZABAMXVVZRBY-GOSISDBHSA-N 1 0 359.926 4.065 20 10 FICDRO CC(=O)NCCc1ccc([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000479457795 1112030616 /nfs/dbraw/zinc/03/06/16/1112030616.db2.gz SEXHQZMNXPTTBZ-KRWDZBQOSA-N 1 0 363.505 4.016 20 10 FICDRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160547508 1113404429 /nfs/dbraw/zinc/40/44/29/1113404429.db2.gz YTXKYQHWSZTAOY-AWEZNQCLSA-N 1 0 352.507 4.430 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CCC(O)CC1)c1ccccc1O ZINC000155827987 1113887339 /nfs/dbraw/zinc/88/73/39/1113887339.db2.gz RGNZFTRHEMMISN-MGPUTAFESA-N 1 0 372.484 4.294 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CCC(O)CC1)c1ccccc1O ZINC000155827882 1113887526 /nfs/dbraw/zinc/88/75/26/1113887526.db2.gz RGNZFTRHEMMISN-YWZLYKJASA-N 1 0 372.484 4.294 20 10 FICDRO c1ccc2c(c1)CCSC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163623926 1114243283 /nfs/dbraw/zinc/24/32/83/1114243283.db2.gz KZOOVEJZQCUWKZ-NRFANRHFSA-N 1 0 370.587 4.360 20 10 FICDRO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(N2CCOCC2)c(F)c1 ZINC000151312742 1114340600 /nfs/dbraw/zinc/34/06/00/1114340600.db2.gz VOHMQZZINBVRJS-INIZCTEOSA-N 1 0 367.468 4.037 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)cc1 ZINC000151415842 1114364871 /nfs/dbraw/zinc/36/48/71/1114364871.db2.gz UHGKFQVCAUZWQN-TZIWHRDSSA-N 1 0 362.583 4.457 20 10 FICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCCN(C(=O)c3cccc(Cl)c3)CC2)c1 ZINC000164201930 1114443578 /nfs/dbraw/zinc/44/35/78/1114443578.db2.gz ZKNCOMXEHDVBHG-UHFFFAOYSA-N 1 0 372.896 4.011 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCC2=O)cc1)c1ccc(N(C)C)cc1 ZINC000156808157 1114595190 /nfs/dbraw/zinc/59/51/90/1114595190.db2.gz VBJMYCMJHHKAKB-IAGOWNOFSA-N 1 0 351.494 4.291 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000227436609 1115564660 /nfs/dbraw/zinc/56/46/60/1115564660.db2.gz QBNKWOZYYRJCBI-UHFFFAOYSA-N 1 0 352.194 4.365 20 10 FICDRO CCOC1CC[NH+](Cc2c(O)ccc3cc(Br)ccc32)CC1 ZINC000060445618 1115640026 /nfs/dbraw/zinc/64/00/26/1115640026.db2.gz KXMZJJZKEPQBSZ-UHFFFAOYSA-N 1 0 364.283 4.309 20 10 FICDRO CCCCCn1cc(C[NH2+]Cc2cc(Cl)cc(OC)c2O)c(C)n1 ZINC000761216793 1115647300 /nfs/dbraw/zinc/64/73/00/1115647300.db2.gz XNAADPZDZAQFTJ-UHFFFAOYSA-N 1 0 351.878 4.039 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccccc2Br)c1O ZINC000228672689 1115706518 /nfs/dbraw/zinc/70/65/18/1115706518.db2.gz WSJIOXRDNNGNNN-UHFFFAOYSA-N 1 0 356.647 4.107 20 10 FICDRO COc1cc(Br)cc(C[NH2+]C2(c3ccccc3)CCC2)c1O ZINC000171129225 1115838723 /nfs/dbraw/zinc/83/87/23/1115838723.db2.gz FHTYTLOQQBXQPT-UHFFFAOYSA-N 1 0 362.267 4.332 20 10 FICDRO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000172676992 1115972015 /nfs/dbraw/zinc/97/20/15/1115972015.db2.gz KHGOZOLDAASCMQ-INIZCTEOSA-N 1 0 367.518 4.326 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000463250139 1118049625 /nfs/dbraw/zinc/04/96/25/1118049625.db2.gz ZXNASYXMQIYYKK-UHFFFAOYSA-N 1 0 361.533 4.283 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(C)cc1 ZINC000151562244 1118527893 /nfs/dbraw/zinc/52/78/93/1118527893.db2.gz BLPJHRQFBGYBCS-QHCPKHFHSA-N 1 0 352.522 4.445 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cc(F)ccc1F ZINC000151569040 1118781002 /nfs/dbraw/zinc/78/10/02/1118781002.db2.gz VTJZZHKOLQZQQJ-JOCHJYFZSA-N 1 0 374.475 4.414 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H]3CCCc4ccccc43)cc2)CC1 ZINC000151587921 1118939417 /nfs/dbraw/zinc/93/94/17/1118939417.db2.gz YZPYDDZKKYMSDX-QHCPKHFHSA-N 1 0 350.506 4.063 20 10 FICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000151588941 1118941779 /nfs/dbraw/zinc/94/17/79/1118941779.db2.gz RROFNWLZHKLGIJ-SFHVURJKSA-N 1 0 368.521 4.145 20 10 FICDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1ccc(N(C)C)cc1 ZINC000152047610 1119068868 /nfs/dbraw/zinc/06/88/68/1119068868.db2.gz IVFZEZWOVQQSDH-KRWDZBQOSA-N 1 0 356.485 4.291 20 10 FICDRO CCCCCNC(=O)C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000152987447 1119799021 /nfs/dbraw/zinc/79/90/21/1119799021.db2.gz IBDCOZXUTNHNQF-UHFFFAOYSA-N 1 0 371.569 4.195 20 10 FICDRO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000153156548 1120044888 /nfs/dbraw/zinc/04/48/88/1120044888.db2.gz GEZOREOGAAVWRN-IIBYNOLFSA-N 1 0 368.496 4.433 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N2CCOCC2)cc1Cl ZINC000130313797 1120305217 /nfs/dbraw/zinc/30/52/17/1120305217.db2.gz SGBGPQKWUQBNET-VBKZILBWSA-N 1 0 372.896 4.220 20 10 FICDRO C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1cc(Cl)ccc1O ZINC000762641294 1120942808 /nfs/dbraw/zinc/94/28/08/1120942808.db2.gz HAXYQOQHXOWMBY-WWGRRREGSA-N 1 0 368.905 4.342 20 10 FICDRO COc1cccc(C[N@H+]2CC=C(c3cccc(Br)c3)CC2)c1O ZINC000762792032 1120963436 /nfs/dbraw/zinc/96/34/36/1120963436.db2.gz ZUYHJYNEHWDEBO-UHFFFAOYSA-N 1 0 374.278 4.453 20 10 FICDRO C[C@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@@H]1CCOC1 ZINC000763117305 1121132549 /nfs/dbraw/zinc/13/25/49/1121132549.db2.gz WDHJLYYROXPNIO-JKSUJKDBSA-N 1 0 352.438 4.055 20 10 FICDRO CC[C@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000763388815 1121568819 /nfs/dbraw/zinc/56/88/19/1121568819.db2.gz AEKKZRAQTVIUQA-HXUWFJFHSA-N 1 0 368.521 4.415 20 10 FICDRO CN(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001649091638 1121721941 /nfs/dbraw/zinc/72/19/41/1121721941.db2.gz SWZJBYWAVCCOIN-SFTDATJTSA-N 1 0 357.567 4.347 20 10 FICDRO FC(F)(F)CO[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000916836701 1121876717 /nfs/dbraw/zinc/87/67/17/1121876717.db2.gz KJSSRVVOUCPMRS-SFHVURJKSA-N 1 0 356.432 4.220 20 10 FICDRO Fc1cc(C[NH2+]C2CCC(c3ccccc3)CC2)ccc1N1CCOCC1 ZINC000916836458 1121877787 /nfs/dbraw/zinc/87/77/87/1121877787.db2.gz IKFAPTOATNCGTG-UHFFFAOYSA-N 1 0 368.496 4.478 20 10 FICDRO CCS(=O)(=O)c1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000186373550 1122067433 /nfs/dbraw/zinc/06/74/33/1122067433.db2.gz SNJIHJJQALYMOQ-HNNXBMFYSA-N 1 0 369.486 4.190 20 10 FICDRO CCN(Cc1ccccc1)C(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074827 1122068341 /nfs/dbraw/zinc/06/83/41/1122068341.db2.gz HIFXVNNQGMYQSP-UHFFFAOYSA-N 1 0 367.537 4.012 20 10 FICDRO CCc1ccccc1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074867 1122069254 /nfs/dbraw/zinc/06/92/54/1122069254.db2.gz IXTXDVZBXJEEFD-UHFFFAOYSA-N 1 0 353.510 4.164 20 10 FICDRO Clc1ccccc1[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCC1 ZINC000917392796 1122286419 /nfs/dbraw/zinc/28/64/19/1122286419.db2.gz MPNLAAYKQJROFD-FQEVSTJZSA-N 1 0 356.897 4.202 20 10 FICDRO Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000917513682 1122342104 /nfs/dbraw/zinc/34/21/04/1122342104.db2.gz QQAPJBKEQRJEJY-UHFFFAOYSA-N 1 0 353.491 4.470 20 10 FICDRO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cccc(-n2cccn2)c1 ZINC000154710407 1122634505 /nfs/dbraw/zinc/63/45/05/1122634505.db2.gz QWPUHWFLUJYWFX-UHFFFAOYSA-N 1 0 359.429 4.373 20 10 FICDRO C[C@H](COc1ccccc1C(F)(F)F)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000920182351 1123398874 /nfs/dbraw/zinc/39/88/74/1123398874.db2.gz MLNARZASYQHMFU-CYBMUJFWSA-N 1 0 351.368 4.197 20 10 FICDRO CN(C)[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1cccc(F)c1 ZINC000920956889 1123542203 /nfs/dbraw/zinc/54/22/03/1123542203.db2.gz ZQSRNBAYWRCJAS-JOCHJYFZSA-N 1 0 355.501 4.209 20 10 FICDRO CC[C@H]([NH2+]CC1(N2CCC(OC)CC2)CCCC1)c1ccc(N(C)C)cc1 ZINC000765859303 1124282451 /nfs/dbraw/zinc/28/24/51/1124282451.db2.gz JZGFUEJMJGTHMW-QFIPXVFZSA-N 1 0 373.585 4.217 20 10 FICDRO CCOc1ccc(Oc2cc(C[NH2+]Cc3cc(F)ccc3O)ccn2)cc1 ZINC000180492509 1124352393 /nfs/dbraw/zinc/35/23/93/1124352393.db2.gz DEIQQWOLCGURRU-UHFFFAOYSA-N 1 0 368.408 4.407 20 10 FICDRO CCN(CC)C(=O)CCC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000181424383 1124918029 /nfs/dbraw/zinc/91/80/29/1124918029.db2.gz BUZRVKDFWJCNCI-UHFFFAOYSA-N 1 0 368.521 4.406 20 10 FICDRO Cc1ccccc1C[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000069714800 1125121086 /nfs/dbraw/zinc/12/10/86/1125121086.db2.gz QVFMVOSOLIBWFG-UHFFFAOYSA-N 1 0 364.411 4.140 20 10 FICDRO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000182242407 1125297428 /nfs/dbraw/zinc/29/74/28/1125297428.db2.gz DTICLPWXSWQYMB-HNNXBMFYSA-N 1 0 358.432 4.141 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(Cc3ccccc3)n2)c1 ZINC000182344639 1125426253 /nfs/dbraw/zinc/42/62/53/1125426253.db2.gz MKXCFQQFKHFVLH-CQSZACIVSA-N 1 0 354.475 4.299 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1)c1cc(Br)ccc1O ZINC000019909160 220304465 /nfs/dbraw/zinc/30/44/65/220304465.db2.gz KPMMONOLXLBQNG-MRXNPFEDSA-N 1 0 350.256 4.404 20 10 FICDRO Cc1cccc(C[NH2+]Cc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c1O ZINC000182618544 1125581486 /nfs/dbraw/zinc/58/14/86/1125581486.db2.gz HXTCLEDULJZVKD-UHFFFAOYSA-N 1 0 364.420 4.382 20 10 FICDRO C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccc(N(C)C)cc1 ZINC000183078038 1125737132 /nfs/dbraw/zinc/73/71/32/1125737132.db2.gz GKTZBGANLRNVRW-GOSISDBHSA-N 1 0 367.537 4.130 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1cnc(C2CCC2)s1)C[C@H]1CCCO1 ZINC000160203704 1079603601 /nfs/dbraw/zinc/60/36/01/1079603601.db2.gz DYLZAQAAKVTFQE-QGZVFWFLSA-N 1 0 358.507 4.297 20 10 FICDRO C[N@@H+](CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C[C@@H]1CCCOC1 ZINC000255033051 1080441946 /nfs/dbraw/zinc/44/19/46/1080441946.db2.gz PKBPFVLKVKMMJO-KRWDZBQOSA-N 1 0 366.465 4.399 20 10 FICDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)c1O ZINC000275266710 1080648132 /nfs/dbraw/zinc/64/81/32/1080648132.db2.gz BGDUHTPVPXCZMU-MNOVXSKESA-N 1 0 367.291 4.116 20 10 FICDRO CN(Cc1cccs1)c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC001648819244 1081244806 /nfs/dbraw/zinc/24/48/06/1081244806.db2.gz UFKYLXPWXKJDTB-RTWAWAEBSA-N 1 0 355.551 4.101 20 10 FICDRO CC(C)(C)Oc1cccc(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)c1 ZINC001648835417 1081276576 /nfs/dbraw/zinc/27/65/76/1081276576.db2.gz NKAKGPIDJXUKNW-UHFFFAOYSA-N 1 0 372.484 4.129 20 10 FICDRO COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000796675262 1081626893 /nfs/dbraw/zinc/62/68/93/1081626893.db2.gz LDJZCAGPQDUCRO-HSZRJFAPSA-N 1 0 361.489 4.230 20 10 FICDRO Oc1cc2c(cc1C[NH2+]C1(c3ccc(F)cc3F)CCOCC1)CCCC2 ZINC000160519681 1081969090 /nfs/dbraw/zinc/96/90/90/1081969090.db2.gz LSTATOXOZYPFMF-UHFFFAOYSA-N 1 0 373.443 4.345 20 10 FICDRO CCN(CC)c1c(F)cccc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167437326 1082199438 /nfs/dbraw/zinc/19/94/38/1082199438.db2.gz QGIXNEZFUCOQJJ-UHFFFAOYSA-N 1 0 370.516 4.036 20 10 FICDRO COc1ccccc1[C@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178443424 1083705318 /nfs/dbraw/zinc/70/53/18/1083705318.db2.gz HOYAQIBQJJWEGR-LAUBAEHRSA-N 1 0 354.494 4.070 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(OC)cc1 ZINC000151573698 1083724132 /nfs/dbraw/zinc/72/41/32/1083724132.db2.gz WGGRQLYBJAZPBJ-QHCPKHFHSA-N 1 0 368.521 4.145 20 10 FICDRO Cc1noc(C[C@@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)c2ccccc2)n1 ZINC000277032462 1083724304 /nfs/dbraw/zinc/72/43/04/1083724304.db2.gz FIBNSQCSKQVAAH-SJKOYZFVSA-N 1 0 357.841 4.372 20 10 FICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1F ZINC000162260406 1083934884 /nfs/dbraw/zinc/93/48/84/1083934884.db2.gz TXZPDNSDZLPMNL-CVEARBPZSA-N 1 0 358.457 4.083 20 10 FICDRO C[C@@H]([NH2+][C@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(N(C)C)cc1 ZINC000156964930 1084279179 /nfs/dbraw/zinc/27/91/79/1084279179.db2.gz ZONOAAPVIQSRBF-HZPDHXFCSA-N 1 0 353.466 4.121 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000178089976 1084668654 /nfs/dbraw/zinc/66/86/54/1084668654.db2.gz UFDVYDCRTSVANT-JLTOFOAXSA-N 1 0 358.432 4.140 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(C)c1OC ZINC000796722372 1085048549 /nfs/dbraw/zinc/04/85/49/1085048549.db2.gz DRDHLZNVKXKHOP-MRXNPFEDSA-N 1 0 354.494 4.245 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2cnc(CC(F)(F)F)s2)cc1 ZINC000892614356 1085057369 /nfs/dbraw/zinc/05/73/69/1085057369.db2.gz HHPWHJBYBGPNQV-UHFFFAOYSA-N 1 0 357.445 4.384 20 10 FICDRO COCc1ccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)cc1 ZINC000124392818 1085148373 /nfs/dbraw/zinc/14/83/73/1085148373.db2.gz JBKSLNWMSVXEDQ-MRXNPFEDSA-N 1 0 374.912 4.174 20 10 FICDRO c1cn(Cc2ccccc2C[NH2+]Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000075758097 1085545970 /nfs/dbraw/zinc/54/59/70/1085545970.db2.gz CSOKISSIMGJVQE-UHFFFAOYSA-N 1 0 360.505 4.212 20 10 FICDRO C[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000178643613 1085603592 /nfs/dbraw/zinc/60/35/92/1085603592.db2.gz YONSXOGLESLNBT-KNQAVFIVSA-N 1 0 352.522 4.494 20 10 FICDRO C[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1cc(Br)ccc1O ZINC000756757839 1085772172 /nfs/dbraw/zinc/77/21/72/1085772172.db2.gz FJNFJWGRLSJTAT-WOSRLPQWSA-N 1 0 356.304 4.137 20 10 FICDRO COc1ccccc1[C@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178443435 1085774013 /nfs/dbraw/zinc/77/40/13/1085774013.db2.gz HOYAQIBQJJWEGR-DYESRHJHSA-N 1 0 354.494 4.070 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1nc2c(s1)CCCC2 ZINC000093399223 1085777024 /nfs/dbraw/zinc/77/70/24/1085777024.db2.gz RQNZFMBYVVPMER-OAHLLOKOSA-N 1 0 373.591 4.426 20 10 FICDRO C[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)c1ccc(Br)cc1O ZINC000756761672 1085800164 /nfs/dbraw/zinc/80/01/64/1085800164.db2.gz USMZUZPMYWESLA-ZENOOKHLSA-N 1 0 356.304 4.137 20 10 FICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCc3c2cccc3Br)c1 ZINC000105491785 1086561141 /nfs/dbraw/zinc/56/11/41/1086561141.db2.gz OUCUBNWLTMWVJT-QGZVFWFLSA-N 1 0 362.267 4.331 20 10 FICDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc21 ZINC000178536268 1086722077 /nfs/dbraw/zinc/72/20/77/1086722077.db2.gz SCKARFNCGOWKQZ-OAQYLSRUSA-N 1 0 368.496 4.299 20 10 FICDRO C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)c1cncc(F)c1 ZINC000157743170 1086974285 /nfs/dbraw/zinc/97/42/85/1086974285.db2.gz NVHFGKKUDQOQFG-ZDUSSCGKSA-N 1 0 365.399 4.142 20 10 FICDRO CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000236592081 1088385087 /nfs/dbraw/zinc/38/50/87/1088385087.db2.gz LNPBJYRZNCGJPJ-UHFFFAOYSA-N 1 0 356.485 4.163 20 10 FICDRO CC[C@@H]([NH2+]C[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O ZINC000311295552 1088535208 /nfs/dbraw/zinc/53/52/08/1088535208.db2.gz COYJSILFMIDZMV-DYESRHJHSA-N 1 0 362.514 4.470 20 10 FICDRO CC(C)N(C(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2)C1CCC1 ZINC000435853223 1089974370 /nfs/dbraw/zinc/97/43/70/1089974370.db2.gz BOPNKYQTNYPFJI-UHFFFAOYSA-N 1 0 367.537 4.197 20 10 FICDRO Cc1cscc1NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000435905224 1089995977 /nfs/dbraw/zinc/99/59/77/1089995977.db2.gz DOISWUWGCXLDQW-UHFFFAOYSA-N 1 0 367.518 4.416 20 10 FICDRO Oc1ccc(F)cc1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000180547372 1090214812 /nfs/dbraw/zinc/21/48/12/1090214812.db2.gz PMLKYVGTTDBVLP-UHFFFAOYSA-N 1 0 374.419 4.069 20 10 FICDRO C[C@@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc2ccccc2c1O ZINC000312218002 1090433023 /nfs/dbraw/zinc/43/30/23/1090433023.db2.gz UXYKVRAXIMWATK-KUHUBIRLSA-N 1 0 370.493 4.499 20 10 FICDRO C[C@@H]([NH2+]Cc1cccnc1OCC(F)F)c1ccc2ccccc2c1O ZINC000186199274 1090622555 /nfs/dbraw/zinc/62/25/55/1090622555.db2.gz ZAZHNCNYOYIFDL-CYBMUJFWSA-N 1 0 358.388 4.435 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCO[C@H](c4ccccc4)C3)CC2)cc1 ZINC000364047479 1090724136 /nfs/dbraw/zinc/72/41/36/1090724136.db2.gz IRORGZYZDCHMJQ-OFNKIYASSA-N 1 0 366.505 4.174 20 10 FICDRO CCc1nc(C[NH2+][C@@H](C)c2cc(Br)c(F)cc2[O-])cs1 ZINC000756549539 1091001108 /nfs/dbraw/zinc/00/11/08/1091001108.db2.gz GKOXCWBVXNCZOH-QMMMGPOBSA-N 1 0 359.264 4.164 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ccnc(OC)c2)cc1 ZINC000236966855 1093237678 /nfs/dbraw/zinc/23/76/78/1093237678.db2.gz SLOGILFHKUQLNS-UHFFFAOYSA-N 1 0 361.489 4.407 20 10 FICDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1Br ZINC000783517569 1093358586 /nfs/dbraw/zinc/35/85/86/1093358586.db2.gz LHNXPSWPDQYCEG-STQMWFEESA-N 1 0 350.256 4.273 20 10 FICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccc(Br)cc1)c1ccccc1O ZINC000783517602 1093376502 /nfs/dbraw/zinc/37/65/02/1093376502.db2.gz LPMYUMWNTYWEMW-QWHCGFSZSA-N 1 0 350.256 4.273 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]C[C@@H](C)CSc2ccccc2OC)c1 ZINC000237043687 1093715893 /nfs/dbraw/zinc/71/58/93/1093715893.db2.gz AUYHGMLBBWROLR-OAHLLOKOSA-N 1 0 361.507 4.318 20 10 FICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(COCC(F)(F)F)cc2)c1O ZINC000894168074 1093781688 /nfs/dbraw/zinc/78/16/88/1093781688.db2.gz VYPDVHJDBUCELY-UHFFFAOYSA-N 1 0 369.383 4.078 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc(OC)c1OC ZINC000273297643 1096248225 /nfs/dbraw/zinc/24/82/25/1096248225.db2.gz ANWDHOUIZKYEJI-LSDHHAIUSA-N 1 0 359.466 4.447 20 10 FICDRO Cc1ccc([C@H](C)[NH2+][C@H](CN2CCCC2=O)c2ccccc2)c(O)c1C ZINC000273362673 1096255685 /nfs/dbraw/zinc/25/56/85/1096255685.db2.gz DHNFEVFNYKDARX-FXAWDEMLSA-N 1 0 352.478 4.023 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc2ccccc2c1O ZINC000273409098 1096260035 /nfs/dbraw/zinc/26/00/35/1096260035.db2.gz PGIKBJPOXGVGBE-QGZVFWFLSA-N 1 0 362.473 4.233 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1cc2c(cc1O)CCCC2 ZINC000273473358 1096265542 /nfs/dbraw/zinc/26/55/42/1096265542.db2.gz KCTMOSXRRJECOI-AYNSBQOLSA-N 1 0 357.519 4.420 20 10 FICDRO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273517921 1096269450 /nfs/dbraw/zinc/26/94/50/1096269450.db2.gz SXBIEZUKXYSVTC-YJBOKZPZSA-N 1 0 361.551 4.366 20 10 FICDRO COc1ccc([C@@H](NCc2c(C)c3ccccc3n2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000423086706 1096570347 /nfs/dbraw/zinc/57/03/47/1096570347.db2.gz NTAKSCUXANQFSK-NZQKXSOJSA-N 1 0 363.505 4.078 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000760326404 1101916715 /nfs/dbraw/zinc/91/67/15/1101916715.db2.gz OTALVZDELPKLEO-KRWDZBQOSA-N 1 0 363.274 4.431 20 10 FICDRO Cn1cccc1C[N@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC000760408837 1101961116 /nfs/dbraw/zinc/96/11/16/1101961116.db2.gz UXQNQKAEVURBHX-UHFFFAOYSA-N 1 0 359.267 4.278 20 10 FICDRO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001168179551 1102022021 /nfs/dbraw/zinc/02/20/21/1102022021.db2.gz KYQFPZPWSYMRRF-QGZVFWFLSA-N 1 0 358.913 4.240 20 10 FICDRO C[N@H+](CCC(=O)Nc1ccccc1F)Cc1ccc(N2CCCCC2)cc1 ZINC000054428416 1102236125 /nfs/dbraw/zinc/23/61/25/1102236125.db2.gz YPWCYERTQKGEHU-UHFFFAOYSA-N 1 0 369.484 4.277 20 10 FICDRO Cc1cc(CN2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001168193582 1102274325 /nfs/dbraw/zinc/27/43/25/1102274325.db2.gz RSRQMQSGINIXCZ-PMACEKPBSA-N 1 0 351.538 4.156 20 10 FICDRO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1C(F)(F)F)c1ccc(Cl)cc1O ZINC000841748389 1103184133 /nfs/dbraw/zinc/18/41/33/1103184133.db2.gz XNYGNYYHCXXUQS-QLJPJBMISA-N 1 0 359.775 4.449 20 10 FICDRO COC1CCC(CC[NH2+][C@@H](C)c2ccc(Br)cc2O)CC1 ZINC000757683467 1103185195 /nfs/dbraw/zinc/18/51/95/1103185195.db2.gz YUJNIRBJDPHCOE-OPFPJEHXSA-N 1 0 356.304 4.401 20 10 FICDRO Oc1ccccc1C[N@H+](C[C@@H]1CCCO1)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001167984667 1103214231 /nfs/dbraw/zinc/21/42/31/1103214231.db2.gz VNSRXORLRPDMST-QNWVGRARSA-N 1 0 367.489 4.294 20 10 FICDRO COCC1CCC([NH2+][C@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000840875513 1106967576 /nfs/dbraw/zinc/96/75/76/1106967576.db2.gz HVDOEWORQOITKO-DNOWBOINSA-N 1 0 356.304 4.319 20 10 FICDRO C[N@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(N2CCOCC2)cc1 ZINC000121299692 1107008200 /nfs/dbraw/zinc/00/82/00/1107008200.db2.gz HAVILTHFKLFMKU-UHFFFAOYSA-N 1 0 371.550 4.269 20 10 FICDRO C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(-c2ccccn2)c1 ZINC000121314651 1107692849 /nfs/dbraw/zinc/69/28/49/1107692849.db2.gz GLBDVQRJDQSKON-UHFFFAOYSA-N 1 0 373.500 4.217 20 10 FICDRO COc1ccc([C@@H]([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C2CC2)cn1 ZINC000528044857 1109897627 /nfs/dbraw/zinc/89/76/27/1109897627.db2.gz VYHGFJRVHJLEPZ-PEBXRYMYSA-N 1 0 352.478 4.477 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CCC(O)CC1)c1ccccc1O ZINC000155828211 1113887167 /nfs/dbraw/zinc/88/71/67/1113887167.db2.gz RGNZFTRHEMMISN-FOIQADDNSA-N 1 0 372.484 4.294 20 10 FICDRO C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000151329835 1114344281 /nfs/dbraw/zinc/34/42/81/1114344281.db2.gz HAZFXGNNMCHFOX-IERDGZPVSA-N 1 0 354.469 4.391 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)cc1 ZINC000151415973 1114364936 /nfs/dbraw/zinc/36/49/36/1114364936.db2.gz UHGKFQVCAUZWQN-CTNGQTDRSA-N 1 0 362.583 4.457 20 10 FICDRO O=[N+]([O-])c1cc(C[NH2+]CCC[C@H]2CCCCO2)ccc1N1CCCCC1 ZINC000760650052 1114402747 /nfs/dbraw/zinc/40/27/47/1114402747.db2.gz IMLBUZAIEAOVNM-GOSISDBHSA-N 1 0 361.486 4.024 20 10 FICDRO C[C@@H](CC[S@](C)=O)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000760698593 1114598967 /nfs/dbraw/zinc/59/89/67/1114598967.db2.gz MLCXGBKWCOXTED-BSEYFRJRSA-N 1 0 353.572 4.234 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cn3cc(Br)cc(C)c3n2)c1 ZINC000760882699 1115120820 /nfs/dbraw/zinc/12/08/20/1115120820.db2.gz ZENYLFRVGAHRTC-ZDUSSCGKSA-N 1 0 374.282 4.270 20 10 FICDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl ZINC000760905891 1115169820 /nfs/dbraw/zinc/16/98/20/1115169820.db2.gz LXMOMSRGAUBACA-FUHWJXTLSA-N 1 0 366.933 4.177 20 10 FICDRO CC[C@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1O ZINC000157966270 1115414964 /nfs/dbraw/zinc/41/49/64/1115414964.db2.gz FMELWBNAQVRNFZ-KRWDZBQOSA-N 1 0 355.413 4.255 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](OC)c2ccccc2F)c1O ZINC000761214228 1115645725 /nfs/dbraw/zinc/64/57/25/1115645725.db2.gz AGMZNXHBKRSIDU-BBATYDOGSA-N 1 0 353.821 4.059 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C\c2ccc(Cl)s2)SC1=S ZINC000170738279 1115766032 /nfs/dbraw/zinc/76/60/32/1115766032.db2.gz FICRVEIZONLGLE-YRNVUSSQSA-N 1 0 374.984 4.191 20 10 FICDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cc1OC ZINC000171378997 1115863227 /nfs/dbraw/zinc/86/32/27/1115863227.db2.gz VXEZMEHXJRRRCC-INIZCTEOSA-N 1 0 354.494 4.245 20 10 FICDRO COCCCOC1CC[NH+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1 ZINC000172913637 1116003954 /nfs/dbraw/zinc/00/39/54/1116003954.db2.gz BJRMBNFUDIYFLD-UHFFFAOYSA-N 1 0 373.493 4.035 20 10 FICDRO CC(C)c1ccc(/C=C2\SC(=S)N(C3CC[NH+](C)CC3)C2=O)cc1 ZINC000063824446 1116114917 /nfs/dbraw/zinc/11/49/17/1116114917.db2.gz QPIMUIBXIQWPCG-ATVHPVEESA-N 1 0 360.548 4.105 20 10 FICDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2cc(Br)ccc2O)c1 ZINC000800496597 1116168485 /nfs/dbraw/zinc/16/84/85/1116168485.db2.gz WAPLBZZITKNGQP-SNVBAGLBSA-N 1 0 355.663 4.362 20 10 FICDRO C[C@H]([NH2+]CCCNC(=O)c1cccs1)c1ccc(N2CCCCC2)cc1 ZINC000089641070 1116207948 /nfs/dbraw/zinc/20/79/48/1116207948.db2.gz YTDMZGWNDGPJOH-KRWDZBQOSA-N 1 0 371.550 4.209 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cccc(Cl)c1 ZINC000151578459 1118863560 /nfs/dbraw/zinc/86/35/60/1118863560.db2.gz CPPWPIAZNMVJJJ-INIZCTEOSA-N 1 0 358.913 4.400 20 10 FICDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1cc(Br)ccc1O ZINC000761500058 1119400782 /nfs/dbraw/zinc/40/07/82/1119400782.db2.gz RRZGIWDRSNATIP-AEFFLSMTSA-N 1 0 364.283 4.237 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](COCC(C)C)c3ccco3)CC2)cc1 ZINC000152596333 1119458603 /nfs/dbraw/zinc/45/86/03/1119458603.db2.gz PCESWRXQURUOBB-NRFANRHFSA-N 1 0 372.509 4.261 20 10 FICDRO Cc1cccc(C)c1C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000761981131 1120614038 /nfs/dbraw/zinc/61/40/38/1120614038.db2.gz GOCCROQJHMSYRE-SFHVURJKSA-N 1 0 372.896 4.057 20 10 FICDRO CCc1nnc([C@H](C)NCc2ccc(N(CC)Cc3ccccc3)cc2)[nH]1 ZINC000762626745 1120941129 /nfs/dbraw/zinc/94/11/29/1120941129.db2.gz HXINRAYQEFTBOJ-KRWDZBQOSA-N 1 0 363.509 4.244 20 10 FICDRO COc1ccc(N2CCC([NH2+]C3CCC4(COC(C)(C)C4)CC3)CC2)cc1 ZINC001649028660 1121297450 /nfs/dbraw/zinc/29/74/50/1121297450.db2.gz JONJAGRLQDPFKJ-UHFFFAOYSA-N 1 0 372.553 4.382 20 10 FICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccc(-n2ccnn2)cc1 ZINC000186183757 1121397218 /nfs/dbraw/zinc/39/72/18/1121397218.db2.gz MRAROHQBGJIVBD-HOTGVXAUSA-N 1 0 362.477 4.264 20 10 FICDRO COc1cc(C)cc(C[N@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c1O ZINC000916567691 1121551346 /nfs/dbraw/zinc/55/13/46/1121551346.db2.gz NCGRCECEPKYQFS-UHFFFAOYSA-N 1 0 369.461 4.383 20 10 FICDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c(C)c1 ZINC000916837835 1121878485 /nfs/dbraw/zinc/87/84/85/1121878485.db2.gz VOMTZYMPNAWGBX-UHFFFAOYSA-N 1 0 353.466 4.492 20 10 FICDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)o1 ZINC000916837795 1121878981 /nfs/dbraw/zinc/87/89/81/1121878981.db2.gz ZNXQPDDJMCIMST-YIOZNXECSA-N 1 0 372.484 4.446 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)c1 ZINC000186230816 1121970895 /nfs/dbraw/zinc/97/08/95/1121970895.db2.gz ZTKKAWUUVCXAAY-AWEZNQCLSA-N 1 0 357.450 4.207 20 10 FICDRO Cc1cc(CC[NH2+]C[C@@H](O)c2cccc(F)c2)c(C)n1-c1ccccc1 ZINC000916989356 1121991870 /nfs/dbraw/zinc/99/18/70/1121991870.db2.gz HJKZLXMQILTZJO-JOCHJYFZSA-N 1 0 352.453 4.099 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1ccc(N2CCOCC2)cc1 ZINC000090964010 1122060081 /nfs/dbraw/zinc/06/00/81/1122060081.db2.gz FBOULTVHQUKEJH-KSFYIVLOSA-N 1 0 354.469 4.391 20 10 FICDRO Cc1ccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cc1F ZINC000917074648 1122068632 /nfs/dbraw/zinc/06/86/32/1122068632.db2.gz FITTVWVWOQSHHN-UHFFFAOYSA-N 1 0 357.473 4.049 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](c3ccccc3)c3ccccn3)CC2)cc1 ZINC000154622431 1122529124 /nfs/dbraw/zinc/52/91/24/1122529124.db2.gz JMADDMHVRKSGBK-DEOSSOPVSA-N 1 0 373.500 4.438 20 10 FICDRO COc1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cc(OC)c1 ZINC000154716560 1122631640 /nfs/dbraw/zinc/63/16/40/1122631640.db2.gz POGKTLVJZDRIHY-UHFFFAOYSA-N 1 0 353.418 4.205 20 10 FICDRO Cc1cc(C(=O)N2CCC(CC[NH+](C)C)CC2)c(C)n1-c1ccccc1C ZINC000918706561 1122755039 /nfs/dbraw/zinc/75/50/39/1122755039.db2.gz WEEUNFYULJZROX-UHFFFAOYSA-N 1 0 367.537 4.206 20 10 FICDRO COc1cc(C[N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)cc(OC)c1 ZINC000919957651 1123284159 /nfs/dbraw/zinc/28/41/59/1123284159.db2.gz UJLVDZUNIYPIDN-UHFFFAOYSA-N 1 0 359.466 4.045 20 10 FICDRO O=C(CC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1)NC1CCCC1 ZINC000920086359 1123344857 /nfs/dbraw/zinc/34/48/57/1123344857.db2.gz GOPCZOFSQKVHSI-UHFFFAOYSA-N 1 0 366.505 4.206 20 10 FICDRO CCOc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 ZINC000920413742 1123454005 /nfs/dbraw/zinc/45/40/05/1123454005.db2.gz HFZPYHYMGOWQQW-UHFFFAOYSA-N 1 0 369.465 4.274 20 10 FICDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000921070406 1123555463 /nfs/dbraw/zinc/55/54/63/1123555463.db2.gz WPRRQZURHQUKHJ-LJQANCHMSA-N 1 0 352.522 4.369 20 10 FICDRO CCc1cc(C[N@@H+]2CCC[C@@H](c3nc(C)no3)C2)c(O)c(C(C)(C)C)c1 ZINC000921047564 1123557008 /nfs/dbraw/zinc/55/70/08/1123557008.db2.gz ABZUJSPYHVGXFP-MRXNPFEDSA-N 1 0 357.498 4.323 20 10 FICDRO Cc1cc(CN2CCN(C(=O)C3CCCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000921187881 1123580797 /nfs/dbraw/zinc/58/07/97/1123580797.db2.gz RXHQNTWMXODZKA-UHFFFAOYSA-N 1 0 372.553 4.223 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000237542973 1123956773 /nfs/dbraw/zinc/95/67/73/1123956773.db2.gz DTALWWFHHCPIRV-HNNXBMFYSA-N 1 0 364.411 4.393 20 10 FICDRO CC(=O)Nc1cccc2c1CC[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000179529554 1123998785 /nfs/dbraw/zinc/99/87/85/1123998785.db2.gz VAJPISVCDLMNBS-UHFFFAOYSA-N 1 0 363.505 4.194 20 10 FICDRO Oc1ccccc1C[NH2+]C1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000238095874 1124278580 /nfs/dbraw/zinc/27/85/80/1124278580.db2.gz IALADKMJCMCTJY-UHFFFAOYSA-N 1 0 364.411 4.165 20 10 FICDRO Cc1cccc(CNc2ccc(NC(=O)C[NH+]3CCCCCC3)cc2)c1O ZINC000180845122 1124444798 /nfs/dbraw/zinc/44/47/98/1124444798.db2.gz XOBNAROUALJYIG-UHFFFAOYSA-N 1 0 367.493 4.127 20 10 FICDRO CC[N@H+](Cc1ccc(-c2nc(Cc3ccc(N)cc3)no2)cc1)C(C)C ZINC000843160139 1124957466 /nfs/dbraw/zinc/95/74/66/1124957466.db2.gz DTDHPNCFGDJHNX-UHFFFAOYSA-N 1 0 350.466 4.140 20 10 FICDRO CCOc1ccc(O)c(C[NH+]2CCC(OCc3ccc(F)cc3)CC2)c1 ZINC000181531961 1125002627 /nfs/dbraw/zinc/00/26/27/1125002627.db2.gz LGCOMNOMZMZABT-UHFFFAOYSA-N 1 0 359.441 4.111 20 10 FICDRO CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1 ZINC000181963215 1125199716 /nfs/dbraw/zinc/19/97/16/1125199716.db2.gz XCGRVSOIPMAYSB-INIZCTEOSA-N 1 0 369.534 4.049 20 10 FICDRO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@H+](Cc3cccc(C(C)(C)C)c3O)[C@@H]2C1 ZINC001143103383 1125245862 /nfs/dbraw/zinc/24/58/62/1125245862.db2.gz BNDGTRQKCLKZDE-MAUKXSAKSA-N 1 0 374.525 4.131 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@]12CC[N@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143103387 1125245909 /nfs/dbraw/zinc/24/59/09/1125245909.db2.gz BPHQTOCZHCXHJB-QFIPXVFZSA-N 1 0 374.525 4.275 20 10 FICDRO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000132202769 1125401830 /nfs/dbraw/zinc/40/18/30/1125401830.db2.gz DNUZPKLDMONHRZ-INIZCTEOSA-N 1 0 374.912 4.426 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2coc(-c3c(F)cccc3F)n2)c1 ZINC000182424226 1125475251 /nfs/dbraw/zinc/47/52/51/1125475251.db2.gz GXTCNTFYKKXLNJ-NSHDSACASA-N 1 0 360.360 4.185 20 10 FICDRO N#Cc1ccc(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)c(F)c1 ZINC000183153831 1125762221 /nfs/dbraw/zinc/76/22/21/1125762221.db2.gz QDIOFMQZKFVVJX-UHFFFAOYSA-N 1 0 362.404 4.272 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(CN3CCCC3=O)c2)cc1 ZINC000153914430 1079703851 /nfs/dbraw/zinc/70/38/51/1079703851.db2.gz NDPGPGZSQBHJNN-SFHVURJKSA-N 1 0 365.521 4.116 20 10 FICDRO C[C@@H]1C[C@H]1C[N@@H+]1CCc2c(Cl)c(O)c(O)cc2[C@H](c2ccc(O)cc2)C1 ZINC001209433028 1080681730 /nfs/dbraw/zinc/68/17/30/1080681730.db2.gz SNHQFYQFCDYPFA-IAISJRAMSA-N 1 0 373.880 4.103 20 10 FICDRO COc1cc(O)c(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)cc1OC ZINC000160309553 1081239381 /nfs/dbraw/zinc/23/93/81/1081239381.db2.gz JCFUMFDKAKVOMA-HNNXBMFYSA-N 1 0 359.491 4.024 20 10 FICDRO N=c1ccc(/N=N/c2ccccc2)c(N)n1C1=CC[C@H]([NH+]2CCCC2)CC1 ZINC001210706209 1081558846 /nfs/dbraw/zinc/55/88/46/1081558846.db2.gz UYAJLCXWTUKGHM-AFAXFSHOSA-N 1 0 362.481 4.454 20 10 FICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(Br)s3)ccc21 ZINC000050266784 1081988391 /nfs/dbraw/zinc/98/83/91/1081988391.db2.gz JXJSGHREUSFPEY-UHFFFAOYSA-N 1 0 351.313 4.183 20 10 FICDRO CCCNC(=O)c1cccc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)c1 ZINC000160601825 1082090557 /nfs/dbraw/zinc/09/05/57/1082090557.db2.gz DZDOBCYKTOWGKE-OAQYLSRUSA-N 1 0 353.510 4.133 20 10 FICDRO CC[C@@H]([NH2+]CCCc1nnc(SC)n1CC(C)C)c1ccccc1O ZINC000155824127 1082093176 /nfs/dbraw/zinc/09/31/76/1082093176.db2.gz RBTGOGJVXPOIKH-MRXNPFEDSA-N 1 0 362.543 4.035 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3cncc(-c4ccccc4)c3)cc2)CC1 ZINC001167434731 1082139613 /nfs/dbraw/zinc/13/96/13/1082139613.db2.gz URZNXHBUTMRCGU-UHFFFAOYSA-N 1 0 358.489 4.113 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)CCC(C)(C)O4)cc2)CC1 ZINC001167437318 1082199844 /nfs/dbraw/zinc/19/98/44/1082199844.db2.gz PZARNXFUVLTQIM-UHFFFAOYSA-N 1 0 365.521 4.154 20 10 FICDRO CC[C@H]([NH2+][C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000160721536 1082274533 /nfs/dbraw/zinc/27/45/33/1082274533.db2.gz ZHIYLXPVRKTBNX-VXKWHMMOSA-N 1 0 365.521 4.157 20 10 FICDRO Cc1ccc(CC[N@@H+](Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 ZINC001167461509 1082569155 /nfs/dbraw/zinc/56/91/55/1082569155.db2.gz KRBXTNNRTXXFIQ-QHCPKHFHSA-N 1 0 352.522 4.285 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1)c1ccc(N2CCCCCC2)cc1 ZINC000178182756 1082946838 /nfs/dbraw/zinc/94/68/38/1082946838.db2.gz AVCFLCDRSDYIIP-KRWDZBQOSA-N 1 0 351.494 4.017 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1ccc(N2CCCCC2)cc1 ZINC000178210365 1082983618 /nfs/dbraw/zinc/98/36/18/1082983618.db2.gz OOUJRKPKFGIZMJ-QGZVFWFLSA-N 1 0 352.478 4.299 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000684559643 1083352860 /nfs/dbraw/zinc/35/28/60/1083352860.db2.gz MVIBENKVKXFSBC-ZDUSSCGKSA-N 1 0 358.283 4.495 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@H]([NH2+]C(C)C)C2)c(C)n1-c1cccc(C)c1 ZINC000728605804 1083544085 /nfs/dbraw/zinc/54/40/85/1083544085.db2.gz JJCXWUIWZVJVLS-IBGZPJMESA-N 1 0 353.510 4.005 20 10 FICDRO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(OC)c(OC)c3O)oc21 ZINC000892475964 1083595639 /nfs/dbraw/zinc/59/56/39/1083595639.db2.gz MYCNQFSTQDQPKH-CYBMUJFWSA-N 1 0 371.433 4.405 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)c(O)c1OC ZINC000892478707 1083629929 /nfs/dbraw/zinc/62/99/29/1083629929.db2.gz ORYOFPROTHJOFQ-NSHDSACASA-N 1 0 355.356 4.279 20 10 FICDRO CCOCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000167142965 1083633140 /nfs/dbraw/zinc/63/31/40/1083633140.db2.gz LDWFUPOZJPQXSS-GOSISDBHSA-N 1 0 356.510 4.327 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(N(C)C)cc1 ZINC000156964638 1084279043 /nfs/dbraw/zinc/27/90/43/1084279043.db2.gz ZONOAAPVIQSRBF-CVEARBPZSA-N 1 0 353.466 4.121 20 10 FICDRO Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000177746869 1084280438 /nfs/dbraw/zinc/28/04/38/1084280438.db2.gz MGRCOAUKBPCDOI-QGZVFWFLSA-N 1 0 354.542 4.311 20 10 FICDRO CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974572 1084520057 /nfs/dbraw/zinc/52/00/57/1084520057.db2.gz GMLXUUMKAFEVKJ-GOSISDBHSA-N 1 0 365.521 4.356 20 10 FICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)C(C)(C)C ZINC000934287289 1084627905 /nfs/dbraw/zinc/62/79/05/1084627905.db2.gz OENOZNIUODONDG-NRFANRHFSA-N 1 0 353.510 4.104 20 10 FICDRO COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 ZINC000178082939 1084664313 /nfs/dbraw/zinc/66/43/13/1084664313.db2.gz LYMAHWZTQLTWES-KSFYIVLOSA-N 1 0 372.484 4.209 20 10 FICDRO C[C@H]([NH2+]CCCOC[C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000158225387 1084955696 /nfs/dbraw/zinc/95/56/96/1084955696.db2.gz HQBSMMILNKHMHT-VQTJNVASSA-N 1 0 360.542 4.161 20 10 FICDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000180286429 1085000694 /nfs/dbraw/zinc/00/06/94/1085000694.db2.gz AGQSTLUVZPJYDG-GKVSMKOHSA-N 1 0 358.551 4.463 20 10 FICDRO Cc1csc(=O)n1CC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176682740 1085176718 /nfs/dbraw/zinc/17/67/18/1085176718.db2.gz IPEVQQLNLAVFDG-KRWDZBQOSA-N 1 0 368.502 4.187 20 10 FICDRO Cc1cc(C(=O)N(C)C2CC[NH+](C(C)C)CC2)c(C)n1-c1ccc(F)cc1 ZINC000115584418 1085289291 /nfs/dbraw/zinc/28/92/91/1085289291.db2.gz VDBRURHTSHXBME-UHFFFAOYSA-N 1 0 371.500 4.178 20 10 FICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)cc1O ZINC000178408035 1085462377 /nfs/dbraw/zinc/46/23/77/1085462377.db2.gz QEPMUFSDHIBQBK-OAHLLOKOSA-N 1 0 358.457 4.381 20 10 FICDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000121945154 1085788014 /nfs/dbraw/zinc/78/80/14/1085788014.db2.gz JQNKEQKFXNQUOL-GJZGRUSLSA-N 1 0 354.922 4.031 20 10 FICDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)cn1 ZINC000279010458 1086756188 /nfs/dbraw/zinc/75/61/88/1086756188.db2.gz GVVMSWMJESZVDP-HNNXBMFYSA-N 1 0 370.472 4.020 20 10 FICDRO Fc1ccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000780511420 1087486277 /nfs/dbraw/zinc/48/62/77/1087486277.db2.gz ODCJUKBWMUKAAW-TZIWHRDSSA-N 1 0 354.469 4.088 20 10 FICDRO CC(C)[C@@H](C)NC(=O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000255953981 1088242932 /nfs/dbraw/zinc/24/29/32/1088242932.db2.gz ZTUOPFWBSHUNAD-QZTJIDSGSA-N 1 0 354.494 4.116 20 10 FICDRO CC[C@@H]([NH2+]C[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O ZINC000311295559 1088534709 /nfs/dbraw/zinc/53/47/09/1088534709.db2.gz COYJSILFMIDZMV-UTKZUKDTSA-N 1 0 362.514 4.470 20 10 FICDRO COc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)c(O)c1OC ZINC000892906489 1089263328 /nfs/dbraw/zinc/26/33/28/1089263328.db2.gz QJMMQVDITZRCHJ-ZDUSSCGKSA-N 1 0 370.474 4.384 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(OC)c(Br)c2)c1 ZINC000122453770 1089424062 /nfs/dbraw/zinc/42/40/62/1089424062.db2.gz RDSOBOJYNCOONS-LLVKDONJSA-N 1 0 366.255 4.023 20 10 FICDRO CN(c1ccc(C[NH2+][C@@H](c2nccn2C)C2CC2)cc1)C1CCCCC1 ZINC000183260551 1090399809 /nfs/dbraw/zinc/39/98/09/1090399809.db2.gz UKAMBBWIFGFNRW-OAQYLSRUSA-N 1 0 352.526 4.430 20 10 FICDRO C[C@H]([NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccccc1O ZINC000183472507 1090416419 /nfs/dbraw/zinc/41/64/19/1090416419.db2.gz RVDJXUXFPQFEPP-KRWDZBQOSA-N 1 0 370.456 4.491 20 10 FICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)CCC1 ZINC000122978005 1090541565 /nfs/dbraw/zinc/54/15/65/1090541565.db2.gz YKGRBYNIJSZOER-INIZCTEOSA-N 1 0 366.933 4.034 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)c1 ZINC000185469595 1090546610 /nfs/dbraw/zinc/54/66/10/1090546610.db2.gz CBFNDWJPADVXKS-SJORKVTESA-N 1 0 354.494 4.277 20 10 FICDRO CC[C@H]([NH2+]C[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc(N(C)C)cc1 ZINC000188609639 1090928762 /nfs/dbraw/zinc/92/87/62/1090928762.db2.gz IDFWLCOKLFGDRE-RYQLBKOJSA-N 1 0 358.448 4.277 20 10 FICDRO COc1ccc2ccc(O)c(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])c2c1 ZINC000025479188 1091187976 /nfs/dbraw/zinc/18/79/76/1091187976.db2.gz QMYLAALOXIODPA-UHFFFAOYSA-N 1 0 352.390 4.094 20 10 FICDRO CCOC[C@@H]1CC[N@H+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000299738008 1091678761 /nfs/dbraw/zinc/67/87/61/1091678761.db2.gz MNIKTJPLFLFNNR-QGZVFWFLSA-N 1 0 366.465 4.399 20 10 FICDRO Cc1cc(C(=O)N(C)C2CC[NH2+]CC2)c(C)n1-c1cccc(C(C)C)c1 ZINC000236868716 1092097056 /nfs/dbraw/zinc/09/70/56/1092097056.db2.gz ZUPDDGMMZINBIK-UHFFFAOYSA-N 1 0 353.510 4.042 20 10 FICDRO Cc1cccc(C2([NH2+]Cc3ccc(N4CCOCC4)cc3)CCCC2)c1 ZINC000237840439 1092538969 /nfs/dbraw/zinc/53/89/69/1092538969.db2.gz BHDPJXVFQYSCAO-UHFFFAOYSA-N 1 0 350.506 4.391 20 10 FICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cc(OC)c(OC)cc2O)cc1 ZINC000159519619 1093033652 /nfs/dbraw/zinc/03/36/52/1093033652.db2.gz WMTMNGYKNDTCTC-GOSISDBHSA-N 1 0 357.450 4.145 20 10 FICDRO Oc1c(C[NH2+]CC[C@H]2CCC3(CCOCC3)CO2)ccc2ccccc21 ZINC000895800157 1093724496 /nfs/dbraw/zinc/72/44/96/1093724496.db2.gz QMXXPPOSBPVEMP-LJQANCHMSA-N 1 0 355.478 4.001 20 10 FICDRO C[N@H+](Cc1coc2ccc(F)cc12)Cc1ccc(N2CCOCC2)cc1 ZINC001141852650 1093773749 /nfs/dbraw/zinc/77/37/49/1093773749.db2.gz LWOOWVIMXMKCDQ-UHFFFAOYSA-N 1 0 354.425 4.041 20 10 FICDRO COC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)c1cccc(C(F)(F)F)c1 ZINC000237072995 1093819184 /nfs/dbraw/zinc/81/91/84/1093819184.db2.gz FLMBMDSZGCRSAC-KRWDZBQOSA-N 1 0 353.384 4.500 20 10 FICDRO COc1cc(C[NH2+]C[C@H](c2ccc(C)cc2)N(C)C)c(O)c(C(C)(C)C)c1 ZINC001648965181 1094299797 /nfs/dbraw/zinc/29/97/97/1094299797.db2.gz JOPYOCDTIWXSNY-OAQYLSRUSA-N 1 0 370.537 4.399 20 10 FICDRO COc1cc(Br)cc([C@H](C)[NH2+]C[C@@H](C)CC(F)F)c1O ZINC000848555132 1095870168 /nfs/dbraw/zinc/87/01/68/1095870168.db2.gz LWAHHJXDABHCFX-IUCAKERBSA-N 1 0 352.219 4.105 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc(OC)c1OC ZINC000273297635 1096248069 /nfs/dbraw/zinc/24/80/69/1096248069.db2.gz ANWDHOUIZKYEJI-GJZGRUSLSA-N 1 0 359.466 4.447 20 10 FICDRO COc1cc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc(OC)c1OC ZINC000273401644 1096258609 /nfs/dbraw/zinc/25/86/09/1096258609.db2.gz NEQDCIDHVWIMRE-NWDGAFQWSA-N 1 0 365.857 4.483 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1cc2c(cc1O)CCCC2 ZINC000273473362 1096265740 /nfs/dbraw/zinc/26/57/40/1096265740.db2.gz KCTMOSXRRJECOI-SKHRDNQBSA-N 1 0 357.519 4.420 20 10 FICDRO COc1cc(C)cc(C[NH2+]Cc2cccc(COCC(F)(F)F)c2)c1O ZINC000894357532 1100743026 /nfs/dbraw/zinc/74/30/26/1100743026.db2.gz TZFNBQBDJXOYJK-UHFFFAOYSA-N 1 0 369.383 4.078 20 10 FICDRO C[C@@H]([NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccccc1O ZINC000183419078 1101627891 /nfs/dbraw/zinc/62/78/91/1101627891.db2.gz JXHXPYLEFCQWNB-CYBMUJFWSA-N 1 0 365.399 4.126 20 10 FICDRO C[C@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)c1ccc2ccccc2c1O ZINC000184967122 1101683101 /nfs/dbraw/zinc/68/31/01/1101683101.db2.gz PZUSFZYALQBPFO-HNNXBMFYSA-N 1 0 364.445 4.094 20 10 FICDRO C[C@H](Cc1ccc(Cl)cc1)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001168164979 1101752585 /nfs/dbraw/zinc/75/25/85/1101752585.db2.gz GTMRBBWUSCQHCT-MRXNPFEDSA-N 1 0 358.913 4.231 20 10 FICDRO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648985218 1102571211 /nfs/dbraw/zinc/57/12/11/1102571211.db2.gz BGGQUWLCUUKIDA-KKLQWCBXSA-N 1 0 358.570 4.446 20 10 FICDRO COc1ccc2c(c1)CCCCN2C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001168244258 1102598803 /nfs/dbraw/zinc/59/88/03/1102598803.db2.gz LPBHSYPUQYXLAR-KRWDZBQOSA-N 1 0 374.525 4.485 20 10 FICDRO C[C@H]([NH2+]C[C@]1(CO)C[C@H]1c1ccc(F)cc1)c1cc2c(cc1O)CCCC2 ZINC000760041211 1105037356 /nfs/dbraw/zinc/03/73/56/1105037356.db2.gz NYCUQBWBIDOWHW-GNOCETLISA-N 1 0 369.480 4.227 20 10 FICDRO Cc1cc(C(=O)NC2CC[NH+](C(C)C)CC2)c(C)n1-c1cccc(C)c1 ZINC000302708167 1107414662 /nfs/dbraw/zinc/41/46/62/1107414662.db2.gz IVEWEDLXEBDGOG-UHFFFAOYSA-N 1 0 353.510 4.005 20 10 FICDRO CC[C@H](C[NH2+]Cc1cc(Br)cc(OC)c1O)CC(F)(F)F ZINC000840960899 1107982637 /nfs/dbraw/zinc/98/26/37/1107982637.db2.gz XKNDZKFLPFOOEY-VIFPVBQESA-N 1 0 370.209 4.232 20 10 FICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(Br)c(F)c2F)cc1C ZINC000527791981 1109824768 /nfs/dbraw/zinc/82/47/68/1109824768.db2.gz PIMUMXBAWNEEMC-UHFFFAOYSA-N 1 0 356.210 4.340 20 10 FICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(Br)c(F)c2F)c1 ZINC000527790826 1109825074 /nfs/dbraw/zinc/82/50/74/1109825074.db2.gz LEOZTQFJVNUBTF-UHFFFAOYSA-N 1 0 372.209 4.121 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc2cn(C)nc2c1)c1cc(Br)ccc1O ZINC000527960322 1109875330 /nfs/dbraw/zinc/87/53/30/1109875330.db2.gz AXMVKPIUBOABRF-MRXNPFEDSA-N 1 0 374.282 4.282 20 10 FICDRO Cc1cc(Br)cc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1O ZINC000529643877 1110298973 /nfs/dbraw/zinc/29/89/73/1110298973.db2.gz KEEUCLZJGSKIEC-KRWDZBQOSA-N 1 0 361.283 4.489 20 10 FICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163603119 1113983185 /nfs/dbraw/zinc/98/31/85/1113983185.db2.gz ALVKCUQXUQHZRV-QGZVFWFLSA-N 1 0 356.535 4.408 20 10 FICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)c1 ZINC000163606189 1113991394 /nfs/dbraw/zinc/99/13/94/1113991394.db2.gz HCYDFBDFRDWWNM-QGZVFWFLSA-N 1 0 356.535 4.489 20 10 FICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)c(OC)c1 ZINC000163624295 1114243151 /nfs/dbraw/zinc/24/31/51/1114243151.db2.gz QTLXJPAXUKFIEW-INIZCTEOSA-N 1 0 372.534 4.108 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cc2c(s1)CCCC2 ZINC000151063458 1114288215 /nfs/dbraw/zinc/28/82/15/1114288215.db2.gz FAIXJTPPYHWJEF-INIZCTEOSA-N 1 0 356.535 4.314 20 10 FICDRO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(N2CCOCC2)c(F)c1 ZINC000151312785 1114340558 /nfs/dbraw/zinc/34/05/58/1114340558.db2.gz VOHMQZZINBVRJS-MRXNPFEDSA-N 1 0 367.468 4.037 20 10 FICDRO C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000151329710 1114343998 /nfs/dbraw/zinc/34/39/98/1114343998.db2.gz HAZFXGNNMCHFOX-IIBYNOLFSA-N 1 0 354.469 4.391 20 10 FICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)cc1 ZINC000151416044 1114365177 /nfs/dbraw/zinc/36/51/77/1114365177.db2.gz UHGKFQVCAUZWQN-FPOVZHCZSA-N 1 0 362.583 4.457 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@@H](c3cccnc3)C(C)C)CC2)cc1 ZINC000164156987 1114442768 /nfs/dbraw/zinc/44/27/68/1114442768.db2.gz RUSLNEISLFOJPC-JOCHJYFZSA-N 1 0 353.510 4.088 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)CCC2 ZINC000166284707 1114970715 /nfs/dbraw/zinc/97/07/15/1114970715.db2.gz BHCRBKOSFOBYAI-XMMPIXPASA-N 1 0 364.533 4.371 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000157396307 1115104937 /nfs/dbraw/zinc/10/49/37/1115104937.db2.gz NJHNMPOKPXJOBA-INIZCTEOSA-N 1 0 369.465 4.231 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1O ZINC000761191399 1115614686 /nfs/dbraw/zinc/61/46/86/1115614686.db2.gz SJEJJTCLKJNLQG-UHFFFAOYSA-N 1 0 362.813 4.127 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(OC3CCCCC3)CC2)c1O ZINC000761196048 1115617467 /nfs/dbraw/zinc/61/74/67/1115617467.db2.gz UKTVVEBGCYLISY-UHFFFAOYSA-N 1 0 353.890 4.368 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(Nc3cccc(C)c3)CC2)c1O ZINC000761203949 1115620122 /nfs/dbraw/zinc/62/01/22/1115620122.db2.gz ZOSMOABSYXSONJ-UHFFFAOYSA-N 1 0 360.885 4.439 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2cc(Br)ccc2F)c1O ZINC000228670310 1115706746 /nfs/dbraw/zinc/70/67/46/1115706746.db2.gz GQNMHDJHVNBEIP-UHFFFAOYSA-N 1 0 374.637 4.246 20 10 FICDRO CC[C@@H]([NH2+]CCc1csc(C)n1)c1cc(Br)ccc1O ZINC000229546954 1115851952 /nfs/dbraw/zinc/85/19/52/1115851952.db2.gz RKSUUVUCFOINKO-CQSZACIVSA-N 1 0 355.301 4.203 20 10 FICDRO CCC[NH+]1CCC(NC(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 ZINC000061510190 1115861878 /nfs/dbraw/zinc/86/18/78/1115861878.db2.gz HURDGFGTJFLIPA-UHFFFAOYSA-N 1 0 353.510 4.007 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(s1)CCC2 ZINC000151578153 1118863165 /nfs/dbraw/zinc/86/31/65/1118863165.db2.gz FIRSHYVUUDLJEA-INIZCTEOSA-N 1 0 370.562 4.296 20 10 FICDRO COc1ccc(OC)c(C[N@H+](Cc2cc3c(cc2O)CCC3)C2CC2)c1 ZINC000914570225 1120375067 /nfs/dbraw/zinc/37/50/67/1120375067.db2.gz SSCHYMHVUVYKAH-UHFFFAOYSA-N 1 0 353.462 4.063 20 10 FICDRO Cc1cccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000915229494 1120887775 /nfs/dbraw/zinc/88/77/75/1120887775.db2.gz DPMYJVIDRNOKQO-SFHVURJKSA-N 1 0 351.494 4.102 20 10 FICDRO Fc1cc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)ccc1N1CCOCC1 ZINC000762473909 1120913265 /nfs/dbraw/zinc/91/32/65/1120913265.db2.gz AWMSDMBTUACCLQ-HXUWFJFHSA-N 1 0 374.887 4.483 20 10 FICDRO CN1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000762622935 1120940613 /nfs/dbraw/zinc/94/06/13/1120940613.db2.gz GHDWODHQXJNUFO-UTKZUKDTSA-N 1 0 374.887 4.197 20 10 FICDRO COc1ccc(C[N@H+](C)Cc2cc(OC)cc(C(C)(C)C)c2O)c(OC)c1 ZINC000915818299 1121083223 /nfs/dbraw/zinc/08/32/23/1121083223.db2.gz NAZPLTHWSYUIPP-UHFFFAOYSA-N 1 0 373.493 4.348 20 10 FICDRO CCOc1ccc(C[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)o1 ZINC001649029623 1121394206 /nfs/dbraw/zinc/39/42/06/1121394206.db2.gz VTLRBLKPAJVMIZ-UHFFFAOYSA-N 1 0 366.408 4.038 20 10 FICDRO CCOCc1cc(C[NH2+]CCCc2nc3c(s2)CCCC3)ccc1OC ZINC001649059752 1121415408 /nfs/dbraw/zinc/41/54/08/1121415408.db2.gz AQJHOEMKLSHOFX-UHFFFAOYSA-N 1 0 374.550 4.289 20 10 FICDRO CCOc1ccc([C@@H](C)[NH2+]CCCSc2nccs2)cc1[N+](=O)[O-] ZINC000153873953 1121426559 /nfs/dbraw/zinc/42/65/59/1121426559.db2.gz DTYQYSWHVBTYLX-GFCCVEGCSA-N 1 0 367.496 4.283 20 10 FICDRO CC(C)c1ccc(C[C@H]2CC[N@H+](Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 ZINC000763392405 1121575206 /nfs/dbraw/zinc/57/52/06/1121575206.db2.gz HLDKWDUXMLCIEJ-VGOFRKELSA-N 1 0 367.489 4.006 20 10 FICDRO CCc1cccc(C)c1NC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075241 1122070001 /nfs/dbraw/zinc/07/00/01/1122070001.db2.gz SMOUSCYKMFPOIJ-UHFFFAOYSA-N 1 0 367.537 4.473 20 10 FICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cn1c(=O)oc2cc(Cl)ccc21 ZINC000917410958 1122299490 /nfs/dbraw/zinc/29/94/90/1122299490.db2.gz AMNYHYSQCDRFFG-UHFFFAOYSA-N 1 0 373.884 4.182 20 10 FICDRO CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000917470183 1122328090 /nfs/dbraw/zinc/32/80/90/1122328090.db2.gz QRHWPFARVHBODM-GOSISDBHSA-N 1 0 360.542 4.088 20 10 FICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCCN(c4ccccc4)CC3)c2c1 ZINC000917486329 1122332493 /nfs/dbraw/zinc/33/24/93/1122332493.db2.gz XNQAWQQAMUNNAW-UHFFFAOYSA-N 1 0 362.473 4.266 20 10 FICDRO Cc1cc(C(=O)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(Cl)c1 ZINC000919984915 1123300159 /nfs/dbraw/zinc/30/01/59/1123300159.db2.gz WGRCOWZFXGFCAD-ZWKOTPCHSA-N 1 0 371.912 4.104 20 10 FICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 ZINC000237768487 1124064904 /nfs/dbraw/zinc/06/49/04/1124064904.db2.gz QSEHAWPTYGGJOJ-INIZCTEOSA-N 1 0 362.420 4.061 20 10 FICDRO COc1ccc(C(=O)C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)cc1 ZINC000179881146 1124130021 /nfs/dbraw/zinc/13/00/21/1124130021.db2.gz RBPQURQRTIPZMF-UHFFFAOYSA-N 1 0 359.853 4.149 20 10 FICDRO Cc1ccc(NC(=O)NC[C@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179932593 1124144626 /nfs/dbraw/zinc/14/46/26/1124144626.db2.gz PBYMGHALTBIAAW-GOSISDBHSA-N 1 0 367.493 4.043 20 10 FICDRO Cc1cccc(C[N@@H+]2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1O ZINC000179958032 1124163069 /nfs/dbraw/zinc/16/30/69/1124163069.db2.gz CJPJHGRHKKPZBD-KRWDZBQOSA-N 1 0 367.424 4.269 20 10 FICDRO CCC[N@H+](Cc1cc(F)ccc1O)C1CCN(C(=O)c2ccccc2)CC1 ZINC000180019081 1124199678 /nfs/dbraw/zinc/19/96/78/1124199678.db2.gz UDWQMXHHPZDPRI-UHFFFAOYSA-N 1 0 370.468 4.048 20 10 FICDRO Cc1cccc(C[NH2+]Cc2cccc(NC(=O)c3ccc(F)cc3)c2)c1O ZINC000180089864 1124229785 /nfs/dbraw/zinc/22/97/85/1124229785.db2.gz RBRWSUVALVHIPP-UHFFFAOYSA-N 1 0 364.420 4.382 20 10 FICDRO CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC000068535429 1124271684 /nfs/dbraw/zinc/27/16/84/1124271684.db2.gz DBUZUGQVFWSTQU-UHFFFAOYSA-N 1 0 365.521 4.011 20 10 FICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C[C@H](O)c2ccsc2)c1 ZINC000180711143 1124415170 /nfs/dbraw/zinc/41/51/70/1124415170.db2.gz ZCYKWONQIQLOGB-NRFANRHFSA-N 1 0 369.486 4.198 20 10 FICDRO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(N(C)C)cc1 ZINC000765910242 1124419043 /nfs/dbraw/zinc/41/90/43/1124419043.db2.gz YAGCFGBUCFGTMJ-SGTLLEGYSA-N 1 0 353.293 4.444 20 10 FICDRO CCCCOc1ccc([C@H](C)[NH2+]Cc2cc(OC)ccc2O)cc1OC ZINC000180896095 1124469819 /nfs/dbraw/zinc/46/98/19/1124469819.db2.gz YXAIFOHNQVEWFU-HNNXBMFYSA-N 1 0 359.466 4.439 20 10 FICDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(Br)ccc2O)cc1 ZINC000756342543 1124716521 /nfs/dbraw/zinc/71/65/21/1124716521.db2.gz SDOXIBFJIQBPNP-LBPRGKRZSA-N 1 0 350.256 4.057 20 10 FICDRO Cc1cccc(C[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 ZINC000069714772 1125121059 /nfs/dbraw/zinc/12/10/59/1125121059.db2.gz YYIQNOUCGNDECR-UHFFFAOYSA-N 1 0 364.411 4.140 20 10 FICDRO C[C@@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000765968263 1125196710 /nfs/dbraw/zinc/19/67/10/1125196710.db2.gz DBKAVIBLKNQYKO-LJQANCHMSA-N 1 0 371.569 4.366 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(NC(C)=O)cc2)cc1F ZINC000182073822 1125230618 /nfs/dbraw/zinc/23/06/18/1125230618.db2.gz QVPUCOMHEKFQIS-HNNXBMFYSA-N 1 0 357.473 4.481 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(NC(C)=O)cc2)cc1F ZINC000182073847 1125230800 /nfs/dbraw/zinc/23/08/00/1125230800.db2.gz QVPUCOMHEKFQIS-OAHLLOKOSA-N 1 0 357.473 4.481 20 10 FICDRO C[C@H]([NH2+]CCSc1ccccc1F)c1ccc(N2CCOCC2)cc1 ZINC000765969301 1125233607 /nfs/dbraw/zinc/23/36/07/1125233607.db2.gz SCGIPQXOFPLFBK-INIZCTEOSA-N 1 0 360.498 4.105 20 10 FICDRO CC[NH+]1CCN(c2cccc(NC(=O)c3ccc(Cl)c(C)c3)c2)CC1 ZINC001128313819 1125275491 /nfs/dbraw/zinc/27/54/91/1125275491.db2.gz WSXIJXSHKFXUJL-UHFFFAOYSA-N 1 0 357.885 4.043 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(=O)Nc2c(C)cccc2C(C)C)c1 ZINC000182339178 1125414643 /nfs/dbraw/zinc/41/46/43/1125414643.db2.gz MQOLBYUPPRCCHU-HNNXBMFYSA-N 1 0 356.466 4.122 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OCC(F)(F)F)c2)c1 ZINC000182433650 1125503405 /nfs/dbraw/zinc/50/34/05/1125503405.db2.gz KGORITDBCSZXTA-GFCCVEGCSA-N 1 0 355.356 4.193 20 10 FICDRO COc1cc(O)c(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)cc1OC ZINC000182634018 1125590598 /nfs/dbraw/zinc/59/05/98/1125590598.db2.gz OYTPRYIALGWPPA-LLVKDONJSA-N 1 0 371.355 4.159 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1cnc(C2CCC2)s1)C[C@@H]1CCCO1 ZINC000160203576 1079603983 /nfs/dbraw/zinc/60/39/83/1079603983.db2.gz DYLZAQAAKVTFQE-KRWDZBQOSA-N 1 0 358.507 4.297 20 10 FICDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648821990 1081249078 /nfs/dbraw/zinc/24/90/78/1081249078.db2.gz LHZJKSLCRYHGFN-NRFANRHFSA-N 1 0 368.521 4.352 20 10 FICDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H]1C ZINC001648826651 1081262540 /nfs/dbraw/zinc/26/25/40/1081262540.db2.gz NEWDHQYABXXZFU-INMHGKMJSA-N 1 0 370.459 4.456 20 10 FICDRO Cc1cc(C)c(/C=C\C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)c(C)c1 ZINC001648835277 1081277212 /nfs/dbraw/zinc/27/72/12/1081277212.db2.gz HFFWQZGBBNRCCP-PLNGDYQASA-N 1 0 368.496 4.391 20 10 FICDRO C[C@@H](NC(=O)C[N@H+](Cc1ccccc1O)C1CCCC1)c1ccccc1 ZINC001167353139 1081591287 /nfs/dbraw/zinc/59/12/87/1081591287.db2.gz FVELAKREJSLDJM-QGZVFWFLSA-N 1 0 352.478 4.014 20 10 FICDRO COc1cc(O)c(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)cc1OC ZINC000160518751 1081969374 /nfs/dbraw/zinc/96/93/74/1081969374.db2.gz DJSSYKXHYUIBNQ-UHFFFAOYSA-N 1 0 363.404 4.247 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccccc3OC3CCCC3)cc2)CC1 ZINC001167434665 1082139335 /nfs/dbraw/zinc/13/93/35/1082139335.db2.gz QXDZXLKGTJXDEI-UHFFFAOYSA-N 1 0 365.521 4.372 20 10 FICDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000157417204 1082816929 /nfs/dbraw/zinc/81/69/29/1082816929.db2.gz DMQXTXSXELFHOU-ROUUACIJSA-N 1 0 368.521 4.454 20 10 FICDRO COCCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000167234432 1083686345 /nfs/dbraw/zinc/68/63/45/1083686345.db2.gz CBGOKAWUNAVHGW-SFHVURJKSA-N 1 0 356.510 4.327 20 10 FICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CCCO2 ZINC000177973534 1084517144 /nfs/dbraw/zinc/51/71/44/1084517144.db2.gz RBOVQEQSLCDPPB-NRFANRHFSA-N 1 0 352.478 4.299 20 10 FICDRO C[C@H]([NH2+]CCCOC[C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000158225102 1084955988 /nfs/dbraw/zinc/95/59/88/1084955988.db2.gz HQBSMMILNKHMHT-PMACEKPBSA-N 1 0 360.542 4.161 20 10 FICDRO CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC001648916773 1085311913 /nfs/dbraw/zinc/31/19/13/1085311913.db2.gz KGPSWNZGVRPVDE-IEBWSBKVSA-N 1 0 362.533 4.481 20 10 FICDRO CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC001648916775 1085313216 /nfs/dbraw/zinc/31/32/16/1085313216.db2.gz KGPSWNZGVRPVDE-PKOBYXMFSA-N 1 0 362.533 4.481 20 10 FICDRO COc1cc(Br)cc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1O ZINC000755223462 1085571821 /nfs/dbraw/zinc/57/18/21/1085571821.db2.gz OLNAJTYTNDSIRE-VIFPVBQESA-N 1 0 370.209 4.374 20 10 FICDRO COC1CCN(c2ccc(C[N@H+](C)[C@@H](C)Cc3cccs3)cc2)CC1 ZINC001167607855 1085583342 /nfs/dbraw/zinc/58/33/42/1085583342.db2.gz CVEVRRHDTJGEHY-KRWDZBQOSA-N 1 0 358.551 4.426 20 10 FICDRO CCOc1cccc(C[NH2+][C@@H]2CCc3c2cccc3Br)c1O ZINC000105491802 1086561277 /nfs/dbraw/zinc/56/12/77/1086561277.db2.gz VGPUQWUEIUHHCP-MRXNPFEDSA-N 1 0 362.267 4.331 20 10 FICDRO C[NH+]1CCC(N2C(=O)/C(=C\c3cc4ccccc4s3)SC2=S)CC1 ZINC000255659715 1087776626 /nfs/dbraw/zinc/77/66/26/1087776626.db2.gz QTSQIJCZRIJEMF-LFIBNONCSA-N 1 0 374.556 4.197 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCCO[C@H](C)c3ccccc3)CC2)cc1 ZINC000163376588 1088096359 /nfs/dbraw/zinc/09/63/59/1088096359.db2.gz ADECCGPWFQFXAN-LJQANCHMSA-N 1 0 368.521 4.422 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H](C)NC(=O)OC(C)(C)C ZINC000394546491 1089161069 /nfs/dbraw/zinc/16/10/69/1089161069.db2.gz FOQHNVNSZHWNQX-SJORKVTESA-N 1 0 361.530 4.068 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OCC(F)(F)F)cc2)c1 ZINC000182345870 1090346085 /nfs/dbraw/zinc/34/60/85/1090346085.db2.gz HSJIJOZVCJABMW-LBPRGKRZSA-N 1 0 355.356 4.193 20 10 FICDRO COc1ccc(N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000108091157 1092134274 /nfs/dbraw/zinc/13/42/74/1092134274.db2.gz DAYWXCFQMAPYRB-UHFFFAOYSA-N 1 0 364.411 4.426 20 10 FICDRO Cc1c2ccccc2n(C)c1CNC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000473283070 1092704441 /nfs/dbraw/zinc/70/44/41/1092704441.db2.gz OOXWAPROWPANHY-UHFFFAOYSA-N 1 0 361.489 4.013 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(C(=O)N(CC)CC)cc1)c1ccc(C)cc1O ZINC000280119733 1094292351 /nfs/dbraw/zinc/29/23/51/1094292351.db2.gz OGGKVVGLVHCGCR-HXUWFJFHSA-N 1 0 354.494 4.424 20 10 FICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(N2CCOC2=O)c1)c1ccc(C)cc1O ZINC000280278021 1094322687 /nfs/dbraw/zinc/32/26/87/1094322687.db2.gz YIEYAIMPDWZYND-DNVCBOLYSA-N 1 0 354.450 4.459 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@@H](c3ccc(F)cc3)C3CC3)cc2)CC1 ZINC000271857523 1096133620 /nfs/dbraw/zinc/13/36/20/1096133620.db2.gz NNGYPTMOJCWKQI-HSZRJFAPSA-N 1 0 368.496 4.275 20 10 FICDRO COc1ccc([C@H](NCc2c(C)c3ccccc3n2C)[C@H]2CCC[NH2+]2)cc1 ZINC000423086707 1096569630 /nfs/dbraw/zinc/56/96/30/1096569630.db2.gz NTAKSCUXANQFSK-OFNKIYASSA-N 1 0 363.505 4.078 20 10 FICDRO COc1cccc(C[NH2+][C@@H](COc2ccccc2F)c2ccccc2)c1O ZINC000237411568 1099483115 /nfs/dbraw/zinc/48/31/15/1099483115.db2.gz HSBAVIIGZDAVHJ-IBGZPJMESA-N 1 0 367.420 4.450 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccccc1N1CCO[C@H](C)C1 ZINC000459499185 1100237397 /nfs/dbraw/zinc/23/73/97/1100237397.db2.gz DNDMNMRKDHOYPC-QGZVFWFLSA-N 1 0 363.505 4.002 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000185084340 1101687471 /nfs/dbraw/zinc/68/74/71/1101687471.db2.gz DJZHJVIQEQJEPL-OAHLLOKOSA-N 1 0 358.445 4.285 20 10 FICDRO Cc1nccn1-c1ccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000185084385 1101687542 /nfs/dbraw/zinc/68/75/42/1101687542.db2.gz GDLINIUPZLHRQI-OAHLLOKOSA-N 1 0 362.477 4.011 20 10 FICDRO C[C@H](COCc1ccccc1)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001167983453 1102887883 /nfs/dbraw/zinc/88/78/83/1102887883.db2.gz MBCJPUNRLUWSGX-UGKGYDQZSA-N 1 0 369.505 4.226 20 10 FICDRO C[C@H]([NH2+]C[C@H](O)c1ccccc1C(F)(F)F)c1ccc(Cl)cc1O ZINC000841748388 1103183467 /nfs/dbraw/zinc/18/34/67/1103183467.db2.gz XNYGNYYHCXXUQS-QFYYESIMSA-N 1 0 359.775 4.449 20 10 FICDRO OC1CCN(c2ccc(CNc3cc[nH+]c4cc(F)ccc34)cc2F)CC1 ZINC000301238874 1106969952 /nfs/dbraw/zinc/96/99/52/1106969952.db2.gz FGZPDPVDBSPOBK-UHFFFAOYSA-N 1 0 369.415 4.086 20 10 FICDRO Cc1ccc2[nH+]ccc(NCc3ccc(N4CCC(O)CC4)c(F)c3)c2c1 ZINC000302106859 1107304336 /nfs/dbraw/zinc/30/43/36/1107304336.db2.gz AAOMYKHZVJPXBJ-UHFFFAOYSA-N 1 0 365.452 4.256 20 10 FICDRO CCC[N@H+](CC(=O)N[C@H](C)c1ccccc1Cl)Cc1ccccc1O ZINC000303133766 1107574807 /nfs/dbraw/zinc/57/48/07/1107574807.db2.gz PTXVAWCMPDVLOD-OAHLLOKOSA-N 1 0 360.885 4.135 20 10 FICDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000840962429 1108043614 /nfs/dbraw/zinc/04/36/14/1108043614.db2.gz BRHWFULIPVURSO-CYBMUJFWSA-N 1 0 359.392 4.263 20 10 FICDRO COc1cc(Cl)cc(C[NH2+]Cc2cc(Br)cs2)c1O ZINC000228671411 1108778928 /nfs/dbraw/zinc/77/89/28/1108778928.db2.gz RVAGQGBXJIMGBY-UHFFFAOYSA-N 1 0 362.676 4.168 20 10 FICDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c1O ZINC000528035655 1109889933 /nfs/dbraw/zinc/88/99/33/1109889933.db2.gz JGMHFKXOYUFANU-QWRGUYRKSA-N 1 0 353.235 4.409 20 10 FICDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C2CC2)cn1 ZINC000528044855 1109897592 /nfs/dbraw/zinc/89/75/92/1109897592.db2.gz VYHGFJRVHJLEPZ-FPTDNZKUSA-N 1 0 352.478 4.477 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCC2(CC1)c1ccccc1NC2=O ZINC000479446430 1112035963 /nfs/dbraw/zinc/03/59/63/1112035963.db2.gz BJTNHYLSORZBLN-UHFFFAOYSA-N 1 0 373.500 4.409 20 10 FICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H](O)c1ccccc1Cl ZINC000111232802 1112891850 /nfs/dbraw/zinc/89/18/50/1112891850.db2.gz OBIHUPXVQAWTRN-FQEVSTJZSA-N 1 0 357.837 4.374 20 10 FICDRO COc1ccc2ccc(O)c(C[NH+]3CCN(c4cccc(C)c4)CC3)c2c1 ZINC000028788827 1114061008 /nfs/dbraw/zinc/06/10/08/1114061008.db2.gz LJSVNAAMRRZEJK-UHFFFAOYSA-N 1 0 362.473 4.185 20 10 FICDRO CC(C)[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F ZINC000150874159 1114151570 /nfs/dbraw/zinc/15/15/70/1114151570.db2.gz JDBJKZWZGBRJQQ-NRFANRHFSA-N 1 0 360.448 4.288 20 10 FICDRO CNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000151019419 1114270020 /nfs/dbraw/zinc/27/00/20/1114270020.db2.gz GLWNRXJAMQHVGJ-INIZCTEOSA-N 1 0 369.484 4.026 20 10 FICDRO CNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000151019465 1114270722 /nfs/dbraw/zinc/27/07/22/1114270722.db2.gz GLWNRXJAMQHVGJ-MRXNPFEDSA-N 1 0 369.484 4.026 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)c1ccccc1O ZINC000156861721 1114621588 /nfs/dbraw/zinc/62/15/88/1114621588.db2.gz NIZGYICJNOHTSP-OAQYLSRUSA-N 1 0 355.478 4.329 20 10 FICDRO C[C@H]([NH2+]CCCOCC1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000157409771 1115102064 /nfs/dbraw/zinc/10/20/64/1115102064.db2.gz MNTKXYITSGMQSE-IBGZPJMESA-N 1 0 360.542 4.161 20 10 FICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(OC(F)F)cc2)c1O ZINC000761183468 1115596496 /nfs/dbraw/zinc/59/64/96/1115596496.db2.gz LHDLEHZKSIDPBP-UHFFFAOYSA-N 1 0 357.784 4.288 20 10 FICDRO OC1CCN(c2ccc(C[NH2+][C@@H]3CCCCc4ccccc43)cc2F)CC1 ZINC000151543339 1117914733 /nfs/dbraw/zinc/91/47/33/1117914733.db2.gz HGRHLIOSGOHWRL-JOCHJYFZSA-N 1 0 368.496 4.344 20 10 FICDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc(C)c1F ZINC000151550710 1118269554 /nfs/dbraw/zinc/26/95/54/1118269554.db2.gz BDSGOTPHCHMSAK-MRXNPFEDSA-N 1 0 374.475 4.394 20 10 FICDRO Cc1ccc(O)c(C[NH2+]C[C@H](O)c2cccc(OCc3ccccc3)c2)c1 ZINC000152396358 1119245469 /nfs/dbraw/zinc/24/54/69/1119245469.db2.gz BQONKNHPNOWYHU-QHCPKHFHSA-N 1 0 363.457 4.103 20 10 FICDRO COc1cc(Br)cc(C[NH2+]C2(c3cccc(F)c3)CC2)c1O ZINC000152855311 1119521688 /nfs/dbraw/zinc/52/16/88/1119521688.db2.gz VWFXUOTZNDIRHJ-UHFFFAOYSA-N 1 0 366.230 4.081 20 10 FICDRO CCCN(Cc1ccccc1O)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000176488945 1119525493 /nfs/dbraw/zinc/52/54/93/1119525493.db2.gz FPTJVZTWHCDESW-UHFFFAOYSA-N 1 0 373.541 4.111 20 10 FICDRO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000153156452 1120044564 /nfs/dbraw/zinc/04/45/64/1120044564.db2.gz GEZOREOGAAVWRN-KKSFZXQISA-N 1 0 368.496 4.433 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc3c(cc2OC)C[C@@H](C)O3)cc1 ZINC000915228084 1120883808 /nfs/dbraw/zinc/88/38/08/1120883808.db2.gz FIDNWDZJXSCPHV-MRXNPFEDSA-N 1 0 354.494 4.155 20 10 FICDRO Cc1cc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc(C)c1O ZINC000916835948 1121876556 /nfs/dbraw/zinc/87/65/56/1121876556.db2.gz DTHIHOUCBXATDN-IAGOWNOFSA-N 1 0 372.484 4.052 20 10 FICDRO COc1ccc(C[NH2+]C[C@H](c2ccccc2OC)N2CCCCC2)cc1C ZINC000916838564 1121880813 /nfs/dbraw/zinc/88/08/13/1121880813.db2.gz UMXSISYBGYKBAB-OAQYLSRUSA-N 1 0 368.521 4.329 20 10 FICDRO CC(C)[N@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccc(N(C)C)cc1 ZINC000917074653 1122069041 /nfs/dbraw/zinc/06/90/41/1122069041.db2.gz FMPRKFYADDNTKZ-UHFFFAOYSA-N 1 0 356.901 4.464 20 10 FICDRO CSc1cccc(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075353 1122070476 /nfs/dbraw/zinc/07/04/76/1122070476.db2.gz UAXOSBCVXYJFNP-UHFFFAOYSA-N 1 0 371.550 4.324 20 10 FICDRO Clc1cccc([C@H](C[NH2+]Cc2ccc3c(c2)CCO3)N2CCCC2)c1 ZINC000917394636 1122286804 /nfs/dbraw/zinc/28/68/04/1122286804.db2.gz KZIJSNOEPIOOFW-FQEVSTJZSA-N 1 0 356.897 4.202 20 10 FICDRO Oc1ccc2ccncc2c1C[NH+]1CCC(Oc2ccc(F)cc2F)CC1 ZINC000917468874 1122328661 /nfs/dbraw/zinc/32/86/61/1122328661.db2.gz ZULATSBEWCNLGE-UHFFFAOYSA-N 1 0 370.399 4.262 20 10 FICDRO CN(C)c1ccc(CN(C(=O)Nc2cccc(C[NH+](C)C)c2)C2CC2)cc1 ZINC000918031600 1122526524 /nfs/dbraw/zinc/52/65/24/1122526524.db2.gz KCJBEVWOHXYSIR-UHFFFAOYSA-N 1 0 366.509 4.011 20 10 FICDRO C[C@H]([NH2+]Cc1cccnc1N(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000154781282 1122740908 /nfs/dbraw/zinc/74/09/08/1122740908.db2.gz NKAGPJRDMQXDTF-SFHVURJKSA-N 1 0 352.526 4.379 20 10 FICDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000918748898 1122772547 /nfs/dbraw/zinc/77/25/47/1122772547.db2.gz DKXWIIPWIQXVIN-HNNXBMFYSA-N 1 0 359.495 4.367 20 10 FICDRO COc1cc2c(cc1OC)CC[NH+](Cc1c(O)ccc3ccccc31)CC2 ZINC000919953212 1123281450 /nfs/dbraw/zinc/28/14/50/1123281450.db2.gz OOFFXOBDCKXMBL-UHFFFAOYSA-N 1 0 363.457 4.163 20 10 FICDRO COc1cc(O)c(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)cc1OC ZINC000179439326 1123976108 /nfs/dbraw/zinc/97/61/08/1123976108.db2.gz WERLOPVFRUXXPZ-UHFFFAOYSA-N 1 0 355.356 4.060 20 10 FICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCC(CO)CC3)cc1)[C@@H](C)C2 ZINC000180215100 1124265759 /nfs/dbraw/zinc/26/57/59/1124265759.db2.gz YTVJZILHPKDNGE-MHECFPHRSA-N 1 0 364.533 4.227 20 10 FICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000180226321 1124268457 /nfs/dbraw/zinc/26/84/57/1124268457.db2.gz HBDCBXRMPZRFJG-JTQLQIEISA-N 1 0 360.376 4.386 20 10 FICDRO O=C(Nc1cccc(C[NH2+]Cc2ccccc2O)c1)c1cccc(F)c1 ZINC000238107879 1124281273 /nfs/dbraw/zinc/28/12/73/1124281273.db2.gz VPWQIDMEMXUVLV-UHFFFAOYSA-N 1 0 350.393 4.073 20 10 FICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C[C@@H](O)c2ccsc2)c1 ZINC000180711167 1124414738 /nfs/dbraw/zinc/41/47/38/1124414738.db2.gz ZCYKWONQIQLOGB-OAQYLSRUSA-N 1 0 369.486 4.198 20 10 FICDRO C[C@H]([NH2+]CCOc1ccccc1F)c1ccc(Br)cc1O ZINC000756374210 1124916221 /nfs/dbraw/zinc/91/62/21/1124916221.db2.gz YWUGSCANJCOUBD-NSHDSACASA-N 1 0 354.219 4.023 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCCCC[C@@H]2C)C1 ZINC001128246770 1125123600 /nfs/dbraw/zinc/12/36/00/1125123600.db2.gz CWIPBQNEXIZQNK-SFHVURJKSA-N 1 0 367.537 4.199 20 10 FICDRO COc1ccc(-c2nc(C[NH2+][C@@H](C)c3cc(OC)ccc3O)cs2)cc1 ZINC000182318342 1125400580 /nfs/dbraw/zinc/40/05/80/1125400580.db2.gz CVXCHYWJKSIHRT-ZDUSSCGKSA-N 1 0 370.474 4.384 20 10 FICDRO C[C@@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000183161927 1125762924 /nfs/dbraw/zinc/76/29/24/1125762924.db2.gz KJRNIXCERZIBCR-KKSFZXQISA-N 1 0 367.445 4.166 20 10 FICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccccc1O ZINC000155181004 1080676542 /nfs/dbraw/zinc/67/65/42/1080676542.db2.gz WCFFUOVMUWMMGZ-IFXJQAMLSA-N 1 0 353.466 4.478 20 10 FICDRO CC[C@@H]([NH2+]C1CCN(C(=O)c2ccc(C)cc2)CC1)c1ccccc1O ZINC000155592247 1081553525 /nfs/dbraw/zinc/55/35/25/1081553525.db2.gz JDSLTPJQKJSJMV-HXUWFJFHSA-N 1 0 352.478 4.046 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cncc(Br)c1 ZINC000580451352 1081951409 /nfs/dbraw/zinc/95/14/09/1081951409.db2.gz DNGFXEMPIARHJO-CYBMUJFWSA-N 1 0 358.283 4.495 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(OC)c(OC)c(OC)c2)cc1 ZINC000160643760 1082145265 /nfs/dbraw/zinc/14/52/65/1082145265.db2.gz BPOMTPHLJNYZPH-OAHLLOKOSA-N 1 0 358.482 4.019 20 10 FICDRO C[NH+]1CCN(c2ccc(CNc3ccc4[nH]c5cccnc5c4c3)cc2)CC1 ZINC001167437343 1082199741 /nfs/dbraw/zinc/19/97/41/1082199741.db2.gz RFQSRJHAKIXSLP-UHFFFAOYSA-N 1 0 371.488 4.080 20 10 FICDRO CSc1ccc(F)c(C)c1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167441797 1082274507 /nfs/dbraw/zinc/27/45/07/1082274507.db2.gz VIADOENZDONEHG-UHFFFAOYSA-N 1 0 359.514 4.220 20 10 FICDRO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000179542987 1083556868 /nfs/dbraw/zinc/55/68/68/1083556868.db2.gz UVLFFVBKZRQLLA-UHFFFAOYSA-N 1 0 358.526 4.277 20 10 FICDRO CCOc1ccccc1C[N@H+](CCCn1ccnc1)Cc1ccccc1O ZINC000179553634 1083563838 /nfs/dbraw/zinc/56/38/38/1083563838.db2.gz IEHAHRBZLQXOMF-UHFFFAOYSA-N 1 0 365.477 4.080 20 10 FICDRO COc1cccc([C@@H](O)C[N@H+](Cc2ccccc2)Cc2ccccc2O)c1 ZINC000179584478 1083571545 /nfs/dbraw/zinc/57/15/45/1083571545.db2.gz YDHMHXYKFFVNOP-QHCPKHFHSA-N 1 0 363.457 4.137 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(OC[C@@H]3CCCCO3)CC2)cc1C(C)C ZINC000176206904 1083751065 /nfs/dbraw/zinc/75/10/65/1083751065.db2.gz LSXORUQFMSZAKA-FQEVSTJZSA-N 1 0 361.526 4.374 20 10 FICDRO CCN(C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1)CC(F)(F)F ZINC000177639561 1084185455 /nfs/dbraw/zinc/18/54/55/1084185455.db2.gz AZBQWRRLFXMCLK-OAHLLOKOSA-N 1 0 366.427 4.252 20 10 FICDRO CC(C)c1noc(CCC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000178512411 1084335860 /nfs/dbraw/zinc/33/58/60/1084335860.db2.gz MCYMSMHGYPVODZ-KRWDZBQOSA-N 1 0 356.514 4.467 20 10 FICDRO COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000178082352 1084659102 /nfs/dbraw/zinc/65/91/02/1084659102.db2.gz LGHDEGAPWHVXFX-VGSWGCGISA-N 1 0 354.494 4.070 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCCOc4ccc(F)cc43)CC2)cc1 ZINC000161265755 1084984452 /nfs/dbraw/zinc/98/44/52/1084984452.db2.gz QZPNQYBUFLQOEQ-OAQYLSRUSA-N 1 0 370.468 4.307 20 10 FICDRO Cc1noc(C[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2O)c2ccccc2)n1 ZINC000277598504 1084998690 /nfs/dbraw/zinc/99/86/90/1084998690.db2.gz VKOQZHSJYOKILQ-QGZVFWFLSA-N 1 0 357.841 4.119 20 10 FICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)cc1F ZINC000158708941 1085004010 /nfs/dbraw/zinc/00/40/10/1085004010.db2.gz ITYOAIOKVATVTO-MQNRADLISA-N 1 0 362.514 4.260 20 10 FICDRO Cc1cc(C(=O)N(C)C2CC[NH+](C(C)C)CC2)c(C)n1-c1cccc(C)c1 ZINC000115584287 1085289344 /nfs/dbraw/zinc/28/93/44/1085289344.db2.gz QOTKZEXYZXLNLO-UHFFFAOYSA-N 1 0 367.537 4.347 20 10 FICDRO CC(C)(C)OC(=O)N1CC[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)CC12CCC2 ZINC000313234565 1085289954 /nfs/dbraw/zinc/28/99/54/1085289954.db2.gz TWPXTSYJNSPWJK-IAGOWNOFSA-N 1 0 372.509 4.291 20 10 FICDRO [O-]c1c(Br)cc(Cl)cc1C[NH+]1CC(CC2CCOCC2)C1 ZINC001207349160 1086064479 /nfs/dbraw/zinc/06/44/79/1086064479.db2.gz ZMQLNFZNKZVEOW-UHFFFAOYSA-N 1 0 374.706 4.057 20 10 FICDRO Cc1cc(C[NH+]2CCN(c3ccccc3O)CC2)ccc1N1CCCCC1 ZINC001167655843 1086287289 /nfs/dbraw/zinc/28/72/89/1086287289.db2.gz CAAKFQLDARNKQH-UHFFFAOYSA-N 1 0 365.521 4.013 20 10 FICDRO COc1cc(Cl)cc(CN[C@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278985274 1086742485 /nfs/dbraw/zinc/74/24/85/1086742485.db2.gz IVNXJKOHYUDBKC-SSDOTTSWSA-N 1 0 366.792 4.380 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3CC[C@H]3Cc3ccccc3)cc2)CC1 ZINC000828021388 1086814736 /nfs/dbraw/zinc/81/47/36/1086814736.db2.gz WHSFTBOGGSEUKW-QFIPXVFZSA-N 1 0 350.506 4.119 20 10 FICDRO Oc1ccccc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000278508508 1087052606 /nfs/dbraw/zinc/05/26/06/1087052606.db2.gz PHOKDZAIRPIDJK-UHFFFAOYSA-N 1 0 351.368 4.207 20 10 FICDRO COc1cccc(C[NH+]2CCC(c3nc4ccccc4s3)CC2)c1O ZINC000162232451 1087590387 /nfs/dbraw/zinc/59/03/87/1087590387.db2.gz VBUNSWUAEJBTME-UHFFFAOYSA-N 1 0 354.475 4.390 20 10 FICDRO CC[C@H]([NH2+]CC1(C)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O ZINC000311311000 1088544220 /nfs/dbraw/zinc/54/42/20/1088544220.db2.gz WQKNFGNNNNZNIH-KRWDZBQOSA-N 1 0 362.514 4.470 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000311303170 1088546753 /nfs/dbraw/zinc/54/67/53/1088546753.db2.gz OANJYCHLJFYUHP-FUHWJXTLSA-N 1 0 361.530 4.193 20 10 FICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1 ZINC000311305403 1088548579 /nfs/dbraw/zinc/54/85/79/1088548579.db2.gz PSCUNSGBUYIDMR-IERDGZPVSA-N 1 0 362.514 4.388 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(C(F)F)c(F)c1)c1ccc(N2CCOCC2)cc1 ZINC000892729296 1088969172 /nfs/dbraw/zinc/96/91/72/1088969172.db2.gz KHBSYNJBXSVNEB-CQSZACIVSA-N 1 0 364.411 4.451 20 10 FICDRO CC[C@@H]([NH2+]Cc1cc(OC)c(OC)cc1OC)c1ccc(N(C)C)cc1 ZINC000178316711 1089218174 /nfs/dbraw/zinc/21/81/74/1089218174.db2.gz SYWVMWOGUXQCOU-GOSISDBHSA-N 1 0 358.482 4.019 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(OC)c(F)c3)CC2)cc1 ZINC000162283840 1089271030 /nfs/dbraw/zinc/27/10/30/1089271030.db2.gz XMLFOFOFVHWOQB-OAHLLOKOSA-N 1 0 358.457 4.163 20 10 FICDRO CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)c2ccccc2)C1 ZINC000435666465 1089850872 /nfs/dbraw/zinc/85/08/72/1089850872.db2.gz YNJGGISCLMPDGS-UHFFFAOYSA-N 1 0 361.489 4.071 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(OCCOc2ccccc2)nc1)c1ccccc1O ZINC000183431153 1090413746 /nfs/dbraw/zinc/41/37/46/1090413746.db2.gz PCRAKXHDEKTNAC-QGZVFWFLSA-N 1 0 364.445 4.096 20 10 FICDRO c1ccc(C[N@H+]2CC[C@H](C[NH2+]Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC000312240032 1090434601 /nfs/dbraw/zinc/43/46/01/1090434601.db2.gz CEWIGIGFFQZYAV-HSZRJFAPSA-N 1 0 363.549 4.289 20 10 FICDRO CCOc1ccc(C2(C[NH2+][C@@H](C)c3ccc(C)cc3O)CCOCC2)cc1 ZINC000185127009 1090510960 /nfs/dbraw/zinc/51/09/60/1090510960.db2.gz WTSXJGOJBMKOSZ-SFHVURJKSA-N 1 0 369.505 4.498 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cnn(-c3ccc(F)cc3)c2C)c1 ZINC000185222228 1090522404 /nfs/dbraw/zinc/52/24/04/1090522404.db2.gz VWCKCWBLOPMCTL-UONOGXRCSA-N 1 0 369.440 4.446 20 10 FICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN(c3ccccc3OC(F)F)C2)c1 ZINC000185476993 1090545977 /nfs/dbraw/zinc/54/59/77/1090545977.db2.gz VHBWLQACMZNPGO-GJZGRUSLSA-N 1 0 362.420 4.232 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H]3CCO[C@@H](c4ccccc4)C3)CC2)cc1 ZINC000364047478 1090724770 /nfs/dbraw/zinc/72/47/70/1090724770.db2.gz IRORGZYZDCHMJQ-NZQKXSOJSA-N 1 0 366.505 4.174 20 10 FICDRO CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000194857560 1091423930 /nfs/dbraw/zinc/42/39/30/1091423930.db2.gz ZQTIGWCUMXFSRE-OAHLLOKOSA-N 1 0 360.498 4.235 20 10 FICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(Br)cn2)c(O)c1 ZINC000279620150 1091945267 /nfs/dbraw/zinc/94/52/67/1091945267.db2.gz ARUXYAUUNVTDMW-LBPRGKRZSA-N 1 0 365.271 4.189 20 10 FICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)c(C(F)(F)F)c1 ZINC000279825886 1092056741 /nfs/dbraw/zinc/05/67/41/1092056741.db2.gz GOLMTUXTVJDYCV-MRXNPFEDSA-N 1 0 365.399 4.039 20 10 FICDRO Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000178697024 1093084669 /nfs/dbraw/zinc/08/46/69/1093084669.db2.gz XBXZJVGEESCQSF-IRXDYDNUSA-N 1 0 358.505 4.308 20 10 FICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H]2CCc3n[nH]cc3C2)cc1 ZINC000236973540 1093252245 /nfs/dbraw/zinc/25/22/45/1093252245.db2.gz CXJGLNJAMPJGQV-NRFANRHFSA-N 1 0 360.505 4.083 20 10 FICDRO CCOc1ccccc1Oc1ccc(C[NH2+]Cc2ccccc2O)cn1 ZINC000236977303 1093278185 /nfs/dbraw/zinc/27/81/85/1093278185.db2.gz RQBLTKGGNMDIEK-UHFFFAOYSA-N 1 0 350.418 4.268 20 10 FICDRO Oc1ccc2oc3c(c2c1C[NH+]1CCC(c2ccncn2)CC1)CCCC3 ZINC000840169912 1093489706 /nfs/dbraw/zinc/48/97/06/1093489706.db2.gz GQVPEUIKCHCDFF-UHFFFAOYSA-N 1 0 363.461 4.187 20 10 FICDRO CN(c1ccc(CNC(=O)CCCC[NH+]2CCCC2)cc1)C1CCCCC1 ZINC000729346395 1093968359 /nfs/dbraw/zinc/96/83/59/1093968359.db2.gz SMIDKCRMQAIWGI-UHFFFAOYSA-N 1 0 371.569 4.338 20 10 FICDRO CC(C)[C@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000840757499 1095910588 /nfs/dbraw/zinc/91/05/88/1095910588.db2.gz AMPUHUXWWZRWNV-FQEVSTJZSA-N 1 0 360.448 4.288 20 10 FICDRO CC(C)[C@@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000840757507 1095911425 /nfs/dbraw/zinc/91/14/25/1095911425.db2.gz AMPUHUXWWZRWNV-HXUWFJFHSA-N 1 0 360.448 4.288 20 10 FICDRO OCC1CCN(c2ccc(C[NH2+][C@H](c3ccc(F)cc3)C3CC3)cc2)CC1 ZINC000271857529 1096133635 /nfs/dbraw/zinc/13/36/35/1096133635.db2.gz NNGYPTMOJCWKQI-QHCPKHFHSA-N 1 0 368.496 4.275 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCc3ccccc3C2)nc1)c1ccccc1O ZINC000272858281 1096217922 /nfs/dbraw/zinc/21/79/22/1096217922.db2.gz MKBSHOBBRGSISZ-QGZVFWFLSA-N 1 0 359.473 4.201 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)c(O)c1C ZINC000273361149 1096255792 /nfs/dbraw/zinc/25/57/92/1096255792.db2.gz DAANMSQRMQZADD-INIZCTEOSA-N 1 0 355.482 4.390 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3F)CC2)c(O)c1C ZINC000273405949 1096259607 /nfs/dbraw/zinc/25/96/07/1096259607.db2.gz OMDJBTHWNKIXRN-INIZCTEOSA-N 1 0 370.468 4.104 20 10 FICDRO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)c3ccc(C)c(C)c3O)cn2)n1 ZINC000273414769 1096260879 /nfs/dbraw/zinc/26/08/79/1096260879.db2.gz QNOOAYDDAYMCPU-KRWDZBQOSA-N 1 0 350.466 4.057 20 10 FICDRO Cc1ccc(C(=O)N2CCC([NH2+][C@H](C)c3ccc(C)c(C)c3O)CC2)cc1 ZINC000273566124 1096273694 /nfs/dbraw/zinc/27/36/94/1096273694.db2.gz JPIJQLLGKJNJMB-GOSISDBHSA-N 1 0 366.505 4.273 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCCO[C@@H](C)c3ccccc3)CC2)cc1 ZINC000163376474 1101949980 /nfs/dbraw/zinc/94/99/80/1101949980.db2.gz ADECCGPWFQFXAN-IBGZPJMESA-N 1 0 368.521 4.422 20 10 FICDRO COc1cccc(-c2csc(C[NH2+][C@@H](C)c3cc(OC)ccc3O)n2)c1 ZINC000894501726 1102473539 /nfs/dbraw/zinc/47/35/39/1102473539.db2.gz FTTZPIFKSJGYFF-ZDUSSCGKSA-N 1 0 370.474 4.384 20 10 FICDRO CC(C)[C@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001648985221 1102570727 /nfs/dbraw/zinc/57/07/27/1102570727.db2.gz BGGQUWLCUUKIDA-QMHWCDLVSA-N 1 0 358.570 4.446 20 10 FICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(Br)cc2F)c1 ZINC000127928100 1102987863 /nfs/dbraw/zinc/98/78/63/1102987863.db2.gz GJSJSZNFQHXMMP-SNVBAGLBSA-N 1 0 354.219 4.153 20 10 FICDRO C[C@@H](Nc1cc[nH+]c2cc(F)ccc12)c1ccc(N2CCOCC2)cc1 ZINC000301279288 1106979341 /nfs/dbraw/zinc/97/93/41/1106979341.db2.gz PLCOOTIKOQYRIE-OAHLLOKOSA-N 1 0 351.425 4.384 20 10 FICDRO COC1CCN(c2ccc(C[N@@H+]3C[C@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000827986274 1107523560 /nfs/dbraw/zinc/52/35/60/1107523560.db2.gz SDSZHPHJAOAKPA-MBSDFSHPSA-N 1 0 350.506 4.495 20 10 FICDRO CC[C@H](Cc1ccccc1)[N@H+](CC)Cc1ccc(N2CCOCC2)cc1 ZINC001168073700 1107789846 /nfs/dbraw/zinc/78/98/46/1107789846.db2.gz NNJHUNPDJWECEC-JOCHJYFZSA-N 1 0 352.522 4.366 20 10 FICDRO C[N@H+](Cc1ccc(Br)s1)Cc1c(O)ccc2ccncc21 ZINC000021970086 1109054421 /nfs/dbraw/zinc/05/44/21/1109054421.db2.gz YFODQWAHQXTWEE-UHFFFAOYSA-N 1 0 363.280 4.396 20 10 FICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)c(Br)cc2F)c1 ZINC000527977054 1109873147 /nfs/dbraw/zinc/87/31/47/1109873147.db2.gz AKCKAUUPORPAPR-VIFPVBQESA-N 1 0 372.209 4.292 20 10 FICDRO Cc1cc(Br)cc([C@H](C)[NH2+]Cc2ccc3cn(C)nc3c2)c1O ZINC000527961452 1109876068 /nfs/dbraw/zinc/87/60/68/1109876068.db2.gz HLCMGKPEUJOJSR-LBPRGKRZSA-N 1 0 374.282 4.201 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Br)c(F)c2F)c1 ZINC000527987559 1109887239 /nfs/dbraw/zinc/88/72/39/1109887239.db2.gz PMRXKORRARIYFG-SECBINFHSA-N 1 0 372.209 4.292 20 10 FICDRO COc1cc(NC(C)=O)ccc1[C@@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479440805 1112024103 /nfs/dbraw/zinc/02/41/03/1112024103.db2.gz UVCZBJCMPNVWLW-OAHLLOKOSA-N 1 0 365.477 4.305 20 10 FICDRO CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc2c(c1)OCCO2 ZINC000479463226 1112033126 /nfs/dbraw/zinc/03/31/26/1112033126.db2.gz RQWXTASOYMXZRC-GOSISDBHSA-N 1 0 350.462 4.499 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1cc(Br)ccc1O ZINC000192918388 1113403477 /nfs/dbraw/zinc/40/34/77/1113403477.db2.gz CLNUGBPYDVLJSM-AWEZNQCLSA-N 1 0 364.239 4.124 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccc2c(c1)CCO2 ZINC000163604883 1113991726 /nfs/dbraw/zinc/99/17/26/1113991726.db2.gz CCKQXFMJSBFBDH-NRFANRHFSA-N 1 0 368.546 4.416 20 10 FICDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(N3CCSCC3)cc1)CCC2 ZINC000163620109 1114174474 /nfs/dbraw/zinc/17/44/74/1114174474.db2.gz KZDMIBBGHRFTAK-KRWDZBQOSA-N 1 0 359.564 4.172 20 10 FICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1 ZINC000163634544 1114314141 /nfs/dbraw/zinc/31/41/41/1114314141.db2.gz BCCZBHKSNCIVEN-KRWDZBQOSA-N 1 0 356.535 4.489 20 10 FICDRO Cc1cc(O)c(C[N@@H+]2CCCN(C(=O)c3ccc(Cl)cc3)CC2)cc1C ZINC000057104683 1114875811 /nfs/dbraw/zinc/87/58/11/1114875811.db2.gz HOZGETOIZQQLIY-UHFFFAOYSA-N 1 0 372.896 4.011 20 10 FICDRO CN1CCCc2cc(C[NH2+]Cc3ccccc3OCc3cccnc3)ccc21 ZINC000058477019 1115233912 /nfs/dbraw/zinc/23/39/12/1115233912.db2.gz ZDCHYTSJXUKVLJ-UHFFFAOYSA-N 1 0 373.500 4.333 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000227436530 1115564264 /nfs/dbraw/zinc/56/42/64/1115564264.db2.gz BKUYUHQFOSVROO-ZYHUDNBSSA-N 1 0 352.194 4.365 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(C(=O)c3ccc(C)cc3)CC2)c1O ZINC000761192468 1115612629 /nfs/dbraw/zinc/61/26/29/1115612629.db2.gz NPZBELHVDUSKFG-UHFFFAOYSA-N 1 0 373.880 4.458 20 10 FICDRO COc1cc(Cl)cc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1O ZINC000761191780 1115614350 /nfs/dbraw/zinc/61/43/50/1115614350.db2.gz VQCFHEURCBBFTI-UHFFFAOYSA-N 1 0 362.813 4.127 20 10 FICDRO Oc1cc2c(cc1C[NH2+]C1(c3cccc(C(F)(F)F)c3)CCC1)OCO2 ZINC000174585661 1116141600 /nfs/dbraw/zinc/14/16/00/1116141600.db2.gz GKRBLWMVMSVHEV-UHFFFAOYSA-N 1 0 365.351 4.309 20 10 FICDRO CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000312212999 1118301931 /nfs/dbraw/zinc/30/19/31/1118301931.db2.gz LYEAIWZDTWWWJQ-LJQANCHMSA-N 1 0 373.541 4.166 20 10 FICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1 ZINC000151588464 1118939403 /nfs/dbraw/zinc/93/94/03/1118939403.db2.gz VTSVNRMEYVQDND-JOCHJYFZSA-N 1 0 356.485 4.275 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC000151863809 1118994268 /nfs/dbraw/zinc/99/42/68/1118994268.db2.gz UXNMZXLZGHQQQP-HNNXBMFYSA-N 1 0 360.448 4.336 20 10 FICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(C)cc1-c1ccnn1C ZINC000669996371 1119366858 /nfs/dbraw/zinc/36/68/58/1119366858.db2.gz TZSAHSSQLHTAER-UHFFFAOYSA-N 1 0 358.489 4.485 20 10 FICDRO CC[C@@](C)([NH2+]Cc1cc(Br)cc(OC)c1O)c1nccs1 ZINC000152610934 1119470698 /nfs/dbraw/zinc/47/06/98/1119470698.db2.gz XGQAEEALQWGDDX-OAHLLOKOSA-N 1 0 371.300 4.035 20 10 FICDRO COc1ccc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)cc1OC(F)F ZINC000914784285 1120535127 /nfs/dbraw/zinc/53/51/27/1120535127.db2.gz LGPFGJKNYNUYLJ-UHFFFAOYSA-N 1 0 363.404 4.123 20 10 FICDRO Cc1cccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000915229492 1120888103 /nfs/dbraw/zinc/88/81/03/1120888103.db2.gz DPMYJVIDRNOKQO-GOSISDBHSA-N 1 0 351.494 4.102 20 10 FICDRO C[C@H](CC(=O)Nc1cccc(Cl)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000915229780 1120888635 /nfs/dbraw/zinc/88/86/35/1120888635.db2.gz QOVZYOWCAWRKLQ-MRXNPFEDSA-N 1 0 371.912 4.447 20 10 FICDRO C[C@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@H]1CCOC1 ZINC000763117303 1121131971 /nfs/dbraw/zinc/13/19/71/1121131971.db2.gz WDHJLYYROXPNIO-HOTGVXAUSA-N 1 0 352.438 4.055 20 10 FICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCN(c3ccccc3OC)C2)cc1C ZINC001649029244 1121364532 /nfs/dbraw/zinc/36/45/32/1121364532.db2.gz PSXZNIZMKGPMSY-HXUWFJFHSA-N 1 0 368.521 4.409 20 10 FICDRO Fc1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)ccc1Br ZINC001649101663 1121793349 /nfs/dbraw/zinc/79/33/49/1121793349.db2.gz MFHMHBLBZWICQY-UHFFFAOYSA-N 1 0 350.231 4.203 20 10 FICDRO CCc1ccc(C[NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)cc1 ZINC000916835873 1121877105 /nfs/dbraw/zinc/87/71/05/1121877105.db2.gz BHAIHKLGKHPJRT-CALCHBBNSA-N 1 0 356.485 4.292 20 10 FICDRO c1ccc(CCOCCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000916838325 1121880758 /nfs/dbraw/zinc/88/07/58/1121880758.db2.gz WQLVBFQPWWFXJV-UHFFFAOYSA-N 1 0 352.522 4.416 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN(C(=O)CCC3CCCCC3)CC2)cc1C ZINC000917484575 1122326777 /nfs/dbraw/zinc/32/67/77/1122326777.db2.gz ATLFMQDVCUYBFY-UHFFFAOYSA-N 1 0 358.526 4.014 20 10 FICDRO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000918024195 1122523345 /nfs/dbraw/zinc/52/33/45/1122523345.db2.gz YITIHTQKAHKJRY-LJQANCHMSA-N 1 0 367.537 4.021 20 10 FICDRO c1ccc2c(c1)-c1ccccc1C2[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000920957051 1123542205 /nfs/dbraw/zinc/54/22/05/1123542205.db2.gz ASJBAAQROILRJQ-UHFFFAOYSA-N 1 0 356.469 4.383 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCN(c3ccc(F)c(F)c3)C2)cc1 ZINC000921070552 1123555933 /nfs/dbraw/zinc/55/59/33/1123555933.db2.gz ZJNJQVNGRICHPT-GOSISDBHSA-N 1 0 373.491 4.427 20 10 FICDRO CC[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1cc(C)ccc1O ZINC000179795961 1124082758 /nfs/dbraw/zinc/08/27/58/1124082758.db2.gz RTTAGMSZZLTZCD-UHFFFAOYSA-N 1 0 367.276 4.468 20 10 FICDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(C(C)=O)c1O ZINC000179937163 1124148089 /nfs/dbraw/zinc/14/80/89/1124148089.db2.gz HZOHLWFWGHCSME-SNVBAGLBSA-N 1 0 351.805 4.247 20 10 FICDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000180286451 1124283815 /nfs/dbraw/zinc/28/38/15/1124283815.db2.gz AGQSTLUVZPJYDG-NSYGIPOTSA-N 1 0 358.551 4.463 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(N3CCC(OC)CC3)CCCC2)cc1 ZINC000765859870 1124292194 /nfs/dbraw/zinc/29/21/94/1124292194.db2.gz LZECTRNPYUTHEH-IBGZPJMESA-N 1 0 373.585 4.217 20 10 FICDRO O=C(Nc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1)c1ccc(F)cc1 ZINC000180493507 1124347717 /nfs/dbraw/zinc/34/77/17/1124347717.db2.gz YKSAQTXPMUSFLR-UHFFFAOYSA-N 1 0 368.383 4.213 20 10 FICDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000765902725 1124359053 /nfs/dbraw/zinc/35/90/53/1124359053.db2.gz DKXATNBOEGFHLU-VQIMIIECSA-N 1 0 354.469 4.043 20 10 FICDRO COc1ccc(O)c(C[N@@H+]2CCCCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000180696627 1124409539 /nfs/dbraw/zinc/40/95/39/1124409539.db2.gz GCIZNKZLVJPHOC-LPHOPBHVSA-N 1 0 361.507 4.331 20 10 FICDRO C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(Br)cc1[O-] ZINC000756363456 1124843808 /nfs/dbraw/zinc/84/38/08/1124843808.db2.gz OGGASJAXGGZZRA-UONOGXRCSA-N 1 0 355.320 4.070 20 10 FICDRO Fc1cc(C[NH2+]Cc2ccc(-c3ccccc3)o2)ccc1N1CCOCC1 ZINC000069751588 1125133909 /nfs/dbraw/zinc/13/39/09/1125133909.db2.gz IMHZATJPSPBTQJ-UHFFFAOYSA-N 1 0 366.436 4.212 20 10 FICDRO c1cc([C@H]2OCCC[C@@H]2[NH2+]Cc2ccc(N3CCCCC3)cc2)ccn1 ZINC000275543848 570716369 /nfs/dbraw/zinc/71/63/69/570716369.db2.gz MVAXCOWBRJYUBI-FCHUYYIVSA-N 1 0 351.494 4.082 20 10 FICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(N2CCCOC2=O)cc1 ZINC000922144850 1125542256 /nfs/dbraw/zinc/54/22/56/1125542256.db2.gz IHQJSSIZUWRPSM-INIZCTEOSA-N 1 0 366.461 4.209 20 10 FICDRO COC[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)c1ccc(C)o1 ZINC000183159048 1125763206 /nfs/dbraw/zinc/76/32/06/1125763206.db2.gz JOWCJOISNALKFU-HXUWFJFHSA-N 1 0 367.445 4.350 20 10 FICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1ccc(Cl)c(F)c1 ZINC001167108277 1080553902 /nfs/dbraw/zinc/55/39/02/1080553902.db2.gz NLDZWFLGYFFLNH-FQEVSTJZSA-N 1 0 364.892 4.489 20 10 FICDRO CC(=O)Nc1ccccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000155224371 1080723599 /nfs/dbraw/zinc/72/35/99/1080723599.db2.gz XVPGXQANQHAZKP-UHFFFAOYSA-N 1 0 351.494 4.267 20 10 FICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc([S@](C)=O)cc1 ZINC000155245442 1080740149 /nfs/dbraw/zinc/74/01/49/1080740149.db2.gz HHABYHQHPLAZCK-RUZDIDTESA-N 1 0 356.535 4.046 20 10 FICDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)N(C)c1ccccc1 ZINC001648795680 1080805225 /nfs/dbraw/zinc/80/52/25/1080805225.db2.gz URHXPBCUDFSLEH-HNNXBMFYSA-N 1 0 365.443 4.386 20 10 FICDRO CC[C@@](C)([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)c1nc(C)cs1 ZINC000177357056 1081211583 /nfs/dbraw/zinc/21/15/83/1081211583.db2.gz KOCMJUAOEULIID-QGZVFWFLSA-N 1 0 352.887 4.428 20 10 FICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CN1Cc1ccccc1 ZINC000398086460 1082019098 /nfs/dbraw/zinc/01/90/98/1082019098.db2.gz IFECGFOHACYQBF-REWPJTCUSA-N 1 0 363.549 4.430 20 10 FICDRO Cc1ccc(-c2ccnc(NCc3ccc(N4CC[NH+](C)CC4)cc3)c2)cc1 ZINC001167427028 1082056080 /nfs/dbraw/zinc/05/60/80/1082056080.db2.gz UQFVTQCKHGAHGQ-UHFFFAOYSA-N 1 0 372.516 4.421 20 10 FICDRO Cc1ccccc1[C@H]1C[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001167469547 1082655004 /nfs/dbraw/zinc/65/50/04/1082655004.db2.gz ZGEKEZRRTKRIPZ-FPOVZHCZSA-N 1 0 350.506 4.210 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccsc1 ZINC000178189535 1082956360 /nfs/dbraw/zinc/95/63/60/1082956360.db2.gz GXFHPXQCWQZNSC-ZDUSSCGKSA-N 1 0 370.440 4.454 20 10 FICDRO COc1cccc([C@H](O)C[N@H+](Cc2ccccc2)Cc2ccccc2O)c1 ZINC000179584469 1083570401 /nfs/dbraw/zinc/57/04/01/1083570401.db2.gz YDHMHXYKFFVNOP-HSZRJFAPSA-N 1 0 363.457 4.137 20 10 FICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)c1O ZINC000179597491 1083571270 /nfs/dbraw/zinc/57/12/70/1083571270.db2.gz KFCAFIJCUYZDBY-SNVBAGLBSA-N 1 0 353.340 4.186 20 10 FICDRO Cc1noc(C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)c2ccccc2)n1 ZINC000277032460 1083725142 /nfs/dbraw/zinc/72/51/42/1083725142.db2.gz FIBNSQCSKQVAAH-SJCJKPOMSA-N 1 0 357.841 4.372 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)c1cc(F)cc(F)c1 ZINC000151579683 1083725337 /nfs/dbraw/zinc/72/53/37/1083725337.db2.gz KSGCGOGFTWABTF-HNNXBMFYSA-N 1 0 360.448 4.024 20 10 FICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1O ZINC000177252697 1083775133 /nfs/dbraw/zinc/77/51/33/1083775133.db2.gz VKYPOOGOLZIAGY-AWEZNQCLSA-N 1 0 368.408 4.255 20 10 FICDRO C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S ZINC000066145206 1084124660 /nfs/dbraw/zinc/12/46/60/1084124660.db2.gz JHFJILQJXHNNHS-ZROIWOOFSA-N 1 0 368.955 4.129 20 10 FICDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(N2CCOCC2)c(F)c1 ZINC000178089854 1084668916 /nfs/dbraw/zinc/66/89/16/1084668916.db2.gz UFDVYDCRTSVANT-VBKZILBWSA-N 1 0 358.432 4.140 20 10 FICDRO Cc1noc(C[C@H]([NH2+]Cc2cc(Cl)cc(C)c2O)c2ccccc2)n1 ZINC000277598497 1084998806 /nfs/dbraw/zinc/99/88/06/1084998806.db2.gz VKOQZHSJYOKILQ-KRWDZBQOSA-N 1 0 357.841 4.119 20 10 FICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)[C@H](O)c1cccc(F)c1 ZINC000756737053 1085658117 /nfs/dbraw/zinc/65/81/17/1085658117.db2.gz RVTAXSSWMIHNQT-RVPKQNPDSA-N 1 0 368.246 4.067 20 10 FICDRO CCC[N@@H+]1CCC[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 ZINC001625905086 1085943265 /nfs/dbraw/zinc/94/32/65/1085943265.db2.gz GXCLVGQNEBDICC-FQEVSTJZSA-N 1 0 371.569 4.194 20 10 FICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000161668724 1086598155 /nfs/dbraw/zinc/59/81/55/1086598155.db2.gz OHDCMXIAVHEHPZ-QGZVFWFLSA-N 1 0 372.484 4.302 20 10 FICDRO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1cc2ccccc2o1 ZINC000066970263 1086614411 /nfs/dbraw/zinc/61/44/11/1086614411.db2.gz HREGWLDCDHOFOA-HNNXBMFYSA-N 1 0 354.425 4.259 20 10 FICDRO C[C@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccc(N2CCCCCC2)cc1 ZINC000161790857 1086837726 /nfs/dbraw/zinc/83/77/26/1086837726.db2.gz DHMGWSWWBRWMKA-SFHVURJKSA-N 1 0 358.526 4.403 20 10 FICDRO C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000367436629 1090460873 /nfs/dbraw/zinc/46/08/73/1090460873.db2.gz GQOXKDAJYIPYKS-MRXNPFEDSA-N 1 0 356.489 4.200 20 10 FICDRO CCc1nc(CN2CCC(C[NH2+][C@H](C)c3ccc(C)cc3O)CC2)cs1 ZINC000185423362 1090541782 /nfs/dbraw/zinc/54/17/82/1090541782.db2.gz TWYBJRSAFNBJGW-MRXNPFEDSA-N 1 0 373.566 4.282 20 10 FICDRO COc1ccc(O)c(C[NH2+]Cc2ccc(NC(=O)OC(C)(C)C)cc2)c1 ZINC000311305745 1091355434 /nfs/dbraw/zinc/35/54/34/1091355434.db2.gz PUMBURVLVJZHCD-UHFFFAOYSA-N 1 0 358.438 4.038 20 10 FICDRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cccc(OC)c2O)cc1OC ZINC000236707352 1092414404 /nfs/dbraw/zinc/41/44/04/1092414404.db2.gz JEMJWBGWFZJZSO-OAHLLOKOSA-N 1 0 359.466 4.439 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]CCCc2nc3ccccc3n2C)cc1 ZINC000236960114 1093134652 /nfs/dbraw/zinc/13/46/52/1093134652.db2.gz OKGJTAXTDASTNR-UHFFFAOYSA-N 1 0 350.510 4.142 20 10 FICDRO CC[C@H]([NH2+]Cc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(C)cc1O ZINC000279969962 1093893188 /nfs/dbraw/zinc/89/31/88/1093893188.db2.gz CVTRGCDGKRDCND-FPOVZHCZSA-N 1 0 368.477 4.059 20 10 FICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOC2=O)cc1)c1ccc(C)cc1O ZINC000279973854 1093980803 /nfs/dbraw/zinc/98/08/03/1093980803.db2.gz DDXZVZUGWROOLS-KXBFYZLASA-N 1 0 354.450 4.459 20 10 FICDRO COc1cc(Cl)c(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1Cl ZINC001648965629 1094317799 /nfs/dbraw/zinc/31/77/99/1094317799.db2.gz RTAWTBKRBCWCKQ-UHFFFAOYSA-N 1 0 357.256 4.497 20 10 FICDRO C[NH2+]C1CCN(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 ZINC000237142373 1095177151 /nfs/dbraw/zinc/17/71/51/1095177151.db2.gz WSMKCYZMUDKYQI-UHFFFAOYSA-N 1 0 353.510 4.042 20 10 FICDRO CSCC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1nnc2ccccn21 ZINC000273367364 1096256935 /nfs/dbraw/zinc/25/69/35/1096256935.db2.gz FKCHFHAXOLZEHL-WBVHZDCISA-N 1 0 370.522 4.197 20 10 FICDRO Cc1nc(CN2CCC(C[NH2+][C@@H](C)c3ccc(C)c(C)c3O)CC2)oc1C ZINC000273615744 1096278619 /nfs/dbraw/zinc/27/86/19/1096278619.db2.gz XHHZJFNHWYRBIL-KRWDZBQOSA-N 1 0 371.525 4.177 20 10 FICDRO COc1ccc([C@@H](NCc2c(C)c3ccccc3n2C)[C@H]2CCC[NH2+]2)cc1 ZINC000423086705 1096570113 /nfs/dbraw/zinc/57/01/13/1096570113.db2.gz NTAKSCUXANQFSK-NFBKMPQASA-N 1 0 363.505 4.078 20 10 FICDRO COc1cccc(C[NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 ZINC000237424983 1099501891 /nfs/dbraw/zinc/50/18/91/1099501891.db2.gz HWHAJWCZUCMDML-INIZCTEOSA-N 1 0 362.420 4.055 20 10 FICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc21 ZINC000289211477 1099755827 /nfs/dbraw/zinc/75/58/27/1099755827.db2.gz KNCBELFRVYFUSH-VFNWGFHPSA-N 1 0 354.469 4.125 20 10 FICDRO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccs1 ZINC000163400346 1102250976 /nfs/dbraw/zinc/25/09/76/1102250976.db2.gz DKZFTCAKLLSKOB-CYBMUJFWSA-N 1 0 370.440 4.454 20 10 FICDRO CC1CCC([NH+]2CCN(c3ccc(OCc4cccnc4)cc3)CC2)CC1 ZINC001168225370 1102546707 /nfs/dbraw/zinc/54/67/07/1102546707.db2.gz YKWZFPOVTUGLEU-UHFFFAOYSA-N 1 0 365.521 4.361 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 ZINC000163414460 1102748706 /nfs/dbraw/zinc/74/87/06/1102748706.db2.gz JZLLIFUTXZZUFM-AWEZNQCLSA-N 1 0 368.399 4.294 20 10 FICDRO CC1(C)C[N@H+](Cc2c(O)ccc3ccncc32)CCN1Cc1ccccc1 ZINC000729469941 1102823425 /nfs/dbraw/zinc/82/34/25/1102823425.db2.gz ICIMVKMPOCJIFT-UHFFFAOYSA-N 1 0 361.489 4.037 20 10 FICDRO C[C@H]([NH2+]C[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cc(F)ccc1O ZINC000760041605 1105021221 /nfs/dbraw/zinc/02/12/21/1105021221.db2.gz YOWGUYHWVDPTCM-SZFUDVHCSA-N 1 0 361.432 4.095 20 10 FICDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1cc(Br)cc(F)c1[O-] ZINC000840892335 1107698355 /nfs/dbraw/zinc/69/83/55/1107698355.db2.gz RAZQLSXMDLQEHD-NSHDSACASA-N 1 0 367.262 4.317 20 10 FICDRO Cc1ccc(C)n1-c1ccc(-c2noc(C(F)(F)C3CC[NH2+]CC3)n2)cc1 ZINC001211901842 1107956729 /nfs/dbraw/zinc/95/67/29/1107956729.db2.gz MJEVRPMLYVPLOH-UHFFFAOYSA-N 1 0 372.419 4.236 20 10 FICDRO COc1cc(C[N@H+](C)Cc2c(O)ccc3ccncc32)ccc1OC(F)F ZINC000021965128 1109054220 /nfs/dbraw/zinc/05/42/20/1109054220.db2.gz QJEPCMOGFVNRAQ-UHFFFAOYSA-N 1 0 374.387 4.182 20 10 FICDRO CC[C@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1O ZINC000527997142 1109881114 /nfs/dbraw/zinc/88/11/14/1109881114.db2.gz HELDOWIALWTYKN-GOEBONIOSA-N 1 0 364.367 4.015 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(CN(C)C(=O)OC(C)(C)C)CC2)cc1C ZINC000728909888 1110132322 /nfs/dbraw/zinc/13/23/22/1110132322.db2.gz AENGDAHOKRASJI-UHFFFAOYSA-N 1 0 362.514 4.088 20 10 FICDRO CCCOc1ccc(C[NH2+]C[C@H](C)N2CCc3ccccc3C2)cc1C ZINC001649004098 1112657750 /nfs/dbraw/zinc/65/77/50/1112657750.db2.gz ATKCCLVTLYYLCS-IBGZPJMESA-N 1 0 352.522 4.320 20 10 FICDRO Cc1cc(C(=O)N2CCC([NH2+]CC3CC3)CC2)c(C)n1-c1ccccc1C ZINC000159868544 1113256774 /nfs/dbraw/zinc/25/67/74/1113256774.db2.gz OHPLLEOJKMRRMM-UHFFFAOYSA-N 1 0 365.521 4.007 20 10 FICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCSCC3)cc2)cc1F ZINC000163594263 1113867709 /nfs/dbraw/zinc/86/77/09/1113867709.db2.gz YYAQAURFOVWOFJ-OAHLLOKOSA-N 1 0 360.498 4.238 20 10 FICDRO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000151071018 1114289136 /nfs/dbraw/zinc/28/91/36/1114289136.db2.gz RDZONXRIMNHTOG-OAHLLOKOSA-N 1 0 373.566 4.436 20 10 FICDRO Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000163964685 1114413929 /nfs/dbraw/zinc/41/39/29/1114413929.db2.gz SQNOCBGYLHRVFO-KRWDZBQOSA-N 1 0 362.521 4.465 20 10 FICDRO CC[C@@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000164280499 1114463880 /nfs/dbraw/zinc/46/38/80/1114463880.db2.gz OGMDHMLYUWBBIS-JOCHJYFZSA-N 1 0 362.521 4.433 20 10 FICDRO C[C@H]([NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000156599244 1114467493 /nfs/dbraw/zinc/46/74/93/1114467493.db2.gz KDTFVGGVZWQHCO-ZLPCBKJTSA-N 1 0 361.530 4.239 20 10 FICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2c(OC)cc(OC)cc2OC)cc1 ZINC000164402350 1114494253 /nfs/dbraw/zinc/49/42/53/1114494253.db2.gz WMSNQMAWOMWQCH-HNNXBMFYSA-N 1 0 358.482 4.019 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)c1ccccc1O ZINC000156861587 1114621516 /nfs/dbraw/zinc/62/15/16/1114621516.db2.gz NIZGYICJNOHTSP-NRFANRHFSA-N 1 0 355.478 4.329 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCC(NC(=O)c3ccsc3)CC2)cc1C(C)C ZINC000057106778 1114872483 /nfs/dbraw/zinc/87/24/83/1114872483.db2.gz IWDQFEKDYFNTEQ-UHFFFAOYSA-N 1 0 372.534 4.280 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c(C)n1-c1ccc(Cl)cc1 ZINC000760763962 1114902782 /nfs/dbraw/zinc/90/27/82/1114902782.db2.gz QTFYZGROBGLHME-GOSISDBHSA-N 1 0 373.928 4.304 20 10 FICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000157408583 1115101925 /nfs/dbraw/zinc/10/19/25/1115101925.db2.gz UGBSZTRIVFOAQC-MRXNPFEDSA-N 1 0 369.465 4.231 20 10 FICDRO CCc1nc2c(s1)[C@@H]([NH2+]C1CCN(c3ccc(OC)cc3)CC1)CCC2 ZINC000157411069 1115102990 /nfs/dbraw/zinc/10/29/90/1115102990.db2.gz TZAGSFFMGHVBSN-SFHVURJKSA-N 1 0 371.550 4.350 20 10 FICDRO Cc1ccc([C@H](C)[NH2+]Cc2cn3cc(Br)cc(C)c3n2)c(O)c1 ZINC000760879593 1115126216 /nfs/dbraw/zinc/12/62/16/1115126216.db2.gz GGQKKAMQWGGIJC-ZDUSSCGKSA-N 1 0 374.282 4.270 20 10 FICDRO C[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)c1cncs1 ZINC000157720140 1115285691 /nfs/dbraw/zinc/28/56/91/1115285691.db2.gz MWZVOOLNOSKIAI-GFCCVEGCSA-N 1 0 353.438 4.064 20 10 FICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2OCCOC)cc1 ZINC000167626995 1115311974 /nfs/dbraw/zinc/31/19/74/1115311974.db2.gz SMPCHZYYMXZACP-GOSISDBHSA-N 1 0 356.510 4.327 20 10 FICDRO Oc1ccc(Br)cc1C[NH2+]Cc1cccc(Br)c1 ZINC000227441988 1115564585 /nfs/dbraw/zinc/56/45/85/1115564585.db2.gz BNKYEOZLKNQJBB-UHFFFAOYSA-N 1 0 371.072 4.207 20 10 FICDRO COc1cc(Cl)cc(C[NH+]2CCC(Oc3ccc(C)cc3)CC2)c1O ZINC000761192532 1115612747 /nfs/dbraw/zinc/61/27/47/1115612747.db2.gz QYERHVBDMXJNML-UHFFFAOYSA-N 1 0 361.869 4.406 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)c1O ZINC000761197989 1115617939 /nfs/dbraw/zinc/61/79/39/1115617939.db2.gz JWRBYXDALGDKRQ-HNNXBMFYSA-N 1 0 351.805 4.197 20 10 FICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](OC)c2ccc(F)cc2)c1O ZINC000761216695 1115648548 /nfs/dbraw/zinc/64/85/48/1115648548.db2.gz WDQBGBOJAGKWFV-ZMZPIMSZSA-N 1 0 353.821 4.059 20 10 FICDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(OC)c1 ZINC000151519223 1116328650 /nfs/dbraw/zinc/32/86/50/1116328650.db2.gz IIIZPUUFVPWIMO-NRFANRHFSA-N 1 0 372.484 4.036 20 10 FICDRO COc1ccc(N2CCC([NH2+]C[C@@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC000151863892 1118994278 /nfs/dbraw/zinc/99/42/78/1118994278.db2.gz UXNMZXLZGHQQQP-OAHLLOKOSA-N 1 0 360.448 4.336 20 10 FICDRO CC(C)(C)OC(=O)NCc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000313254412 1119180458 /nfs/dbraw/zinc/18/04/58/1119180458.db2.gz XXLHENUELNDKBD-GOSISDBHSA-N 1 0 368.477 4.194 20 10 FICDRO O=C(NC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1)c1ccccc1 ZINC000176496790 1119540235 /nfs/dbraw/zinc/54/02/35/1119540235.db2.gz AICFVLXJBPYMRQ-SFHVURJKSA-N 1 0 374.484 4.187 20 10 FICDRO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000153037051 1119835032 /nfs/dbraw/zinc/83/50/32/1119835032.db2.gz QIUJLTOBKRRTGU-UZLBHIALSA-N 1 0 354.469 4.309 20 10 FICDRO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F ZINC000153228275 1120370485 /nfs/dbraw/zinc/37/04/85/1120370485.db2.gz HODSWBDXYABCOT-HZPDHXFCSA-N 1 0 358.457 4.083 20 10 FICDRO C[NH+](C)CCOc1ccccc1-c1noc(-c2ccc(-n3cccc3)cc2)n1 ZINC000762078159 1120698802 /nfs/dbraw/zinc/69/88/02/1120698802.db2.gz BWQPYLLWKPLANU-UHFFFAOYSA-N 1 0 374.444 4.135 20 10 FICDRO CC[NH+](CC)CCC[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000915267968 1120902806 /nfs/dbraw/zinc/90/28/06/1120902806.db2.gz PKILTEYHDVRYCW-MRXNPFEDSA-N 1 0 373.516 4.474 20 10 FICDRO COc1ccc(N2CCC([NH2+]CCC3CC(OC(C)(C)C)C3)CC2)cc1 ZINC000762622442 1120940274 /nfs/dbraw/zinc/94/02/74/1120940274.db2.gz PKNKCRFFAIWDMH-UHFFFAOYSA-N 1 0 360.542 4.237 20 10 FICDRO Oc1cc2c(cc1C[NH+]1CCN(c3ccccn3)CC1)oc1ccccc12 ZINC000915795703 1121060689 /nfs/dbraw/zinc/06/06/89/1121060689.db2.gz VMPCBNAFRGVXIN-UHFFFAOYSA-N 1 0 359.429 4.009 20 10 FICDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@@H]1CCOC1 ZINC000763117304 1121131875 /nfs/dbraw/zinc/13/18/75/1121131875.db2.gz WDHJLYYROXPNIO-HZPDHXFCSA-N 1 0 352.438 4.055 20 10 FICDRO Cc1cc(C[NH2+]C2CCN(c3ccccn3)CC2)c(C)n1-c1ccccc1 ZINC000915876441 1121227514 /nfs/dbraw/zinc/22/75/14/1121227514.db2.gz UNXFICZZPHWBHN-UHFFFAOYSA-N 1 0 360.505 4.248 20 10 FICDRO COc1ccc(N2CCC([NH2+]Cc3c(Cl)cccc3N(C)C)CC2)cc1 ZINC001649028514 1121296374 /nfs/dbraw/zinc/29/63/74/1121296374.db2.gz FQEMYQBEKDDREY-UHFFFAOYSA-N 1 0 373.928 4.173 20 10 FICDRO CN(C)c1cc(F)c(C[NH2+]CCCc2nc3c(s2)CCCC3)cc1F ZINC001649054947 1121363152 /nfs/dbraw/zinc/36/31/52/1121363152.db2.gz SSSZHUQQGZROJB-UHFFFAOYSA-N 1 0 365.493 4.089 20 10 FICDRO CC[C@H]([NH2+]Cc1cccc(CN2CCCC2=O)c1)c1ccc(N(C)C)cc1 ZINC000153932156 1121465171 /nfs/dbraw/zinc/46/51/71/1121465171.db2.gz IGQXPOJEHCRHSM-QFIPXVFZSA-N 1 0 365.521 4.116 20 10 FICDRO CN(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001649091530 1121728534 /nfs/dbraw/zinc/72/85/34/1121728534.db2.gz QUAYYGJBOFHORH-ISKFKSNPSA-N 1 0 363.549 4.212 20 10 FICDRO Cc1cc(O)c(C[NH+]2CCN(Cc3csc(C(C)(C)C)n3)CC2)cc1C ZINC000917474885 1122322118 /nfs/dbraw/zinc/32/21/18/1122322118.db2.gz RYHLVDOLXGTPRV-UHFFFAOYSA-N 1 0 373.566 4.081 20 10 FICDRO Cc1ccc(N2CCC[N@H+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)cc1 ZINC000917484867 1122326817 /nfs/dbraw/zinc/32/68/17/1122326817.db2.gz IJJIUNGCNCTJJW-UHFFFAOYSA-N 1 0 368.521 4.416 20 10 FICDRO CCCc1ccc(C[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc1 ZINC000920181848 1123398814 /nfs/dbraw/zinc/39/88/14/1123398814.db2.gz CVBJYIVHETZQGR-UHFFFAOYSA-N 1 0 356.485 4.029 20 10 FICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCN(c3ccc(F)cc3)C2)cc1 ZINC000920183440 1123399440 /nfs/dbraw/zinc/39/94/40/1123399440.db2.gz NYGBZPRJPOMVJR-IBGZPJMESA-N 1 0 355.501 4.288 20 10 FICDRO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000921057226 1123558606 /nfs/dbraw/zinc/55/86/06/1123558606.db2.gz VDSYYXQKPMXYAJ-SJLPKXTDSA-N 1 0 354.494 4.062 20 10 FICDRO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)c(C)n1-c1cccc(C)c1 ZINC000921207515 1123583921 /nfs/dbraw/zinc/58/39/21/1123583921.db2.gz KFKBDINNDQLRLD-OAQYLSRUSA-N 1 0 365.521 4.103 20 10 FICDRO Cc1ccsc1C[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237782860 1124076179 /nfs/dbraw/zinc/07/61/79/1124076179.db2.gz KYOLBBZHSBFWQQ-CQSZACIVSA-N 1 0 352.450 4.417 20 10 FICDRO COc1cc(O)c(C[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cc1OC ZINC000180045431 1124202023 /nfs/dbraw/zinc/20/20/23/1124202023.db2.gz DNNMINQPNNHFQZ-UHFFFAOYSA-N 1 0 364.445 4.180 20 10 FICDRO COc1ccc(N2CC[NH+](Cn3ccc(=S)c4ccccc43)CC2)cc1 ZINC000068611935 1124296239 /nfs/dbraw/zinc/29/62/39/1124296239.db2.gz SHBYYCDPTKBPRN-UHFFFAOYSA-N 1 0 365.502 4.159 20 10 FICDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(N(C)C)cc1 ZINC000765910241 1124418969 /nfs/dbraw/zinc/41/89/69/1124418969.db2.gz YAGCFGBUCFGTMJ-KZULUSFZSA-N 1 0 353.293 4.444 20 10 FICDRO COc1cccc(C([NH2+]Cc2cc(F)ccc2O)c2cccc(OC)c2)c1 ZINC000180826205 1124446145 /nfs/dbraw/zinc/44/61/45/1124446145.db2.gz BJLAKJFCRYEXSQ-UHFFFAOYSA-N 1 0 367.420 4.428 20 10 FICDRO COc1ccc([C@H](CCO)[NH2+]Cc2cc(-c3ccccc3)ccc2O)cc1 ZINC000763495308 1124937570 /nfs/dbraw/zinc/93/75/70/1124937570.db2.gz BWMXMZAYXROLBI-QFIPXVFZSA-N 1 0 363.457 4.281 20 10 FICDRO Oc1c(CNc2cc(OC(F)F)cc[nH+]2)cc(Cl)c2cccnc12 ZINC001168526287 1125230790 /nfs/dbraw/zinc/23/07/90/1125230790.db2.gz VCTVGGSXSWDMEV-UHFFFAOYSA-N 1 0 351.740 4.202 20 10 FICDRO Cc1ccc(C2(O)CC[NH+](Cc3cccc(C(C)(C)C)c3O)CC2)cc1 ZINC001143103374 1125245037 /nfs/dbraw/zinc/24/50/37/1125245037.db2.gz BBGCTNXGFOIFHP-UHFFFAOYSA-N 1 0 353.506 4.482 20 10 FICDRO CC(=O)c1ccc(N2CC[NH+](Cc3cccc(C(C)(C)C)c3O)CC2)cc1 ZINC001143110541 1125283361 /nfs/dbraw/zinc/28/33/61/1125283361.db2.gz IPVISQMGJICAKO-UHFFFAOYSA-N 1 0 366.505 4.215 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2coc(-c3ccc(F)c(F)c3)n2)c1 ZINC000182368807 1125436500 /nfs/dbraw/zinc/43/65/00/1125436500.db2.gz PSIARYBSSXTEJA-LLVKDONJSA-N 1 0 360.360 4.185 20 10 FICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(-n3nc(C)cc3C)cc2)c1 ZINC000182376214 1125439472 /nfs/dbraw/zinc/43/94/72/1125439472.db2.gz QSHPNNKBNANZTC-MRXNPFEDSA-N 1 0 351.450 4.054 20 10 FICDRO