smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]([NH2+]Cc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1Cl ZINC000007018395 568425784 /nfs/dbraw/zinc/42/57/84/568425784.db2.gz JGQXMVXMDNGONT-INIZCTEOSA-N 1 0 364.876 5.443 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1Cl ZINC000007018397 568425843 /nfs/dbraw/zinc/42/58/43/568425843.db2.gz JGQXMVXMDNGONT-MRXNPFEDSA-N 1 0 364.876 5.443 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(=O)Nc2ccccc2)cc1)c1cccc(Cl)c1 ZINC000007018413 568425869 /nfs/dbraw/zinc/42/58/69/568425869.db2.gz ZOWSVYNIOBKRIB-MRXNPFEDSA-N 1 0 364.876 5.443 20 0 FKADRO COc1ccc(-c2nc(CN(C)Cc3ccc(Cl)cc3)cs2)cc1 ZINC000007444308 568236400 /nfs/dbraw/zinc/23/64/00/568236400.db2.gz ALTLYNJOYMWMKC-UHFFFAOYSA-N 1 0 358.894 5.104 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000010137232 207296087 /nfs/dbraw/zinc/29/60/87/207296087.db2.gz OVLJUSCLSXWOOD-NRFANRHFSA-N 1 0 358.913 5.389 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000012672626 220016513 /nfs/dbraw/zinc/01/65/13/220016513.db2.gz IMTGGYWWSDBAJU-SGTLLEGYSA-N 1 0 363.288 5.061 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000012672635 207405711 /nfs/dbraw/zinc/40/57/11/207405711.db2.gz IMTGGYWWSDBAJU-XIKOKIGWSA-N 1 0 363.288 5.061 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000012672642 207407292 /nfs/dbraw/zinc/40/72/92/207407292.db2.gz IMTGGYWWSDBAJU-KPZWWZAWSA-N 1 0 363.288 5.061 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000012672651 220016983 /nfs/dbraw/zinc/01/69/83/220016983.db2.gz IMTGGYWWSDBAJU-KZULUSFZSA-N 1 0 363.288 5.061 20 0 FKADRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000017311186 568255990 /nfs/dbraw/zinc/25/59/90/568255990.db2.gz FINWCADELKWSHA-YWZLYKJASA-N 1 0 356.897 5.261 20 0 FKADRO C[N@H+](CCC(=O)Nc1ccccc1Cl)Cc1cccc(Cl)c1Cl ZINC000022194296 220378566 /nfs/dbraw/zinc/37/85/66/220378566.db2.gz CXQKMEKGKLMXRU-UHFFFAOYSA-N 1 0 371.695 5.107 20 0 FKADRO O=C(CC[N@@H+]1CCC[C@@H]1c1cccs1)Nc1c(Cl)cccc1Cl ZINC000022199304 211339199 /nfs/dbraw/zinc/33/91/99/211339199.db2.gz NHYAZNYECOMSGE-CQSZACIVSA-N 1 0 369.317 5.221 20 0 FKADRO O=C(CC[N@@H+]1CCC[C@H]1c1cccs1)Nc1c(Cl)cccc1Cl ZINC000022199307 211339763 /nfs/dbraw/zinc/33/97/63/211339763.db2.gz NHYAZNYECOMSGE-AWEZNQCLSA-N 1 0 369.317 5.221 20 0 FKADRO C[C@H]1c2ccsc2CC[N@H+]1CCC(=O)Nc1c(Cl)cccc1Cl ZINC000022199884 220378150 /nfs/dbraw/zinc/37/81/50/220378150.db2.gz RCVZDWYBHSOQQD-NSHDSACASA-N 1 0 369.317 5.003 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Oc2ccccc2)c1)c1ccc2c(c1)OCCO2 ZINC000022774533 568270411 /nfs/dbraw/zinc/27/04/11/568270411.db2.gz HXZLYZSCYQQQLD-QGZVFWFLSA-N 1 0 361.441 5.101 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(Oc2ccccc2)c1)c1ccc2c(c1)OCCO2 ZINC000022774537 568270493 /nfs/dbraw/zinc/27/04/93/568270493.db2.gz HXZLYZSCYQQQLD-KRWDZBQOSA-N 1 0 361.441 5.101 20 0 FKADRO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1cccc2ccccc21 ZINC000022788070 220398238 /nfs/dbraw/zinc/39/82/38/220398238.db2.gz WSHNRYQTORVHMM-CQSZACIVSA-N 1 0 353.849 5.115 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)c1ccc(Cl)cc1F)C1CCCCC1 ZINC000026492449 568411934 /nfs/dbraw/zinc/41/19/34/568411934.db2.gz MKHMBGHQBQIZHR-UHFFFAOYSA-N 1 0 374.887 5.496 20 0 FKADRO Cc1c(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)sc2cccc(F)c12 ZINC000028170428 568278487 /nfs/dbraw/zinc/27/84/87/568278487.db2.gz FLYJAZYRGDPNPR-UHFFFAOYSA-N 1 0 368.477 5.197 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Br)s1)c1cccc(C(F)(F)F)c1 ZINC000035009984 210336409 /nfs/dbraw/zinc/33/64/09/210336409.db2.gz VSIVCTITAOIISY-SECBINFHSA-N 1 0 364.230 5.380 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2sccc2Br)cc1 ZINC000037292248 211092240 /nfs/dbraw/zinc/09/22/40/211092240.db2.gz WITUOYVMWZEIDX-MNOVXSKESA-N 1 0 356.354 5.644 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2sccc2Br)cc1 ZINC000037292250 211092679 /nfs/dbraw/zinc/09/26/79/211092679.db2.gz WITUOYVMWZEIDX-GHMZBOCLSA-N 1 0 356.354 5.644 20 0 FKADRO Clc1ccc(C[NH2+]Cc2ccc(Br)s2)c(Cl)c1 ZINC000037977146 205037246 /nfs/dbraw/zinc/03/72/46/205037246.db2.gz FQYLQSZYHHRHQZ-UHFFFAOYSA-N 1 0 351.096 5.107 20 0 FKADRO Clc1ccc([C@@H]([NH2+]Cc2ccc(Br)s2)C2CC2)cc1 ZINC000037977312 211327383 /nfs/dbraw/zinc/32/73/83/211327383.db2.gz OHXNSMUYXGRKNU-HNNXBMFYSA-N 1 0 356.716 5.405 20 0 FKADRO Clc1ccc(C[NH2+]Cc2ccc(Br)s2)cc1Cl ZINC000037985108 205037693 /nfs/dbraw/zinc/03/76/93/205037693.db2.gz SKETVHPHENOSHP-UHFFFAOYSA-N 1 0 351.096 5.107 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(C(F)(F)F)c1)c1ccc(Br)s1 ZINC000038001669 211340926 /nfs/dbraw/zinc/34/09/26/211340926.db2.gz OOUGPWLOXUJSBW-VIFPVBQESA-N 1 0 364.230 5.380 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1)c1ccc(Br)s1 ZINC000038001670 211340310 /nfs/dbraw/zinc/34/03/10/211340310.db2.gz OOUGPWLOXUJSBW-SECBINFHSA-N 1 0 364.230 5.380 20 0 FKADRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000038002591 211344486 /nfs/dbraw/zinc/34/44/86/211344486.db2.gz QVGPWBFHUPLORE-NEPJUHHUSA-N 1 0 354.313 5.239 20 0 FKADRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000038002592 211344761 /nfs/dbraw/zinc/34/47/61/211344761.db2.gz QVGPWBFHUPLORE-RYUDHWBXSA-N 1 0 354.313 5.239 20 0 FKADRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)s1 ZINC000038002594 211344863 /nfs/dbraw/zinc/34/48/63/211344863.db2.gz QVGPWBFHUPLORE-NWDGAFQWSA-N 1 0 354.313 5.239 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(Br)s1)c1ccc(Cl)s1 ZINC000038002691 208196709 /nfs/dbraw/zinc/19/67/09/208196709.db2.gz JAUKQLCTUCDFMI-YUMQZZPRSA-N 1 0 350.734 5.637 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1ccc(Br)s1 ZINC000038002693 208196747 /nfs/dbraw/zinc/19/67/47/208196747.db2.gz JAUKQLCTUCDFMI-SFYZADRCSA-N 1 0 350.734 5.637 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc(Br)s1)c1ccc(Cl)s1 ZINC000038002694 205037393 /nfs/dbraw/zinc/03/73/93/205037393.db2.gz JAUKQLCTUCDFMI-HTQZYQBOSA-N 1 0 350.734 5.637 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(Br)s1)c1ccc(OC)cc1 ZINC000038002864 211342507 /nfs/dbraw/zinc/34/25/07/211342507.db2.gz JZLMPZDMKGLJJE-SMDDNHRTSA-N 1 0 354.313 5.321 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(Br)s1)c1ccc(OC)cc1 ZINC000038002865 211342259 /nfs/dbraw/zinc/34/22/59/211342259.db2.gz JZLMPZDMKGLJJE-RISCZKNCSA-N 1 0 354.313 5.321 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)s2)cc1F ZINC000038002924 211342318 /nfs/dbraw/zinc/34/23/18/211342318.db2.gz SEWZCQALSWQYOF-ZJUUUORDSA-N 1 0 358.276 5.070 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Br)s2)cc1F ZINC000038002925 211342011 /nfs/dbraw/zinc/34/20/11/211342011.db2.gz SEWZCQALSWQYOF-VHSXEESVSA-N 1 0 358.276 5.070 20 0 FKADRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000038002995 211341424 /nfs/dbraw/zinc/34/14/24/211341424.db2.gz RWWOUCQJNXTFOD-UWVGGRQHSA-N 1 0 358.276 5.070 20 0 FKADRO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)s1 ZINC000038002996 211342955 /nfs/dbraw/zinc/34/29/55/211342955.db2.gz RWWOUCQJNXTFOD-VHSXEESVSA-N 1 0 358.276 5.070 20 0 FKADRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000038002997 211342464 /nfs/dbraw/zinc/34/24/64/211342464.db2.gz RWWOUCQJNXTFOD-ZJUUUORDSA-N 1 0 358.276 5.070 20 0 FKADRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(Br)s1 ZINC000038002998 211341716 /nfs/dbraw/zinc/34/17/16/211341716.db2.gz RWWOUCQJNXTFOD-NXEZZACHSA-N 1 0 358.276 5.070 20 0 FKADRO Clc1cc(Cl)cc(C[NH2+]Cc2ccc(Br)s2)c1 ZINC000038018325 205038662 /nfs/dbraw/zinc/03/86/62/205038662.db2.gz IXHYLLPSPOQDDU-UHFFFAOYSA-N 1 0 351.096 5.107 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Br)s1)c1ccccc1C(F)(F)F ZINC000038018569 211354153 /nfs/dbraw/zinc/35/41/53/211354153.db2.gz RYLCEHHTAUPMBT-VIFPVBQESA-N 1 0 364.230 5.380 20 0 FKADRO CC[NH+](CC)CCN(Cc1cccs1)C(=O)Nc1c(C)cc(C)cc1C ZINC000043150606 567849243 /nfs/dbraw/zinc/84/92/43/567849243.db2.gz QLMOSCWJPVWMGJ-UHFFFAOYSA-N 1 0 373.566 5.049 20 0 FKADRO O=C(Nc1ccccc1-c1ccccc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000044914739 208323528 /nfs/dbraw/zinc/32/35/28/208323528.db2.gz AOUOAYHPSYOCQR-QFIPXVFZSA-N 1 0 370.496 5.204 20 0 FKADRO O=C(Nc1ccccc1-c1ccccc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000044914743 208323009 /nfs/dbraw/zinc/32/30/09/208323009.db2.gz AOUOAYHPSYOCQR-JOCHJYFZSA-N 1 0 370.496 5.204 20 0 FKADRO CC[NH+](CC)Cc1cccc(NC(=O)c2cc(Cl)sc2Cl)c1 ZINC000047447803 211854473 /nfs/dbraw/zinc/85/44/73/211854473.db2.gz VDTZSOLRSNVKGF-UHFFFAOYSA-N 1 0 357.306 5.149 20 0 FKADRO CCCCOc1ccc(-c2nnc(CN(C)[C@@H](C)c3cccs3)o2)cc1 ZINC000051501847 568048305 /nfs/dbraw/zinc/04/83/05/568048305.db2.gz XAWQKEITAVBSCQ-HNNXBMFYSA-N 1 0 371.506 5.170 20 0 FKADRO CCCCOc1ccc(-c2nnc(CN(C)[C@H](C)c3cccs3)o2)cc1 ZINC000051501848 568048332 /nfs/dbraw/zinc/04/83/32/568048332.db2.gz XAWQKEITAVBSCQ-OAHLLOKOSA-N 1 0 371.506 5.170 20 0 FKADRO C[N@@H+](Cc1csc(-c2ccco2)n1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051582023 568090890 /nfs/dbraw/zinc/09/08/90/568090890.db2.gz WKKGJCARIJRFDT-FXAWDEMLSA-N 1 0 368.502 5.003 20 0 FKADRO C[N@@H+](Cc1csc(-c2ccco2)n1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051582024 568090863 /nfs/dbraw/zinc/09/08/63/568090863.db2.gz WKKGJCARIJRFDT-YLJYHZDGSA-N 1 0 368.502 5.003 20 0 FKADRO CCCCC[N@H+](Cc1nnc(-c2c(C)onc2-c2ccccc2)o1)C(C)C ZINC000051708996 568191270 /nfs/dbraw/zinc/19/12/70/568191270.db2.gz UZPWAGAWBPFIAN-UHFFFAOYSA-N 1 0 368.481 5.101 20 0 FKADRO Clc1ccc2oc(C3CC[NH+](Cc4nc5ccccc5o4)CC3)nc2c1 ZINC000052993606 221041217 /nfs/dbraw/zinc/04/12/17/221041217.db2.gz DNWWBBRCJHAPSI-UHFFFAOYSA-N 1 0 367.836 5.002 20 0 FKADRO C[C@H](c1ccccc1F)[N@H+](C)CCC(=O)Nc1c(Cl)cccc1Cl ZINC000053125046 221042883 /nfs/dbraw/zinc/04/28/83/221042883.db2.gz AXOJLDHHYZAKGF-GFCCVEGCSA-N 1 0 369.267 5.154 20 0 FKADRO CC(C)Sc1ccccc1C(=O)Nc1ccc(CC[NH+]2CCCC2)cc1 ZINC000056326491 205229796 /nfs/dbraw/zinc/22/97/96/205229796.db2.gz IGEPTPIILWIXKL-UHFFFAOYSA-N 1 0 368.546 5.078 20 0 FKADRO O=C(Nc1ccccc1-c1ccccc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000060549973 221131972 /nfs/dbraw/zinc/13/19/72/221131972.db2.gz YCNBHOYWVQVXAQ-UHFFFAOYSA-N 1 0 356.469 5.202 20 0 FKADRO COc1ccc(C[NH2+]C2c3ccccc3-c3ccccc32)cc1OC(F)F ZINC000060842194 567855313 /nfs/dbraw/zinc/85/53/13/567855313.db2.gz HOKZOAUAFQWETC-UHFFFAOYSA-N 1 0 367.395 5.156 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2csc3ccccc23)cc1 ZINC000061001184 567859049 /nfs/dbraw/zinc/85/90/49/567859049.db2.gz UVNJIIXYTDRWRS-OAHLLOKOSA-N 1 0 367.518 5.282 20 0 FKADRO Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]Cc1cccs1 ZINC000061012571 567859272 /nfs/dbraw/zinc/85/92/72/567859272.db2.gz XEGQMYNCIWAENB-UHFFFAOYSA-N 1 0 359.498 5.199 20 0 FKADRO c1sc2ccccc2c1C[NH2+]Cc1ccccc1OCc1ccncc1 ZINC000061048801 567860182 /nfs/dbraw/zinc/86/01/82/567860182.db2.gz JTNZVAPQCNGSDF-UHFFFAOYSA-N 1 0 360.482 5.165 20 0 FKADRO COc1cc(C[NH2+][C@H](c2cccs2)c2ccc(Cl)cc2)cc(OC)c1 ZINC000061135146 567859325 /nfs/dbraw/zinc/85/93/25/567859325.db2.gz CMCWYELPUUZUQF-FQEVSTJZSA-N 1 0 373.905 5.298 20 0 FKADRO COc1cc(C[NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)cc(OC)c1 ZINC000062422431 567951762 /nfs/dbraw/zinc/95/17/62/567951762.db2.gz KBYNPGYULGIUKJ-QFIPXVFZSA-N 1 0 367.876 5.236 20 0 FKADRO CCOc1cccc([C@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2OC)c1 ZINC000063319342 567972962 /nfs/dbraw/zinc/97/29/62/567972962.db2.gz CHGVSXNVHWJIMH-LBPRGKRZSA-N 1 0 354.277 5.252 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)c1nccc2ccccc21)C1CCCCC1 ZINC000063474406 221142048 /nfs/dbraw/zinc/14/20/48/221142048.db2.gz ADICUOZXTWIQLQ-UHFFFAOYSA-N 1 0 373.500 5.252 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000063523243 567980699 /nfs/dbraw/zinc/98/06/99/567980699.db2.gz GLJMPLVHNBCGMK-CQSZACIVSA-N 1 0 362.926 5.084 20 0 FKADRO C[C@@H](c1ccc2ccccc2c1)[N@H+](Cc1cccc(C(=O)N(C)C)c1)C1CC1 ZINC000063577991 567877369 /nfs/dbraw/zinc/87/73/69/567877369.db2.gz YDPQWMGJLSKCSU-SFHVURJKSA-N 1 0 372.512 5.267 20 0 FKADRO COc1cc(C[NH2+]C(C)(C)c2ccccc2)ccc1OCc1ccccc1 ZINC000065275130 568048341 /nfs/dbraw/zinc/04/83/41/568048341.db2.gz RSPPFLAGWHWQCF-UHFFFAOYSA-N 1 0 361.485 5.299 20 0 FKADRO Cc1cc(C)cc(C[NH2+][C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000065890980 568063614 /nfs/dbraw/zinc/06/36/14/568063614.db2.gz LQAFPRXWCSFNCD-IBGZPJMESA-N 1 0 358.485 5.407 20 0 FKADRO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000066898425 568068306 /nfs/dbraw/zinc/06/83/06/568068306.db2.gz HQZUUVPSIWGUMU-WBVHZDCISA-N 1 0 353.491 5.129 20 0 FKADRO CCOc1ccc(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)cc1 ZINC000069525996 221325961 /nfs/dbraw/zinc/32/59/61/221325961.db2.gz KUATUQGMFVFQHV-UHFFFAOYSA-N 1 0 366.505 5.102 20 0 FKADRO Clc1ccc(C2([NH2+]Cc3ccc(OCc4ccccn4)cc3)CC2)cc1 ZINC000069878583 568100396 /nfs/dbraw/zinc/10/03/96/568100396.db2.gz QYIOUMVSTIIBSK-UHFFFAOYSA-N 1 0 364.876 5.093 20 0 FKADRO Clc1ccc(C2([NH2+]Cc3ccc(OCc4ccncc4)cc3)CC2)cc1 ZINC000069878647 568100377 /nfs/dbraw/zinc/10/03/77/568100377.db2.gz ZLAJOVPWBWSZMK-UHFFFAOYSA-N 1 0 364.876 5.093 20 0 FKADRO Cc1cccc(C(C)C)c1NC(=O)C[NH2+]C(C)(C)c1ccc(Cl)cc1 ZINC000072097369 568346976 /nfs/dbraw/zinc/34/69/76/568346976.db2.gz CLNCEQWMYVKZFQ-UHFFFAOYSA-N 1 0 358.913 5.235 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(F)c2)cc1Br ZINC000097393789 222178708 /nfs/dbraw/zinc/17/87/08/222178708.db2.gz NZCRPDUAQUSSMY-MNOVXSKESA-N 1 0 370.237 5.148 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)cc1Br ZINC000097393790 206543314 /nfs/dbraw/zinc/54/33/14/206543314.db2.gz NZCRPDUAQUSSMY-GHMZBOCLSA-N 1 0 370.237 5.148 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)cc1Br ZINC000097393791 222179354 /nfs/dbraw/zinc/17/93/54/222179354.db2.gz YRZASPYNHVFOKA-QWRGUYRKSA-N 1 0 370.237 5.148 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)cc1Br ZINC000097393793 222179265 /nfs/dbraw/zinc/17/92/65/222179265.db2.gz YRZASPYNHVFOKA-WDEREUQCSA-N 1 0 370.237 5.148 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)cc1Br ZINC000097393795 222178754 /nfs/dbraw/zinc/17/87/54/222178754.db2.gz PJYFLGWLBVRFMA-QWRGUYRKSA-N 1 0 370.237 5.148 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)cc1Br ZINC000097393796 222178762 /nfs/dbraw/zinc/17/87/62/222178762.db2.gz PJYFLGWLBVRFMA-MNOVXSKESA-N 1 0 370.237 5.148 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)CCc1ccccc1)C1CCCCC1 ZINC000105444559 222369556 /nfs/dbraw/zinc/36/95/56/222369556.db2.gz XHKILQGWKDIDLO-UHFFFAOYSA-N 1 0 350.506 5.022 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)c1cc2ccccc2[nH]1)C1CCCCC1 ZINC000105615802 206008886 /nfs/dbraw/zinc/00/88/86/206008886.db2.gz GGUBFONDCRFQQX-UHFFFAOYSA-N 1 0 361.489 5.185 20 0 FKADRO C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)C1 ZINC000107591175 209277502 /nfs/dbraw/zinc/27/75/02/209277502.db2.gz VKHUZGHGOOSPQT-GOSISDBHSA-N 1 0 374.484 5.431 20 0 FKADRO C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)C1 ZINC000107591179 206021130 /nfs/dbraw/zinc/02/11/30/206021130.db2.gz VKHUZGHGOOSPQT-SFHVURJKSA-N 1 0 374.484 5.431 20 0 FKADRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc(Cl)ccc2F)cc1 ZINC000107685510 206021310 /nfs/dbraw/zinc/02/13/10/206021310.db2.gz PFAXUBKCZHPMJY-CQSZACIVSA-N 1 0 360.860 5.106 20 0 FKADRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc(Cl)ccc2F)cc1 ZINC000107685514 222398482 /nfs/dbraw/zinc/39/84/82/222398482.db2.gz PFAXUBKCZHPMJY-AWEZNQCLSA-N 1 0 360.860 5.106 20 0 FKADRO C[C@H](c1cccc(Cl)c1)[N@H+](C)CCC(=O)Nc1ccc(Cl)cc1F ZINC000108085768 209282833 /nfs/dbraw/zinc/28/28/33/209282833.db2.gz HHQDNPJIQIXMDK-GFCCVEGCSA-N 1 0 369.267 5.154 20 0 FKADRO CC[C@@H](C(=O)Nc1ccc(-c2cn3c(n2)CCCC3)cc1)c1ccccc1 ZINC000108315398 206028931 /nfs/dbraw/zinc/02/89/31/206028931.db2.gz WHFCWXQGGGEMBF-HXUWFJFHSA-N 1 0 359.473 5.019 20 0 FKADRO C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(C(=O)Nc2ccccc2)CC1 ZINC000108446507 209287800 /nfs/dbraw/zinc/28/78/00/209287800.db2.gz PRVUZRGCLUZGTJ-SFHVURJKSA-N 1 0 358.485 5.252 20 0 FKADRO C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(C(=O)Nc2ccccc2)CC1 ZINC000108446510 206032464 /nfs/dbraw/zinc/03/24/64/206032464.db2.gz PRVUZRGCLUZGTJ-GOSISDBHSA-N 1 0 358.485 5.252 20 0 FKADRO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000109011473 206044288 /nfs/dbraw/zinc/04/42/88/206044288.db2.gz BMIFKAPUYVUTRS-JOCHJYFZSA-N 1 0 362.517 5.209 20 0 FKADRO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccc(OCc2ccccn2)cc1 ZINC000109013267 209295573 /nfs/dbraw/zinc/29/55/73/209295573.db2.gz AKKIZIJRNVMENY-UHFFFAOYSA-N 1 0 372.921 5.398 20 0 FKADRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2sccc2C2CC2)cc1 ZINC000109294703 209302576 /nfs/dbraw/zinc/30/25/76/209302576.db2.gz VQGYUYNFZFRNFF-HNNXBMFYSA-N 1 0 354.519 5.252 20 0 FKADRO CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC(NC(=O)Nc2ccccc2)CC1 ZINC000109479936 206059235 /nfs/dbraw/zinc/05/92/35/206059235.db2.gz IMRAPAPXIUKOMS-HXUWFJFHSA-N 1 0 371.912 5.077 20 0 FKADRO Cc1ccc(-c2nnc(C[N@H+](C3CC3)[C@H]3CCCc4ccccc43)o2)cc1 ZINC000109866222 209314531 /nfs/dbraw/zinc/31/45/31/209314531.db2.gz QKOGAGYJTWVGTF-NRFANRHFSA-N 1 0 359.473 5.087 20 0 FKADRO CC[N@H+](Cc1ccc(C(=O)Nc2cc(C)c(Cl)cc2OC)cc1)C(C)C ZINC000110093212 206069033 /nfs/dbraw/zinc/06/90/33/206069033.db2.gz FJNMFBCUZKKMHU-UHFFFAOYSA-N 1 0 374.912 5.140 20 0 FKADRO C[C@@H](c1ccccc1Cl)[N@H+](CCC(=O)Nc1ccccc1F)C1CC1 ZINC000110182074 206070999 /nfs/dbraw/zinc/07/09/99/206070999.db2.gz DOFSAFNADCGZPK-AWEZNQCLSA-N 1 0 360.860 5.033 20 0 FKADRO C[C@H](c1ccccc1Cl)[N@H+](CCC(=O)Nc1ccccc1F)C1CC1 ZINC000110182077 206071694 /nfs/dbraw/zinc/07/16/94/206071694.db2.gz DOFSAFNADCGZPK-CQSZACIVSA-N 1 0 360.860 5.033 20 0 FKADRO C[C@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000182006244 568400126 /nfs/dbraw/zinc/40/01/26/568400126.db2.gz LNRORTCKSPVWBS-HAWMADMCSA-N 1 0 363.482 5.174 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000182006257 568400175 /nfs/dbraw/zinc/40/01/75/568400175.db2.gz LNRORTCKSPVWBS-WZQKQDCOSA-N 1 0 363.482 5.174 20 0 FKADRO C[C@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000182006281 568400183 /nfs/dbraw/zinc/40/01/83/568400183.db2.gz LNRORTCKSPVWBS-QWXGXRTQSA-N 1 0 363.482 5.174 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000182006304 568400179 /nfs/dbraw/zinc/40/01/79/568400179.db2.gz LNRORTCKSPVWBS-PVPMGCCUSA-N 1 0 363.482 5.174 20 0 FKADRO CCO[C@@H](C)c1nc(CN[C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186183478 567890611 /nfs/dbraw/zinc/89/06/11/567890611.db2.gz JLINCOYZEMLOPO-MNOVXSKESA-N 1 0 359.322 5.398 20 0 FKADRO CCO[C@H](C)c1nc(CN[C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186183495 567890596 /nfs/dbraw/zinc/89/05/96/567890596.db2.gz JLINCOYZEMLOPO-GHMZBOCLSA-N 1 0 359.322 5.398 20 0 FKADRO C[C@@H](NCc1nc(C(F)(F)F)cs1)c1cc(Cl)ccc1Cl ZINC000186184410 567890725 /nfs/dbraw/zinc/89/07/25/567890725.db2.gz UHIDXDBWKMJROW-SSDOTTSWSA-N 1 0 355.212 5.320 20 0 FKADRO Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(NC(=O)C(C)C)cc1)CCS2 ZINC000186958260 568033978 /nfs/dbraw/zinc/03/39/78/568033978.db2.gz PYDGKTIAOQREFQ-FQEVSTJZSA-N 1 0 368.546 5.225 20 0 FKADRO Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(NC(=O)C(C)C)cc1)CCS2 ZINC000186958278 568034015 /nfs/dbraw/zinc/03/40/15/568034015.db2.gz PYDGKTIAOQREFQ-HXUWFJFHSA-N 1 0 368.546 5.225 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000186963001 568027769 /nfs/dbraw/zinc/02/77/69/568027769.db2.gz URJIXLPHWQWWHJ-YWZLYKJASA-N 1 0 354.519 5.150 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000186963019 568027754 /nfs/dbraw/zinc/02/77/54/568027754.db2.gz URJIXLPHWQWWHJ-MGPUTAFESA-N 1 0 354.519 5.150 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000186963037 568027790 /nfs/dbraw/zinc/02/77/90/568027790.db2.gz URJIXLPHWQWWHJ-QRWLVFNGSA-N 1 0 354.519 5.150 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000186963056 568027752 /nfs/dbraw/zinc/02/77/52/568027752.db2.gz URJIXLPHWQWWHJ-FOIQADDNSA-N 1 0 354.519 5.150 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)s1 ZINC000226076806 222882151 /nfs/dbraw/zinc/88/21/51/222882151.db2.gz BMCDMFQQUITESJ-IVZWLZJFSA-N 1 0 356.251 5.282 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)s1 ZINC000226076822 206508445 /nfs/dbraw/zinc/50/84/45/206508445.db2.gz BMCDMFQQUITESJ-AEJSXWLSSA-N 1 0 356.251 5.282 20 0 FKADRO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2cnn(CC)c2)c2cccs2)cc1 ZINC000236902247 568253073 /nfs/dbraw/zinc/25/30/73/568253073.db2.gz WJVDMOUXNKBWMI-IIBYNOLFSA-N 1 0 353.535 5.357 20 0 FKADRO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2scnc2C)c2cccs2)cc1 ZINC000236902389 568253139 /nfs/dbraw/zinc/25/31/39/568253139.db2.gz FHVXUSGYTSCMSN-JLTOFOAXSA-N 1 0 356.560 5.906 20 0 FKADRO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2cnn(CC)c2)c2cccs2)cc1 ZINC000236903249 568253961 /nfs/dbraw/zinc/25/39/61/568253961.db2.gz WJVDMOUXNKBWMI-IERDGZPVSA-N 1 0 353.535 5.357 20 0 FKADRO CC[C@@H](C)c1ccc([C@H](NCc2nc(C)cs2)c2cccs2)cc1 ZINC000236903323 568254236 /nfs/dbraw/zinc/25/42/36/568254236.db2.gz ZFLULEGXTKEVGU-VLIAUNLRSA-N 1 0 356.560 5.906 20 0 FKADRO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2scnc2C)c2cccs2)cc1 ZINC000236903352 568254359 /nfs/dbraw/zinc/25/43/59/568254359.db2.gz FHVXUSGYTSCMSN-VLIAUNLRSA-N 1 0 356.560 5.906 20 0 FKADRO CCCOc1c(Cl)cc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1OC ZINC000236905051 568261842 /nfs/dbraw/zinc/26/18/42/568261842.db2.gz AASMRKUVCGUJEM-UHFFFAOYSA-N 1 0 363.860 5.055 20 0 FKADRO CC[C@H](C)c1ccc([C@@H](N[C@H](C)c2cnccn2)c2cccs2)cc1 ZINC000248067884 568282323 /nfs/dbraw/zinc/28/23/23/568282323.db2.gz ZYBSYFZXCXBKIW-GCKMJXCFSA-N 1 0 351.519 5.492 20 0 FKADRO C[C@H](C[N@H+](C)[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1)c1nccs1 ZINC000248438528 568637787 /nfs/dbraw/zinc/63/77/87/568637787.db2.gz BYVKYEAOZOLNIK-CHWSQXEVSA-N 1 0 361.898 5.248 20 0 FKADRO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+](C)C[C@H](C)c1nccs1 ZINC000248438529 568637819 /nfs/dbraw/zinc/63/78/19/568637819.db2.gz BYVKYEAOZOLNIK-QWHCGFSZSA-N 1 0 361.898 5.248 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(Cl)cc1F ZINC000248448159 568639697 /nfs/dbraw/zinc/63/96/97/568639697.db2.gz NTXVELMCRDXGHR-SLXPHNIWSA-N 1 0 367.917 5.264 20 0 FKADRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(Cl)cc1F ZINC000248448161 568639999 /nfs/dbraw/zinc/63/99/99/568639999.db2.gz NTXVELMCRDXGHR-XMFXQIMHSA-N 1 0 367.917 5.264 20 0 FKADRO Fc1cccc([C@H]([NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccn2)c1 ZINC000248492582 568665294 /nfs/dbraw/zinc/66/52/94/568665294.db2.gz OSVWNWQNLMKJCT-HFTRVMKXSA-N 1 0 352.375 5.021 20 0 FKADRO Fc1cccc([C@H]([NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccn2)c1 ZINC000248492584 568665414 /nfs/dbraw/zinc/66/54/14/568665414.db2.gz OSVWNWQNLMKJCT-KYJSFNMBSA-N 1 0 352.375 5.021 20 0 FKADRO CN1CCC[C@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)[C@H]1c1cccs1 ZINC000248615632 568668510 /nfs/dbraw/zinc/66/85/10/568668510.db2.gz KDGORNAXBFMELZ-CSKOPFHVSA-N 1 0 374.516 5.089 20 0 FKADRO CN1CCC[C@@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)[C@H]1c1cccs1 ZINC000248615641 568668784 /nfs/dbraw/zinc/66/87/84/568668784.db2.gz KDGORNAXBFMELZ-OQGULXLBSA-N 1 0 374.516 5.089 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Br)cc1 ZINC000248727809 568715346 /nfs/dbraw/zinc/71/53/46/568715346.db2.gz CYDSPQCEWZENFS-GDIGMMSISA-N 1 0 360.295 5.020 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Br)cc1 ZINC000248727810 568715613 /nfs/dbraw/zinc/71/56/13/568715613.db2.gz CYDSPQCEWZENFS-ZOCIIQOWSA-N 1 0 360.295 5.020 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc(Br)cs1 ZINC000248733984 568716146 /nfs/dbraw/zinc/71/61/46/568716146.db2.gz MSSCJPMACSPXCQ-APHBMKBZSA-N 1 0 366.324 5.082 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)c1cc(Br)cs1 ZINC000248733987 568716164 /nfs/dbraw/zinc/71/61/64/568716164.db2.gz MSSCJPMACSPXCQ-VBNZEHGJSA-N 1 0 366.324 5.082 20 0 FKADRO C[C@@H]([NH2+]Cc1cccs1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000390880506 568449464 /nfs/dbraw/zinc/44/94/64/568449464.db2.gz STPVTMUXAHMEHK-SECBINFHSA-N 1 0 353.331 5.637 20 0 FKADRO C[C@H]([NH2+]Cc1cccs1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000390880521 568449620 /nfs/dbraw/zinc/44/96/20/568449620.db2.gz STPVTMUXAHMEHK-VIFPVBQESA-N 1 0 353.331 5.637 20 0 FKADRO Brc1cc(C[NH2+]Cc2cc(-c3ccccc3)cs2)cs1 ZINC000397264776 568534232 /nfs/dbraw/zinc/53/42/32/568534232.db2.gz IQLXKTLPFJLQFR-UHFFFAOYSA-N 1 0 364.333 5.529 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)NC1CC[NH+](C2CCC2)CC1 ZINC000454151719 567863405 /nfs/dbraw/zinc/86/34/05/567863405.db2.gz DIFLWJUMCKTPDH-UHFFFAOYSA-N 1 0 357.542 5.072 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)NCCCC(C)(F)F)C1CCCCC1 ZINC000454234270 567888658 /nfs/dbraw/zinc/88/86/58/567888658.db2.gz YKVORJWMXRWHFY-UHFFFAOYSA-N 1 0 367.484 5.008 20 0 FKADRO C[NH+](C)Cc1cccc(NC(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000454337593 567945432 /nfs/dbraw/zinc/94/54/32/567945432.db2.gz VXSPWSWEOOMTFG-FQEVSTJZSA-N 1 0 371.912 5.161 20 0 FKADRO C[NH+](C)Cc1cccc(NC(=O)N2CCCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000454337596 567945374 /nfs/dbraw/zinc/94/53/74/567945374.db2.gz VXSPWSWEOOMTFG-HXUWFJFHSA-N 1 0 371.912 5.161 20 0 FKADRO CC(C)c1ccc(NC(=O)NC2CC[NH+](C3CCC3)CC2)c(C(C)C)c1 ZINC000454406241 567970840 /nfs/dbraw/zinc/97/08/40/567970840.db2.gz GUIGZIFRAHYJEF-UHFFFAOYSA-N 1 0 357.542 5.072 20 0 FKADRO CCC(C)(C)OCc1cccc(NC(=O)NCc2cnc(C)cc2C)c1C ZINC000454915896 568028793 /nfs/dbraw/zinc/02/87/93/568028793.db2.gz CUKHATGSRMYHBK-UHFFFAOYSA-N 1 0 369.509 5.034 20 0 FKADRO CCCc1cccc(C(C)C)c1NC(=O)N1CC[N@@H+](C2CCC2)C[C@@H](C)C1 ZINC000455242717 568104836 /nfs/dbraw/zinc/10/48/36/568104836.db2.gz DZVGDUIBHIXITP-GOSISDBHSA-N 1 0 371.569 5.101 20 0 FKADRO CCCc1cccc(C(C)C)c1NC(=O)N1CC[N@@H+](C2CCC2)C[C@H](C)C1 ZINC000455242733 568104854 /nfs/dbraw/zinc/10/48/54/568104854.db2.gz DZVGDUIBHIXITP-SFHVURJKSA-N 1 0 371.569 5.101 20 0 FKADRO Cc1ccc(CN(Cc2ccco2)C(=O)Nc2c(C)cc(C)nc2C)s1 ZINC000455460252 568127135 /nfs/dbraw/zinc/12/71/35/568127135.db2.gz ANBBHGOFHQXSTI-UHFFFAOYSA-N 1 0 369.490 5.204 20 0 FKADRO CCCN(C(=O)Nc1c(C)cc(C)nc1C)[C@@H](C)c1ccccc1OC ZINC000455461174 568127117 /nfs/dbraw/zinc/12/71/17/568127117.db2.gz BAXBPYYQTTYTIR-KRWDZBQOSA-N 1 0 355.482 5.021 20 0 FKADRO CCCN(C(=O)Nc1c(C)cc(C)nc1C)[C@H](C)c1ccccc1OC ZINC000455461176 568127126 /nfs/dbraw/zinc/12/71/26/568127126.db2.gz BAXBPYYQTTYTIR-QGZVFWFLSA-N 1 0 355.482 5.021 20 0 FKADRO Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455851057 568183292 /nfs/dbraw/zinc/18/32/92/568183292.db2.gz LCHXQZQEWLAHBU-FQEVSTJZSA-N 1 0 367.493 5.017 20 0 FKADRO Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455851064 568183303 /nfs/dbraw/zinc/18/33/03/568183303.db2.gz LCHXQZQEWLAHBU-HXUWFJFHSA-N 1 0 367.493 5.017 20 0 FKADRO Cc1ccc(CN(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)C(C)C)s1 ZINC000455904179 568190885 /nfs/dbraw/zinc/19/08/85/568190885.db2.gz GRWFUMFWDKNGHY-FQEVSTJZSA-N 1 0 371.550 5.048 20 0 FKADRO Cc1ccc(CN(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)C(C)C)s1 ZINC000455904180 568190858 /nfs/dbraw/zinc/19/08/58/568190858.db2.gz GRWFUMFWDKNGHY-HXUWFJFHSA-N 1 0 371.550 5.048 20 0 FKADRO C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455906962 568190986 /nfs/dbraw/zinc/19/09/86/568190986.db2.gz HTTHENXHBHSWDB-JLTOFOAXSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455906963 568191031 /nfs/dbraw/zinc/19/10/31/568191031.db2.gz HTTHENXHBHSWDB-VBKZILBWSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455906964 568191050 /nfs/dbraw/zinc/19/10/50/568191050.db2.gz HTTHENXHBHSWDB-VLIAUNLRSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455906965 568191042 /nfs/dbraw/zinc/19/10/42/568191042.db2.gz HTTHENXHBHSWDB-XOBRGWDASA-N 1 0 371.912 5.114 20 0 FKADRO CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455935142 568188537 /nfs/dbraw/zinc/18/85/37/568188537.db2.gz RITNAKXIAXFZAW-FCHUYYIVSA-N 1 0 365.521 5.097 20 0 FKADRO CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455935152 568188564 /nfs/dbraw/zinc/18/85/64/568188564.db2.gz RITNAKXIAXFZAW-FGZHOGPDSA-N 1 0 365.521 5.097 20 0 FKADRO CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455935167 568188541 /nfs/dbraw/zinc/18/85/41/568188541.db2.gz RITNAKXIAXFZAW-VXKWHMMOSA-N 1 0 365.521 5.097 20 0 FKADRO CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455935180 568188551 /nfs/dbraw/zinc/18/85/51/568188551.db2.gz RITNAKXIAXFZAW-YADHBBJMSA-N 1 0 365.521 5.097 20 0 FKADRO C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455947602 568194036 /nfs/dbraw/zinc/19/40/36/568194036.db2.gz XNLYKGPMTFJFJH-JLTOFOAXSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455947603 568194063 /nfs/dbraw/zinc/19/40/63/568194063.db2.gz XNLYKGPMTFJFJH-VBKZILBWSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455947604 568194073 /nfs/dbraw/zinc/19/40/73/568194073.db2.gz XNLYKGPMTFJFJH-VLIAUNLRSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455947605 568194087 /nfs/dbraw/zinc/19/40/87/568194087.db2.gz XNLYKGPMTFJFJH-XOBRGWDASA-N 1 0 371.912 5.114 20 0 FKADRO C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455949035 568194289 /nfs/dbraw/zinc/19/42/89/568194289.db2.gz YTWRVFLRBOREFY-JLTOFOAXSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000455949038 568194250 /nfs/dbraw/zinc/19/42/50/568194250.db2.gz YTWRVFLRBOREFY-VBKZILBWSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455949040 568194285 /nfs/dbraw/zinc/19/42/85/568194285.db2.gz YTWRVFLRBOREFY-VLIAUNLRSA-N 1 0 371.912 5.114 20 0 FKADRO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000455949044 568194237 /nfs/dbraw/zinc/19/42/37/568194237.db2.gz YTWRVFLRBOREFY-XOBRGWDASA-N 1 0 371.912 5.114 20 0 FKADRO C[NH+](C)CCCC(C)(C)NC(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000456205778 568223961 /nfs/dbraw/zinc/22/39/61/568223961.db2.gz QGWYRRCECJHPGT-UHFFFAOYSA-N 1 0 373.349 5.058 20 0 FKADRO C[NH2+]Cc1cccc(NC(=O)c2cc(C)ccc2SC2CCCC2)c1 ZINC000457364332 568385194 /nfs/dbraw/zinc/38/51/94/568385194.db2.gz VXAHWPCASZSYPC-UHFFFAOYSA-N 1 0 354.519 5.001 20 0 FKADRO CC[C@@H](CC(F)F)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000457425304 568393909 /nfs/dbraw/zinc/39/39/09/568393909.db2.gz DJGATXBIKQNMMR-HNNXBMFYSA-N 1 0 352.469 5.071 20 0 FKADRO CC[C@H](CC(F)F)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000457425306 568393934 /nfs/dbraw/zinc/39/39/34/568393934.db2.gz DJGATXBIKQNMMR-OAHLLOKOSA-N 1 0 352.469 5.071 20 0 FKADRO COc1ccccc1-c1ccc([C@H](C)[NH2+]CCc2sc(C)nc2C)cc1 ZINC000482818177 370698481 /nfs/dbraw/zinc/69/84/81/370698481.db2.gz CLAVNQNUVUXHLJ-HNNXBMFYSA-N 1 0 366.530 5.329 20 0 FKADRO COc1ccccc1-c1ccc([C@@H](C)[NH2+]CCc2sc(C)nc2C)cc1 ZINC000482818178 370697706 /nfs/dbraw/zinc/69/77/06/370697706.db2.gz CLAVNQNUVUXHLJ-OAHLLOKOSA-N 1 0 366.530 5.329 20 0 FKADRO CC[C@H]([NH2+][C@H]1CS[C@H](C(C)(C)C)C1)c1nc(C(F)(F)F)cs1 ZINC000488435926 567972522 /nfs/dbraw/zinc/97/25/22/567972522.db2.gz SVVQPMMYGCHDQN-SCVCMEIPSA-N 1 0 352.491 5.123 20 0 FKADRO CCCOc1cc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)ccc1OC ZINC000522756052 568038331 /nfs/dbraw/zinc/03/83/31/568038331.db2.gz HOVGZDDCRAHWGA-CYBMUJFWSA-N 1 0 368.304 5.642 20 0 FKADRO CCCOc1cc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)ccc1OC ZINC000522756053 568038379 /nfs/dbraw/zinc/03/83/79/568038379.db2.gz HOVGZDDCRAHWGA-ZDUSSCGKSA-N 1 0 368.304 5.642 20 0 FKADRO COc1ccc(C[NH2+]Cc2oc3ccc(F)cc3c2C)cc1OCC(C)C ZINC000522756984 568051526 /nfs/dbraw/zinc/05/15/26/568051526.db2.gz PDUMTRJJKKFCQD-UHFFFAOYSA-N 1 0 371.452 5.214 20 0 FKADRO C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(OCc2cccnc2)cc1 ZINC000548583928 567836264 /nfs/dbraw/zinc/83/62/64/567836264.db2.gz DTRIINLPAKHFLE-HNNXBMFYSA-N 1 0 370.855 5.304 20 0 FKADRO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(OCc2cccnc2)cc1 ZINC000548583929 567836392 /nfs/dbraw/zinc/83/63/92/567836392.db2.gz DTRIINLPAKHFLE-OAHLLOKOSA-N 1 0 370.855 5.304 20 0 FKADRO Fc1cc(Cl)cc(C[NH2+]Cc2cccc(COCc3ccco3)c2)c1 ZINC000548584098 567836399 /nfs/dbraw/zinc/83/63/99/567836399.db2.gz JALYZEFVZDXNRC-UHFFFAOYSA-N 1 0 359.828 5.079 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1ccc2ncsc2c1 ZINC000548584611 567836452 /nfs/dbraw/zinc/83/64/52/567836452.db2.gz OJWQPSLVFOTUPB-CYBMUJFWSA-N 1 0 357.548 5.651 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1ccc2ncsc2c1 ZINC000548584612 567836373 /nfs/dbraw/zinc/83/63/73/567836373.db2.gz OJWQPSLVFOTUPB-ZDUSSCGKSA-N 1 0 357.548 5.651 20 0 FKADRO Cc1cc(C[NH2+]Cc2cnc(-c3ccccc3)nc2)ccc1-c1ccccc1 ZINC000548622847 567837049 /nfs/dbraw/zinc/83/70/49/567837049.db2.gz OZQFHHTWGVBKSR-UHFFFAOYSA-N 1 0 365.480 5.409 20 0 FKADRO CC[C@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccc(Br)cc1 ZINC000548626294 567838079 /nfs/dbraw/zinc/83/80/79/567838079.db2.gz RDDBOACWTBGISV-HNNXBMFYSA-N 1 0 365.340 5.334 20 0 FKADRO CC[C@@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccc(Br)cc1 ZINC000548626295 567838097 /nfs/dbraw/zinc/83/80/97/567838097.db2.gz RDDBOACWTBGISV-OAHLLOKOSA-N 1 0 365.340 5.334 20 0 FKADRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000548634939 567838596 /nfs/dbraw/zinc/83/85/96/567838596.db2.gz TXGJNPGOZVHMIC-INIZCTEOSA-N 1 0 365.448 5.361 20 0 FKADRO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000548634940 567838654 /nfs/dbraw/zinc/83/86/54/567838654.db2.gz TXGJNPGOZVHMIC-MRXNPFEDSA-N 1 0 365.448 5.361 20 0 FKADRO COc1ccc(F)cc1C[NH2+][C@H](C)c1sc(-c2ccc(F)cc2)nc1C ZINC000548634949 567838574 /nfs/dbraw/zinc/83/85/74/567838574.db2.gz ZMOHIWQAHPGWAV-GFCCVEGCSA-N 1 0 374.456 5.256 20 0 FKADRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1sc(-c2ccc(F)cc2)nc1C ZINC000548634950 567838578 /nfs/dbraw/zinc/83/85/78/567838578.db2.gz ZMOHIWQAHPGWAV-LBPRGKRZSA-N 1 0 374.456 5.256 20 0 FKADRO C[C@H]([NH2+][C@H](CC1CC1)c1cc(F)cc(Br)c1)c1ccoc1 ZINC000548636705 567838556 /nfs/dbraw/zinc/83/85/56/567838556.db2.gz KVUDNOMNTLRNHZ-APPDUMDISA-N 1 0 352.247 5.373 20 0 FKADRO C[C@@H]([NH2+][C@@H](CC1CC1)c1cc(F)cc(Br)c1)c1ccoc1 ZINC000548636707 567838562 /nfs/dbraw/zinc/83/85/62/567838562.db2.gz KVUDNOMNTLRNHZ-DIFFPNOSSA-N 1 0 352.247 5.373 20 0 FKADRO C[C@H]([NH2+][C@@H](CC1CC1)c1cc(F)cc(Br)c1)c1ccoc1 ZINC000548636708 567838584 /nfs/dbraw/zinc/83/85/84/567838584.db2.gz KVUDNOMNTLRNHZ-GTNSWQLSSA-N 1 0 352.247 5.373 20 0 FKADRO C[C@@H]([NH2+][C@H](CC1CC1)c1cc(F)cc(Br)c1)c1ccoc1 ZINC000548636709 567838645 /nfs/dbraw/zinc/83/86/45/567838645.db2.gz KVUDNOMNTLRNHZ-PIGZYNQJSA-N 1 0 352.247 5.373 20 0 FKADRO COc1cc(C)ccc1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000548684130 567862482 /nfs/dbraw/zinc/86/24/82/567862482.db2.gz RECLHUWCEJRJKS-UHFFFAOYSA-N 1 0 366.505 5.020 20 0 FKADRO C[C@H]([NH2+]Cc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F ZINC000548730169 567874966 /nfs/dbraw/zinc/87/49/66/567874966.db2.gz RAAUTMQUCOMOPL-AWEZNQCLSA-N 1 0 351.400 5.435 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F ZINC000548730170 567875041 /nfs/dbraw/zinc/87/50/41/567875041.db2.gz RAAUTMQUCOMOPL-CQSZACIVSA-N 1 0 351.400 5.435 20 0 FKADRO C[C@@H]([NH2+]CCSc1ccccc1F)c1nc2ccccc2n1C(F)F ZINC000548731156 567882701 /nfs/dbraw/zinc/88/27/01/567882701.db2.gz IYMDYXIHGPBQNU-GFCCVEGCSA-N 1 0 365.424 5.013 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cccc2ccccc21)c1nc2ccccc2n1C(F)F ZINC000548731404 567882675 /nfs/dbraw/zinc/88/26/75/567882675.db2.gz ZZCDIXIKNCWGKL-GJZGRUSLSA-N 1 0 365.427 5.996 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cccc2ccccc21)c1nc2ccccc2n1C(F)F ZINC000548731405 567882839 /nfs/dbraw/zinc/88/28/39/567882839.db2.gz ZZCDIXIKNCWGKL-HUUCEWRRSA-N 1 0 365.427 5.996 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cccc2ccccc21)c1nc2ccccc2n1C(F)F ZINC000548731406 567882826 /nfs/dbraw/zinc/88/28/26/567882826.db2.gz ZZCDIXIKNCWGKL-LSDHHAIUSA-N 1 0 365.427 5.996 20 0 FKADRO O=C(Nc1ccccc1Cc1ccccc1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000548740711 567878087 /nfs/dbraw/zinc/87/80/87/567878087.db2.gz UZRUFUXXUDTOEW-UHFFFAOYSA-N 1 0 370.496 5.126 20 0 FKADRO COc1cc2c(cc1C[NH2+][C@@H](C)c1cc3ccccc3s1)O[C@@H](C)C2 ZINC000548786273 567885441 /nfs/dbraw/zinc/88/54/41/567885441.db2.gz SDZRSMIPAQLMAN-KBPBESRZSA-N 1 0 353.487 5.084 20 0 FKADRO COc1cc2c(cc1C[NH2+][C@@H](C)c1cc3ccccc3s1)O[C@H](C)C2 ZINC000548786278 567885520 /nfs/dbraw/zinc/88/55/20/567885520.db2.gz SDZRSMIPAQLMAN-KGLIPLIRSA-N 1 0 353.487 5.084 20 0 FKADRO COc1cc2c(cc1C[NH2+][C@H](C)c1cc3ccccc3s1)O[C@@H](C)C2 ZINC000548786279 567885510 /nfs/dbraw/zinc/88/55/10/567885510.db2.gz SDZRSMIPAQLMAN-UONOGXRCSA-N 1 0 353.487 5.084 20 0 FKADRO COc1cc2c(cc1C[NH2+][C@H](C)c1cc3ccccc3s1)O[C@H](C)C2 ZINC000548786281 567885543 /nfs/dbraw/zinc/88/55/43/567885543.db2.gz SDZRSMIPAQLMAN-ZIAGYGMSSA-N 1 0 353.487 5.084 20 0 FKADRO c1c2ccccc2oc1CN[C@@H](c1cc2ccccc2o1)c1cccnc1 ZINC000548796084 567888519 /nfs/dbraw/zinc/88/85/19/567888519.db2.gz IMCJROVHQHDMGD-HSZRJFAPSA-N 1 0 354.409 5.453 20 0 FKADRO FC(F)(F)c1ccc(-c2ccc(C[NH+]3CCC4(CCO4)CC3)s2)cc1 ZINC000548807079 567889812 /nfs/dbraw/zinc/88/98/12/567889812.db2.gz ZONSEOHPUZNDGB-UHFFFAOYSA-N 1 0 367.436 5.189 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)cc2)cs1 ZINC000548851704 567901048 /nfs/dbraw/zinc/90/10/48/567901048.db2.gz DQVUPCCEFDTWEZ-CTNGQTDRSA-N 1 0 363.530 5.330 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@H]3CCC[C@H](c4cccnc4)C3)cc2)cs1 ZINC000548851705 567900960 /nfs/dbraw/zinc/90/09/60/567900960.db2.gz DQVUPCCEFDTWEZ-FPOVZHCZSA-N 1 0 363.530 5.330 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)cc2)cs1 ZINC000548851706 567901058 /nfs/dbraw/zinc/90/10/58/567901058.db2.gz DQVUPCCEFDTWEZ-PZJWPPBQSA-N 1 0 363.530 5.330 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)cc2)cs1 ZINC000548851707 567900997 /nfs/dbraw/zinc/90/09/97/567900997.db2.gz DQVUPCCEFDTWEZ-TZIWHRDSSA-N 1 0 363.530 5.330 20 0 FKADRO CSc1ccccc1[C@@H](C)NCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000548852974 567900994 /nfs/dbraw/zinc/90/09/94/567900994.db2.gz GECIMRXGSSXLOV-CYBMUJFWSA-N 1 0 358.894 5.568 20 0 FKADRO COc1cc(C[NH2+]CC(C)(C)C(F)(F)F)c(-c2ccccc2)cc1OC ZINC000548859160 567902328 /nfs/dbraw/zinc/90/23/28/567902328.db2.gz SGDOUDCKBBSKPL-UHFFFAOYSA-N 1 0 367.411 5.049 20 0 FKADRO Fc1cccc([C@@H]([NH2+][C@H]2CCC23CCOCC3)c2cccc(Cl)c2)c1 ZINC000548859253 567902333 /nfs/dbraw/zinc/90/23/33/567902333.db2.gz UWQDHYSFBBGILM-PMACEKPBSA-N 1 0 359.872 5.117 20 0 FKADRO Fc1cccc([C@@H]([NH2+][C@@H]2CCC23CCOCC3)c2cccc(Cl)c2)c1 ZINC000548859263 567902366 /nfs/dbraw/zinc/90/23/66/567902366.db2.gz UWQDHYSFBBGILM-UXHICEINSA-N 1 0 359.872 5.117 20 0 FKADRO Fc1cccc([C@H]([NH2+][C@H]2CCC23CCOCC3)c2cccc(Cl)c2)c1 ZINC000548859264 567902350 /nfs/dbraw/zinc/90/23/50/567902350.db2.gz UWQDHYSFBBGILM-VQTJNVASSA-N 1 0 359.872 5.117 20 0 FKADRO Fc1cccc([C@H]([NH2+][C@@H]2CCC23CCOCC3)c2cccc(Cl)c2)c1 ZINC000548859265 567902371 /nfs/dbraw/zinc/90/23/71/567902371.db2.gz UWQDHYSFBBGILM-WOJBJXKFSA-N 1 0 359.872 5.117 20 0 FKADRO OCc1ccc(C[NH2+]Cc2ccc(Oc3cccc4ccccc43)cc2)o1 ZINC000548860616 567903438 /nfs/dbraw/zinc/90/34/38/567903438.db2.gz QTWORZIZPPYBBI-UHFFFAOYSA-N 1 0 359.425 5.007 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3cnn(C4CCCC4)c3)c(C)c2c1 ZINC000548860690 567903561 /nfs/dbraw/zinc/90/35/61/567903561.db2.gz FVRUIFBCQGFCRQ-CVEARBPZSA-N 1 0 367.493 5.473 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3cnn(C4CCCC4)c3)c(C)c2c1 ZINC000548860691 567903590 /nfs/dbraw/zinc/90/35/90/567903590.db2.gz FVRUIFBCQGFCRQ-HOTGVXAUSA-N 1 0 367.493 5.473 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3cnn(C4CCCC4)c3)c(C)c2c1 ZINC000548860692 567903620 /nfs/dbraw/zinc/90/36/20/567903620.db2.gz FVRUIFBCQGFCRQ-HZPDHXFCSA-N 1 0 367.493 5.473 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3cnn(C4CCCC4)c3)c(C)c2c1 ZINC000548860693 567903544 /nfs/dbraw/zinc/90/35/44/567903544.db2.gz FVRUIFBCQGFCRQ-JKSUJKDBSA-N 1 0 367.493 5.473 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@@H](C)c3cnn(C4CCCC4)c3)cc2)cs1 ZINC000548860739 567903637 /nfs/dbraw/zinc/90/36/37/567903637.db2.gz JRGSTQOSNDWLIV-HNNXBMFYSA-N 1 0 366.534 5.281 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC12CCOCC2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000548860786 567904321 /nfs/dbraw/zinc/90/43/21/567904321.db2.gz PZBWMSFNCYHBQT-HTAPYJJXSA-N 1 0 369.480 5.015 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC12CCOCC2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000548860787 567904262 /nfs/dbraw/zinc/90/42/62/567904262.db2.gz PZBWMSFNCYHBQT-JTSKRJEESA-N 1 0 369.480 5.015 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCC12CCOCC2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000548860788 567904330 /nfs/dbraw/zinc/90/43/30/567904330.db2.gz PZBWMSFNCYHBQT-VGOFRKELSA-N 1 0 369.480 5.015 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCC12CCOCC2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000548860789 567904246 /nfs/dbraw/zinc/90/42/46/567904246.db2.gz PZBWMSFNCYHBQT-VGSWGCGISA-N 1 0 369.480 5.015 20 0 FKADRO CCn1ccnc1CNCc1ccc(Oc2cccc3ccccc32)cc1 ZINC000548860909 567904326 /nfs/dbraw/zinc/90/43/26/567904326.db2.gz HWHUHQPXJUAGPC-UHFFFAOYSA-N 1 0 357.457 5.138 20 0 FKADRO CC(C)(C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1)C(F)(F)F ZINC000548882691 567900507 /nfs/dbraw/zinc/90/05/07/567900507.db2.gz FAZBVNULHYBTLY-INIZCTEOSA-N 1 0 356.819 5.197 20 0 FKADRO CC(C)(C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1)C(F)(F)F ZINC000548882694 567900734 /nfs/dbraw/zinc/90/07/34/567900734.db2.gz FAZBVNULHYBTLY-MRXNPFEDSA-N 1 0 356.819 5.197 20 0 FKADRO O=C(CC[NH2+][C@H](c1cc2ccccc2o1)c1ccccc1)Nc1ccccc1 ZINC000548907527 567928595 /nfs/dbraw/zinc/92/85/95/567928595.db2.gz SQZYRFDCFJNOPC-DEOSSOPVSA-N 1 0 370.452 5.141 20 0 FKADRO O=C(CC[NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1)Nc1ccccc1 ZINC000548907528 567928535 /nfs/dbraw/zinc/92/85/35/567928535.db2.gz SQZYRFDCFJNOPC-XMMPIXPASA-N 1 0 370.452 5.141 20 0 FKADRO COc1ccc(C[NH2+][C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)nc1 ZINC000548915515 567929580 /nfs/dbraw/zinc/92/95/80/567929580.db2.gz GQVHSVAHNLQPDD-GFCCVEGCSA-N 1 0 373.909 5.026 20 0 FKADRO COc1ccc(C[NH2+][C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)nc1 ZINC000548915516 567929570 /nfs/dbraw/zinc/92/95/70/567929570.db2.gz GQVHSVAHNLQPDD-LBPRGKRZSA-N 1 0 373.909 5.026 20 0 FKADRO Cc1cn2c(n1)[C@H](C[NH2+]Cc1ccc(Sc3ccccc3)cc1)CCC2 ZINC000548922587 567929892 /nfs/dbraw/zinc/92/98/92/567929892.db2.gz OVGLXYCRRXDWLP-IBGZPJMESA-N 1 0 363.530 5.010 20 0 FKADRO Cc1cn2c(n1)[C@@H](C[NH2+]Cc1ccc(Sc3ccccc3)cc1)CCC2 ZINC000548922588 567929870 /nfs/dbraw/zinc/92/98/70/567929870.db2.gz OVGLXYCRRXDWLP-LJQANCHMSA-N 1 0 363.530 5.010 20 0 FKADRO Clc1ccc(Cl)c(-c2csc(C[NH2+][C@H]3CCCSC3)n2)c1 ZINC000548923092 567930309 /nfs/dbraw/zinc/93/03/09/567930309.db2.gz YXBBOEKRGYAYND-NSHDSACASA-N 1 0 359.347 5.102 20 0 FKADRO COc1ccccc1-c1nc(CN2CCC(C)=C(c3ccco3)C2)cs1 ZINC000548930611 567932229 /nfs/dbraw/zinc/93/22/29/567932229.db2.gz SUSZWNHGBXLHKY-UHFFFAOYSA-N 1 0 366.486 5.091 20 0 FKADRO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CCC(C)=C(c2ccco2)C1 ZINC000548930932 567932144 /nfs/dbraw/zinc/93/21/44/567932144.db2.gz WCWXXSUDDGPPFK-GOSISDBHSA-N 1 0 366.505 5.218 20 0 FKADRO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CCC(C)=C(c2ccco2)C1 ZINC000548930935 567932169 /nfs/dbraw/zinc/93/21/69/567932169.db2.gz WCWXXSUDDGPPFK-SFHVURJKSA-N 1 0 366.505 5.218 20 0 FKADRO CC(C)(C[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)C(F)(F)F ZINC000548973327 567959784 /nfs/dbraw/zinc/95/97/84/567959784.db2.gz JGMJGXVYGDHBTA-UHFFFAOYSA-N 1 0 354.397 5.234 20 0 FKADRO CCCOc1cccc(C[NH2+]Cc2ccc3c(c2)nc(CC)n3C2CC2)c1 ZINC000548979152 567960132 /nfs/dbraw/zinc/96/01/32/567960132.db2.gz UKWJBCKOBLVKQH-UHFFFAOYSA-N 1 0 363.505 5.012 20 0 FKADRO Cc1ncc(C[NH2+]Cc2ccc(Oc3cc(Cl)cc(Cl)c3)cc2)cn1 ZINC000548983421 567960382 /nfs/dbraw/zinc/96/03/82/567960382.db2.gz DXFFUUFNYCTHBN-UHFFFAOYSA-N 1 0 374.271 5.174 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3ccc(Cl)cc3F)ccc2n1C1CC1 ZINC000548983903 567960404 /nfs/dbraw/zinc/96/04/04/567960404.db2.gz GNSIXDKHVSXBJJ-UHFFFAOYSA-N 1 0 357.860 5.016 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3cccc(OC(C)C)c3)ccc2n1C1CC1 ZINC000548985093 567960440 /nfs/dbraw/zinc/96/04/40/567960440.db2.gz YZHGMXKQYYVBAX-UHFFFAOYSA-N 1 0 363.505 5.011 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cccc3cccnc32)C2CC2)c1 ZINC000548988702 567960464 /nfs/dbraw/zinc/96/04/64/567960464.db2.gz CWALKBQMAHSZLB-LJQANCHMSA-N 1 0 356.391 5.495 20 0 FKADRO FC(F)(F)c1cccc([C@@H]([NH2+]Cc2nccs2)C2CCCCC2)c1 ZINC000548990130 567960761 /nfs/dbraw/zinc/96/07/61/567960761.db2.gz DFPOIITYGUAVDY-KRWDZBQOSA-N 1 0 354.441 5.573 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2nccs2)C2CCCCC2)c1 ZINC000548990146 567960715 /nfs/dbraw/zinc/96/07/15/567960715.db2.gz DFPOIITYGUAVDY-QGZVFWFLSA-N 1 0 354.441 5.573 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)cn1 ZINC000549041347 567977036 /nfs/dbraw/zinc/97/70/36/567977036.db2.gz XBUMPOAPWVBFIJ-CABCVRRESA-N 1 0 353.432 5.155 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)cn1 ZINC000549041348 567977027 /nfs/dbraw/zinc/97/70/27/567977027.db2.gz XBUMPOAPWVBFIJ-GJZGRUSLSA-N 1 0 353.432 5.155 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)cn1 ZINC000549041349 567977023 /nfs/dbraw/zinc/97/70/23/567977023.db2.gz XBUMPOAPWVBFIJ-HUUCEWRRSA-N 1 0 353.432 5.155 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)cn1 ZINC000549041350 567977018 /nfs/dbraw/zinc/97/70/18/567977018.db2.gz XBUMPOAPWVBFIJ-LSDHHAIUSA-N 1 0 353.432 5.155 20 0 FKADRO CCn1c(SCc2ccc(C(C)C)nc2C)nnc1-c1ccc(F)cc1 ZINC000549056655 567978204 /nfs/dbraw/zinc/97/82/04/567978204.db2.gz OHFAHTQNTKZUKT-UHFFFAOYSA-N 1 0 370.497 5.223 20 0 FKADRO Cc1oncc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549075042 567980472 /nfs/dbraw/zinc/98/04/72/567980472.db2.gz XDFBSXRTTXBGOU-GOSISDBHSA-N 1 0 352.400 5.413 20 0 FKADRO Cc1oncc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549075045 567980510 /nfs/dbraw/zinc/98/05/10/567980510.db2.gz XDFBSXRTTXBGOU-SFHVURJKSA-N 1 0 352.400 5.413 20 0 FKADRO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1cccc(C(=O)N(C)C)c1 ZINC000549078044 567980562 /nfs/dbraw/zinc/98/05/62/567980562.db2.gz KITVZLGMVMUBRU-UHFFFAOYSA-N 1 0 358.551 5.031 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cc(-c3ccccc3)no2)C2CC2)c1 ZINC000549078265 567980554 /nfs/dbraw/zinc/98/05/54/567980554.db2.gz QEFDRTARMJCEJU-HXUWFJFHSA-N 1 0 372.390 5.601 20 0 FKADRO COc1ncc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1Cl ZINC000549078267 567980558 /nfs/dbraw/zinc/98/05/58/567980558.db2.gz QEYNPBXRCSJRNP-MRXNPFEDSA-N 1 0 370.802 5.003 20 0 FKADRO O=c1[nH]c2ccccc2cc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000549078312 567980524 /nfs/dbraw/zinc/98/05/24/567980524.db2.gz RHWZXSVSECOXRL-LJQANCHMSA-N 1 0 372.390 5.200 20 0 FKADRO CCCC(C)(C)[N@@H+](Cc1csc(-c2ncccn2)n1)Cc1cccs1 ZINC000549081400 567980466 /nfs/dbraw/zinc/98/04/66/567980466.db2.gz TWESZVGGSRVHPR-UHFFFAOYSA-N 1 0 372.563 5.243 20 0 FKADRO CCCC(C)(C)[N@H+](Cc1cc(-c2cnn(C)c2C)no1)Cc1cccs1 ZINC000549081485 567980482 /nfs/dbraw/zinc/98/04/82/567980482.db2.gz WSKZYFMNSCZCKW-UHFFFAOYSA-N 1 0 372.538 5.026 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCCO[C@H]1CCCCO1 ZINC000549132168 567984622 /nfs/dbraw/zinc/98/46/22/567984622.db2.gz ADFUUPCEQPERIJ-APWZRJJASA-N 1 0 374.550 5.011 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCCO[C@H]1CCCCO1 ZINC000549132169 567984594 /nfs/dbraw/zinc/98/45/94/567984594.db2.gz ADFUUPCEQPERIJ-LPHOPBHVSA-N 1 0 374.550 5.011 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCCO[C@@H]1CCCCO1 ZINC000549132170 567984619 /nfs/dbraw/zinc/98/46/19/567984619.db2.gz ADFUUPCEQPERIJ-QFBILLFUSA-N 1 0 374.550 5.011 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCCO[C@@H]1CCCCO1 ZINC000549132171 567984641 /nfs/dbraw/zinc/98/46/41/567984641.db2.gz ADFUUPCEQPERIJ-VQIMIIECSA-N 1 0 374.550 5.011 20 0 FKADRO O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000549144243 567984937 /nfs/dbraw/zinc/98/49/37/567984937.db2.gz SAPHVCJUAJTTMN-FQEVSTJZSA-N 1 0 362.498 5.106 20 0 FKADRO O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000549144244 567984978 /nfs/dbraw/zinc/98/49/78/567984978.db2.gz SAPHVCJUAJTTMN-HXUWFJFHSA-N 1 0 362.498 5.106 20 0 FKADRO CC(=O)N(c1nc(CN(C)[C@H](C)C2CCCCC2)cs1)c1ccccc1 ZINC000549159658 567989546 /nfs/dbraw/zinc/98/95/46/567989546.db2.gz MIZMXNPANNZFTE-MRXNPFEDSA-N 1 0 371.550 5.228 20 0 FKADRO CC1=C(c2ccco2)CN([C@@H](C)c2nc3ccccc3n2C(F)F)CC1 ZINC000549159977 567989540 /nfs/dbraw/zinc/98/95/40/567989540.db2.gz ZGCWWJQMULYKGB-AWEZNQCLSA-N 1 0 357.404 5.265 20 0 FKADRO CC1=C(c2ccco2)CN([C@H](C)c2nc3ccccc3n2C(F)F)CC1 ZINC000549159978 567989483 /nfs/dbraw/zinc/98/94/83/567989483.db2.gz ZGCWWJQMULYKGB-CQSZACIVSA-N 1 0 357.404 5.265 20 0 FKADRO CSc1ccccc1[C@@H](C)N[C@H](C)c1nnc(-c2ccccc2F)s1 ZINC000549161737 567989585 /nfs/dbraw/zinc/98/95/85/567989585.db2.gz IREYGOHOABMREN-CHWSQXEVSA-N 1 0 373.522 5.478 20 0 FKADRO CSc1ccccc1[C@@H](C)N[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000549161738 567989596 /nfs/dbraw/zinc/98/95/96/567989596.db2.gz IREYGOHOABMREN-OLZOCXBDSA-N 1 0 373.522 5.478 20 0 FKADRO CSc1ccccc1[C@H](C)N[C@H](C)c1nnc(-c2ccccc2F)s1 ZINC000549164592 567989598 /nfs/dbraw/zinc/98/95/98/567989598.db2.gz IREYGOHOABMREN-QWHCGFSZSA-N 1 0 373.522 5.478 20 0 FKADRO CSc1ccccc1[C@H](C)N[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000549164593 567989577 /nfs/dbraw/zinc/98/95/77/567989577.db2.gz IREYGOHOABMREN-STQMWFEESA-N 1 0 373.522 5.478 20 0 FKADRO Fc1ccc(C2([NH2+]Cc3cccc(OCC(F)(F)F)c3)CCCC2)cc1 ZINC000549165277 567989703 /nfs/dbraw/zinc/98/97/03/567989703.db2.gz LSODIMSYEDYEJE-UHFFFAOYSA-N 1 0 367.386 5.326 20 0 FKADRO c1sc(-c2ccccn2)nc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000549169476 567986963 /nfs/dbraw/zinc/98/69/63/567986963.db2.gz WJCIHDPCRDBXAS-FNLKRUPLSA-N 1 0 361.514 5.116 20 0 FKADRO c1ccc(-c2nnc(C[N@H+]3[C@@H]4CC[C@H]3C[C@@H](c3ccccc3)C4)s2)cc1 ZINC000549170900 567986999 /nfs/dbraw/zinc/98/69/99/567986999.db2.gz FMWASYURDJBNCX-ACDBMABISA-N 1 0 361.514 5.116 20 0 FKADRO CO[C@@H](C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000549171669 567986987 /nfs/dbraw/zinc/98/69/87/567986987.db2.gz ILGANCRZDRDXAO-FCHUYYIVSA-N 1 0 366.892 5.110 20 0 FKADRO CO[C@H](C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000549171685 567986966 /nfs/dbraw/zinc/98/69/66/567986966.db2.gz ILGANCRZDRDXAO-FGZHOGPDSA-N 1 0 366.892 5.110 20 0 FKADRO CO[C@@H](C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000549171699 567986978 /nfs/dbraw/zinc/98/69/78/567986978.db2.gz ILGANCRZDRDXAO-VXKWHMMOSA-N 1 0 366.892 5.110 20 0 FKADRO CO[C@H](C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000549171700 567987005 /nfs/dbraw/zinc/98/70/05/567987005.db2.gz ILGANCRZDRDXAO-YADHBBJMSA-N 1 0 366.892 5.110 20 0 FKADRO Cc1c(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)ccn1C(C)C ZINC000549173204 567986968 /nfs/dbraw/zinc/98/69/68/567986968.db2.gz NFNGVRGSVXGENR-UHFFFAOYSA-N 1 0 367.537 5.394 20 0 FKADRO Cc1ccsc1C[N@@H+](C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000549195055 567989611 /nfs/dbraw/zinc/98/96/11/567989611.db2.gz RHKRYEIIEZAMJK-KRWDZBQOSA-N 1 0 364.514 5.502 20 0 FKADRO Cc1ccsc1C[N@@H+](C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000549195056 567989579 /nfs/dbraw/zinc/98/95/79/567989579.db2.gz RHKRYEIIEZAMJK-QGZVFWFLSA-N 1 0 364.514 5.502 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]CC[C@@H]3C[C@@H](C)O[C@@H](C)C3)cs2)cs1 ZINC000549225298 567995036 /nfs/dbraw/zinc/99/50/36/567995036.db2.gz HCDRKUBVEIBSEV-FQLMCAECSA-N 1 0 364.580 5.424 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+]CC[C@@H]3C[C@@H](C)O[C@@H](C)C3)cs2)cs1 ZINC000549225299 567995056 /nfs/dbraw/zinc/99/50/56/567995056.db2.gz HCDRKUBVEIBSEV-HLPPOEQASA-N 1 0 364.580 5.424 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]CCC3C[C@H](C)O[C@@H](C)C3)cs2)cs1 ZINC000549225300 567995086 /nfs/dbraw/zinc/99/50/86/567995086.db2.gz HCDRKUBVEIBSEV-IHRRRGAJSA-N 1 0 364.580 5.424 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]CCC3C[C@@H](C)O[C@H](C)C3)cs2)cs1 ZINC000549225301 567995094 /nfs/dbraw/zinc/99/50/94/567995094.db2.gz HCDRKUBVEIBSEV-MCIONIFRSA-N 1 0 364.580 5.424 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccco1 ZINC000549225328 567995095 /nfs/dbraw/zinc/99/50/95/567995095.db2.gz IDONVXLMPPYRCY-FQCOAQKJSA-N 1 0 358.913 5.198 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccco1 ZINC000549225329 567995038 /nfs/dbraw/zinc/99/50/38/567995038.db2.gz IDONVXLMPPYRCY-MXPIYFSTSA-N 1 0 358.913 5.198 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccco1 ZINC000549225330 567995073 /nfs/dbraw/zinc/99/50/73/567995073.db2.gz IDONVXLMPPYRCY-QIOKEVSGSA-N 1 0 358.913 5.198 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccco1 ZINC000549225331 567995099 /nfs/dbraw/zinc/99/50/99/567995099.db2.gz IDONVXLMPPYRCY-VLCCKYJDSA-N 1 0 358.913 5.198 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000549225335 567995126 /nfs/dbraw/zinc/99/51/26/567995126.db2.gz IFMDYNCSKLMAHE-GQWLDOHISA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000549225336 567995118 /nfs/dbraw/zinc/99/51/18/567995118.db2.gz IFMDYNCSKLMAHE-IPHXSNPTSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000549225337 567995111 /nfs/dbraw/zinc/99/51/11/567995111.db2.gz IFMDYNCSKLMAHE-LPTQZCDUSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000549225338 567995128 /nfs/dbraw/zinc/99/51/28/567995128.db2.gz IFMDYNCSKLMAHE-NQERJWCQSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2SC)c2ccccc21 ZINC000549226239 567995330 /nfs/dbraw/zinc/99/53/30/567995330.db2.gz VIBLOWSTWUTETR-BEVDRBHNSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2SC)c2ccccc21 ZINC000549226241 567995362 /nfs/dbraw/zinc/99/53/62/567995362.db2.gz VIBLOWSTWUTETR-CWFSZBLJSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2SC)c2ccccc21 ZINC000549226242 567995346 /nfs/dbraw/zinc/99/53/46/567995346.db2.gz VIBLOWSTWUTETR-RYGJVYDSSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2SC)c2ccccc21 ZINC000549226243 567995392 /nfs/dbraw/zinc/99/53/92/567995392.db2.gz VIBLOWSTWUTETR-YSSFQJQWSA-N 1 0 369.530 5.241 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](CC)c3ccc(F)cc3)ccc2n1C1CC1 ZINC000549226278 567995337 /nfs/dbraw/zinc/99/53/37/567995337.db2.gz WIMPRPTTWMRZBS-IBGZPJMESA-N 1 0 351.469 5.314 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](CC)c3ccc(F)cc3)ccc2n1C1CC1 ZINC000549226279 567995364 /nfs/dbraw/zinc/99/53/64/567995364.db2.gz WIMPRPTTWMRZBS-LJQANCHMSA-N 1 0 351.469 5.314 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H]3CCSc4ccccc43)ccc2n1C1CC1 ZINC000549226423 567995381 /nfs/dbraw/zinc/99/53/81/567995381.db2.gz XQHRAZVSIUTXSR-GOSISDBHSA-N 1 0 363.530 5.260 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H]3CCSc4ccccc43)ccc2n1C1CC1 ZINC000549226424 567995348 /nfs/dbraw/zinc/99/53/48/567995348.db2.gz XQHRAZVSIUTXSR-SFHVURJKSA-N 1 0 363.530 5.260 20 0 FKADRO Cc1nc(C)c(C[NH2+][C@H]2CCCCc3cc(Br)ccc32)s1 ZINC000549227946 567995398 /nfs/dbraw/zinc/99/53/98/567995398.db2.gz FICDSAOBKHQXNV-INIZCTEOSA-N 1 0 365.340 5.080 20 0 FKADRO Cc1nc(C)c(C[NH2+][C@@H]2CCCCc3cc(Br)ccc32)s1 ZINC000549227947 567995335 /nfs/dbraw/zinc/99/53/35/567995335.db2.gz FICDSAOBKHQXNV-MRXNPFEDSA-N 1 0 365.340 5.080 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc2c(c1)COC2 ZINC000549230991 567994672 /nfs/dbraw/zinc/99/46/72/567994672.db2.gz XDTAIPHACXHTRE-RNODOKPDSA-N 1 0 361.407 5.538 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc2c(c1)COC2 ZINC000549230992 567994708 /nfs/dbraw/zinc/99/47/08/567994708.db2.gz XDTAIPHACXHTRE-ZUOKHONESA-N 1 0 361.407 5.538 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2c(C)oc3ccccc32)c2ccccc21 ZINC000549234453 567998862 /nfs/dbraw/zinc/99/88/62/567998862.db2.gz BXIJXTMUAHONNL-CTNGQTDRSA-N 1 0 363.457 5.013 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+]Cc2c(C)oc3ccccc32)c2ccccc21 ZINC000549234454 567998890 /nfs/dbraw/zinc/99/88/90/567998890.db2.gz BXIJXTMUAHONNL-FPOVZHCZSA-N 1 0 363.457 5.013 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+]Cc2c(C)oc3ccccc32)c2ccccc21 ZINC000549234455 567998864 /nfs/dbraw/zinc/99/88/64/567998864.db2.gz BXIJXTMUAHONNL-PZJWPPBQSA-N 1 0 363.457 5.013 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2c(C)oc3ccccc32)c2ccccc21 ZINC000549234456 567998911 /nfs/dbraw/zinc/99/89/11/567998911.db2.gz BXIJXTMUAHONNL-TZIWHRDSSA-N 1 0 363.457 5.013 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](C)c3cc4ccccc4o3)ccc2n1C1CC1 ZINC000549234607 567998866 /nfs/dbraw/zinc/99/88/66/567998866.db2.gz CUEDDVMWSGEYTH-HNNXBMFYSA-N 1 0 359.473 5.531 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cc4ccccc4o3)ccc2n1C1CC1 ZINC000549234615 567998905 /nfs/dbraw/zinc/99/89/05/567998905.db2.gz CUEDDVMWSGEYTH-OAHLLOKOSA-N 1 0 359.473 5.531 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](CC)c3cccc(OC)c3)ccc2n1C1CC1 ZINC000549235645 567998955 /nfs/dbraw/zinc/99/89/55/567998955.db2.gz LCWFNDRXHASKMH-FQEVSTJZSA-N 1 0 363.505 5.183 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](CC)c3cccc(OC)c3)ccc2n1C1CC1 ZINC000549235646 567998970 /nfs/dbraw/zinc/99/89/70/567998970.db2.gz LCWFNDRXHASKMH-HXUWFJFHSA-N 1 0 363.505 5.183 20 0 FKADRO Cc1ccc(C[NH2+]Cc2cc(Cl)sc2Cl)c(-c2ccnn2C)c1 ZINC000549247496 567997270 /nfs/dbraw/zinc/99/72/70/567997270.db2.gz ZDTMFUDTIPUVPC-UHFFFAOYSA-N 1 0 366.317 5.054 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3ccc(C(F)(F)F)cc3)ccc2n1C1CC1 ZINC000549249161 567998340 /nfs/dbraw/zinc/99/83/40/567998340.db2.gz OTONUESUKQDPOD-UHFFFAOYSA-N 1 0 373.422 5.242 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3ccc(F)c(Cl)c3)ccc2n1C1CC1 ZINC000549249244 567998325 /nfs/dbraw/zinc/99/83/25/567998325.db2.gz CETZGLGKBUKLQN-UHFFFAOYSA-N 1 0 357.860 5.016 20 0 FKADRO CCn1ccnc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549262601 567998495 /nfs/dbraw/zinc/99/84/95/567998495.db2.gz AUZJWOAHFTZNOC-IBGZPJMESA-N 1 0 365.443 5.333 20 0 FKADRO CCn1ccnc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549262612 567998493 /nfs/dbraw/zinc/99/84/93/567998493.db2.gz AUZJWOAHFTZNOC-LJQANCHMSA-N 1 0 365.443 5.333 20 0 FKADRO Cc1ncc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)cn1 ZINC000549263049 567998504 /nfs/dbraw/zinc/99/85/04/567998504.db2.gz FKKWPAXIGUOQHP-IBGZPJMESA-N 1 0 363.427 5.215 20 0 FKADRO Cc1ncc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)cn1 ZINC000549263050 567998506 /nfs/dbraw/zinc/99/85/06/567998506.db2.gz FKKWPAXIGUOQHP-LJQANCHMSA-N 1 0 363.427 5.215 20 0 FKADRO FC(F)(F)c1cccc([C@@H]([NH2+]Cc2cncs2)C2CCCCC2)c1 ZINC000549263089 567998512 /nfs/dbraw/zinc/99/85/12/567998512.db2.gz GSQWZUPHSSEOEM-KRWDZBQOSA-N 1 0 354.441 5.573 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cncs2)C2CCCCC2)c1 ZINC000549263094 567998516 /nfs/dbraw/zinc/99/85/16/567998516.db2.gz GSQWZUPHSSEOEM-QGZVFWFLSA-N 1 0 354.441 5.573 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)s1 ZINC000549263920 567999086 /nfs/dbraw/zinc/99/90/86/567999086.db2.gz PFQCGAOYHUTZRC-MRXNPFEDSA-N 1 0 368.468 5.700 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2ccnc3ccccc23)C2CC2)c1 ZINC000549264225 567996743 /nfs/dbraw/zinc/99/67/43/567996743.db2.gz SVTYTHCUXJIKBX-HXUWFJFHSA-N 1 0 356.391 5.495 20 0 FKADRO C[C@H]1CC(CC[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000549269854 568000909 /nfs/dbraw/zinc/00/09/09/568000909.db2.gz XHPFZMAOHUBPBR-KBPBESRZSA-N 1 0 364.942 5.147 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000549269857 568000903 /nfs/dbraw/zinc/00/09/03/568000903.db2.gz XHPFZMAOHUBPBR-QDMKHBRRSA-N 1 0 364.942 5.147 20 0 FKADRO C[C@@H]1CC(CC[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C[C@@H](C)O1 ZINC000549269859 568000846 /nfs/dbraw/zinc/00/08/46/568000846.db2.gz XHPFZMAOHUBPBR-ZIAGYGMSSA-N 1 0 364.942 5.147 20 0 FKADRO C[C@H]([NH2+]Cc1sccc1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000549386484 568018839 /nfs/dbraw/zinc/01/88/39/568018839.db2.gz NEDGFSSLTIRJKC-AWEZNQCLSA-N 1 0 358.894 5.226 20 0 FKADRO C[C@@H]([NH2+]Cc1sccc1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000549386486 568018739 /nfs/dbraw/zinc/01/87/39/568018739.db2.gz NEDGFSSLTIRJKC-CQSZACIVSA-N 1 0 358.894 5.226 20 0 FKADRO Cc1noc(C)c1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549405188 568020520 /nfs/dbraw/zinc/02/05/20/568020520.db2.gz ZMQNALSVRQFCKS-IBGZPJMESA-N 1 0 366.427 5.721 20 0 FKADRO Cc1noc(C)c1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549405189 568020534 /nfs/dbraw/zinc/02/05/34/568020534.db2.gz ZMQNALSVRQFCKS-LJQANCHMSA-N 1 0 366.427 5.721 20 0 FKADRO c1nc(-c2ccccn2)sc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000549407510 568020559 /nfs/dbraw/zinc/02/05/59/568020559.db2.gz GBJMHVVFAISILA-REPLKXPHSA-N 1 0 361.514 5.116 20 0 FKADRO CCCC(C)(C)[N@H+](CC(=O)Nc1c(F)cccc1F)Cc1cccs1 ZINC000549408158 568020910 /nfs/dbraw/zinc/02/09/10/568020910.db2.gz FGUKXLPEEWSVPP-UHFFFAOYSA-N 1 0 366.477 5.046 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000549535287 568026929 /nfs/dbraw/zinc/02/69/29/568026929.db2.gz ADXNQUIBKASNFU-LJQANCHMSA-N 1 0 350.428 5.551 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000549535288 568026989 /nfs/dbraw/zinc/02/69/89/568026989.db2.gz AECDDTVFUVPOOG-GOSISDBHSA-N 1 0 359.517 5.680 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000549535289 568027076 /nfs/dbraw/zinc/02/70/76/568027076.db2.gz AECDDTVFUVPOOG-SFHVURJKSA-N 1 0 359.517 5.680 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000549535318 568027016 /nfs/dbraw/zinc/02/70/16/568027016.db2.gz BCXNFDVIMYNEAZ-HNNXBMFYSA-N 1 0 356.485 5.292 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000549535319 568027085 /nfs/dbraw/zinc/02/70/85/568027085.db2.gz BCXNFDVIMYNEAZ-OAHLLOKOSA-N 1 0 356.485 5.292 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)cc1OCC ZINC000549535636 568027106 /nfs/dbraw/zinc/02/71/06/568027106.db2.gz HODBUNYFKMDZLX-INIZCTEOSA-N 1 0 356.510 5.162 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)cc1OCC ZINC000549535637 568027013 /nfs/dbraw/zinc/02/70/13/568027013.db2.gz HODBUNYFKMDZLX-MRXNPFEDSA-N 1 0 356.510 5.162 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000549536198 568027063 /nfs/dbraw/zinc/02/70/63/568027063.db2.gz OYQQAJCZZWFIFH-AWEZNQCLSA-N 1 0 366.427 5.305 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000549536199 568027020 /nfs/dbraw/zinc/02/70/20/568027020.db2.gz OYQQAJCZZWFIFH-CQSZACIVSA-N 1 0 366.427 5.305 20 0 FKADRO Cc1nc(-c2ccc([C@H](C)[NH2+]Cc3ccc(C(C)C)nc3C)cc2)cs1 ZINC000549536225 568027046 /nfs/dbraw/zinc/02/70/46/568027046.db2.gz PSRUVXIPBDXAFZ-HNNXBMFYSA-N 1 0 365.546 5.796 20 0 FKADRO Cc1nc(-c2ccc([C@@H](C)[NH2+]Cc3ccc(C(C)C)nc3C)cc2)cs1 ZINC000549536226 568027053 /nfs/dbraw/zinc/02/70/53/568027053.db2.gz PSRUVXIPBDXAFZ-OAHLLOKOSA-N 1 0 365.546 5.796 20 0 FKADRO Fc1cc(C[NH2+]C2c3ccccc3-c3ccccc32)ccc1OC(F)F ZINC000549536541 568027099 /nfs/dbraw/zinc/02/70/99/568027099.db2.gz ABCUDUQYCZJLHX-UHFFFAOYSA-N 1 0 355.359 5.287 20 0 FKADRO COCc1ccc(C[NH2+][C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 ZINC000549536622 568027028 /nfs/dbraw/zinc/02/70/28/568027028.db2.gz UEZXQVWXIWODTR-KRWDZBQOSA-N 1 0 369.505 5.014 20 0 FKADRO COCc1ccc(C[NH2+][C@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 ZINC000549536623 568027082 /nfs/dbraw/zinc/02/70/82/568027082.db2.gz UEZXQVWXIWODTR-QGZVFWFLSA-N 1 0 369.505 5.014 20 0 FKADRO COCCSc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)cc1 ZINC000549536810 568027024 /nfs/dbraw/zinc/02/70/24/568027024.db2.gz YGRDSKZSRRRSDN-INIZCTEOSA-N 1 0 358.551 5.103 20 0 FKADRO COCCSc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)cc1 ZINC000549536811 568027090 /nfs/dbraw/zinc/02/70/90/568027090.db2.gz YGRDSKZSRRRSDN-MRXNPFEDSA-N 1 0 358.551 5.103 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1 ZINC000549537483 568027233 /nfs/dbraw/zinc/02/72/33/568027233.db2.gz RWMFLDYNLXSPCQ-CYBMUJFWSA-N 1 0 353.384 5.067 20 0 FKADRO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1 ZINC000549537496 568027183 /nfs/dbraw/zinc/02/71/83/568027183.db2.gz RWMFLDYNLXSPCQ-ZDUSSCGKSA-N 1 0 353.384 5.067 20 0 FKADRO COCc1ccc(C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 ZINC000549547837 568026272 /nfs/dbraw/zinc/02/62/72/568026272.db2.gz NOTAQGCIJBKQSU-AWEZNQCLSA-N 1 0 370.493 5.255 20 0 FKADRO COCc1ccc(C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 ZINC000549547838 568026634 /nfs/dbraw/zinc/02/66/34/568026634.db2.gz NOTAQGCIJBKQSU-CQSZACIVSA-N 1 0 370.493 5.255 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1cccc(C(F)(F)F)c1 ZINC000549549630 568027353 /nfs/dbraw/zinc/02/73/53/568027353.db2.gz CUFBANMVKJWXBI-FQEVSTJZSA-N 1 0 373.422 5.378 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1cccc(C(F)(F)F)c1 ZINC000549549631 568027288 /nfs/dbraw/zinc/02/72/88/568027288.db2.gz CUFBANMVKJWXBI-HXUWFJFHSA-N 1 0 373.422 5.378 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@H+](C)Cc1csc2ccccc12 ZINC000549606100 568034404 /nfs/dbraw/zinc/03/44/04/568034404.db2.gz RAIIHEGMYRCGNB-UHFFFAOYSA-N 1 0 370.543 5.084 20 0 FKADRO COCc1nc(C[NH2+]C(C2CCC2)C2CCC2)c(-c2ccccc2)s1 ZINC000549610291 568034447 /nfs/dbraw/zinc/03/44/47/568034447.db2.gz KBWYSKNPYGOIJB-UHFFFAOYSA-N 1 0 356.535 5.015 20 0 FKADRO C[C@@H]1CC(CC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@@H](C)O1 ZINC000549610976 568034422 /nfs/dbraw/zinc/03/44/22/568034422.db2.gz MHKSISZTSLZASM-DRSNIGMVSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@H](C)O1 ZINC000549610990 568034363 /nfs/dbraw/zinc/03/43/63/568034363.db2.gz MHKSISZTSLZASM-SUWCGCSTSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@H](C)O1 ZINC000549610992 568034443 /nfs/dbraw/zinc/03/44/43/568034443.db2.gz MHKSISZTSLZASM-WYADAEROSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1CC(CC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@@H](C)O1 ZINC000549610993 568034366 /nfs/dbraw/zinc/03/43/66/568034366.db2.gz MHKSISZTSLZASM-YVHKJVDXSA-N 1 0 372.940 5.202 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)nc(CC)n3C2CC2)cc1 ZINC000549611208 568034460 /nfs/dbraw/zinc/03/44/60/568034460.db2.gz SOCRRNMYMINRMB-INIZCTEOSA-N 1 0 363.505 5.183 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)nc(CC)n3C2CC2)cc1 ZINC000549611209 568034418 /nfs/dbraw/zinc/03/44/18/568034418.db2.gz SOCRRNMYMINRMB-MRXNPFEDSA-N 1 0 363.505 5.183 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000549611409 568034414 /nfs/dbraw/zinc/03/44/14/568034414.db2.gz VPBSZYDGTBCQAX-LBPRGKRZSA-N 1 0 353.329 5.188 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](C)c3cc(C)ccc3OC)ccc2n1C1CC1 ZINC000549612070 568034592 /nfs/dbraw/zinc/03/45/92/568034592.db2.gz VBVWZXURVQNQCZ-INIZCTEOSA-N 1 0 363.505 5.101 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cc(C)ccc3OC)ccc2n1C1CC1 ZINC000549612071 568034590 /nfs/dbraw/zinc/03/45/90/568034590.db2.gz VBVWZXURVQNQCZ-MRXNPFEDSA-N 1 0 363.505 5.101 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(Br)s1 ZINC000549612121 568034521 /nfs/dbraw/zinc/03/45/21/568034521.db2.gz KMUFVRFIOUXIPE-GFCCVEGCSA-N 1 0 367.356 5.442 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cccc(C)c2C)c2ccccc21 ZINC000549612326 568034506 /nfs/dbraw/zinc/03/45/06/568034506.db2.gz VQSUPSBQNLBYSK-MTNREXPMSA-N 1 0 351.490 5.136 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cccc(C)c2C)c2ccccc21 ZINC000549612327 568034564 /nfs/dbraw/zinc/03/45/64/568034564.db2.gz VQSUPSBQNLBYSK-WTOYTKOKSA-N 1 0 351.490 5.136 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2cccc(C)c2C)c2ccccc21 ZINC000549612328 568034555 /nfs/dbraw/zinc/03/45/55/568034555.db2.gz VQSUPSBQNLBYSK-YHYVQYDKSA-N 1 0 351.490 5.136 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cccc(C)c2C)c2ccccc21 ZINC000549612329 568034518 /nfs/dbraw/zinc/03/45/18/568034518.db2.gz VQSUPSBQNLBYSK-ZPMCFJSWSA-N 1 0 351.490 5.136 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnn(C)c1 ZINC000549613003 568034581 /nfs/dbraw/zinc/03/45/81/568034581.db2.gz BHECEGXVOTUKQL-AUUYWEPGSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnn(C)c1 ZINC000549613004 568034557 /nfs/dbraw/zinc/03/45/57/568034557.db2.gz BHECEGXVOTUKQL-IFXJQAMLSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnn(C)c1 ZINC000549613005 568034572 /nfs/dbraw/zinc/03/45/72/568034572.db2.gz BHECEGXVOTUKQL-KUHUBIRLSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnn(C)c1 ZINC000549613006 568034498 /nfs/dbraw/zinc/03/44/98/568034498.db2.gz BHECEGXVOTUKQL-LIRRHRJNSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@@H](Nc1cccc2c1CN(c1ccccn1)C2)[C@@H]1C[C@H]1c1ccccc1 ZINC000549627204 568034813 /nfs/dbraw/zinc/03/48/13/568034813.db2.gz YMGPPYVVOMQCDL-QMMLZNLJSA-N 1 0 355.485 5.206 20 0 FKADRO C[C@H](Nc1cccc2c1CN(c1ccccn1)C2)[C@@H]1C[C@H]1c1ccccc1 ZINC000549627205 568034826 /nfs/dbraw/zinc/03/48/26/568034826.db2.gz YMGPPYVVOMQCDL-YYWHXJBOSA-N 1 0 355.485 5.206 20 0 FKADRO COc1cccc2cc([C@H](C)N[C@H](C[NH+](C)C)c3ccc(Cl)cc3)oc21 ZINC000549627305 568034829 /nfs/dbraw/zinc/03/48/29/568034829.db2.gz ZCHCWSVGANGBEA-KBXCAEBGSA-N 1 0 372.896 5.048 20 0 FKADRO COc1cccc2cc([C@@H](C)N[C@@H](C[NH+](C)C)c3ccc(Cl)cc3)oc21 ZINC000549627307 568034799 /nfs/dbraw/zinc/03/47/99/568034799.db2.gz ZCHCWSVGANGBEA-KDOFPFPSSA-N 1 0 372.896 5.048 20 0 FKADRO COc1cccc2cc([C@H](C)N[C@@H](C[NH+](C)C)c3ccc(Cl)cc3)oc21 ZINC000549627309 568034784 /nfs/dbraw/zinc/03/47/84/568034784.db2.gz ZCHCWSVGANGBEA-KSSFIOAISA-N 1 0 372.896 5.048 20 0 FKADRO COc1cccc2cc([C@@H](C)N[C@H](C[NH+](C)C)c3ccc(Cl)cc3)oc21 ZINC000549627311 568034804 /nfs/dbraw/zinc/03/48/04/568034804.db2.gz ZCHCWSVGANGBEA-RDTXWAMCSA-N 1 0 372.896 5.048 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(COCC(F)(F)F)cc2)c1 ZINC000549709755 568030005 /nfs/dbraw/zinc/03/00/05/568030005.db2.gz QJSHNIBPYSSNTB-UHFFFAOYSA-N 1 0 357.803 5.017 20 0 FKADRO CCC(=O)Nc1cccc(C[NH2+]Cc2sc3c(cccc3Cl)c2C)c1 ZINC000549709840 568030145 /nfs/dbraw/zinc/03/01/45/568030145.db2.gz UABLZZMIZFDDLF-UHFFFAOYSA-N 1 0 372.921 5.501 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000549709922 568030176 /nfs/dbraw/zinc/03/01/76/568030176.db2.gz XSIXRYYSFUBADY-IBGZPJMESA-N 1 0 367.320 5.034 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000549709923 568030213 /nfs/dbraw/zinc/03/02/13/568030213.db2.gz XSIXRYYSFUBADY-LJQANCHMSA-N 1 0 367.320 5.034 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+]C1CCN(c2ccccn2)CC1 ZINC000549710793 568030203 /nfs/dbraw/zinc/03/02/03/568030203.db2.gz FMQFBKQPRSROBR-UHFFFAOYSA-N 1 0 371.937 5.017 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+]Cc2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000549711150 568030220 /nfs/dbraw/zinc/03/02/20/568030220.db2.gz JSQYKROMXUXXQQ-UHFFFAOYSA-N 1 0 364.876 5.191 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000549711635 568030218 /nfs/dbraw/zinc/03/02/18/568030218.db2.gz QYMIWOMNEXMJMJ-INIZCTEOSA-N 1 0 363.505 5.089 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000549711636 568030216 /nfs/dbraw/zinc/03/02/16/568030216.db2.gz QYMIWOMNEXMJMJ-MRXNPFEDSA-N 1 0 363.505 5.089 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000549712010 568030201 /nfs/dbraw/zinc/03/02/01/568030201.db2.gz ZIMGKCZLILSCIC-KRWDZBQOSA-N 1 0 365.521 5.335 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000549712011 568030184 /nfs/dbraw/zinc/03/01/84/568030184.db2.gz ZIMGKCZLILSCIC-QGZVFWFLSA-N 1 0 365.521 5.335 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(Br)cc1F ZINC000549717961 568030452 /nfs/dbraw/zinc/03/04/52/568030452.db2.gz MUUPKYJUGJGJSS-CYBMUJFWSA-N 1 0 365.290 5.266 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH+]1CCC(c2noc3cc(F)ccc32)CC1 ZINC000549718127 568030385 /nfs/dbraw/zinc/03/03/85/568030385.db2.gz XKVINDHVMPFLQD-UHFFFAOYSA-N 1 0 367.468 5.173 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(Oc3cccnc3)c(F)c2)c1 ZINC000549718925 568030417 /nfs/dbraw/zinc/03/04/17/568030417.db2.gz IBWFCXJPLKVPON-UHFFFAOYSA-N 1 0 356.828 5.265 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000549719286 568030398 /nfs/dbraw/zinc/03/03/98/568030398.db2.gz YLJXJTIXVMLNRQ-HNNXBMFYSA-N 1 0 358.894 5.131 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000549719287 568030407 /nfs/dbraw/zinc/03/04/07/568030407.db2.gz YLJXJTIXVMLNRQ-OAHLLOKOSA-N 1 0 358.894 5.131 20 0 FKADRO Cc1sccc1C[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000549734145 568030809 /nfs/dbraw/zinc/03/08/09/568030809.db2.gz SYOHKWNXECDPNC-UHFFFAOYSA-N 1 0 373.525 5.258 20 0 FKADRO Cc1sccc1C[NH2+][C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000549734376 568030891 /nfs/dbraw/zinc/03/08/91/568030891.db2.gz XIKRTKZKGVSKOZ-FQEVSTJZSA-N 1 0 365.477 5.076 20 0 FKADRO Cc1sccc1C[NH2+][C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000549734377 568030830 /nfs/dbraw/zinc/03/08/30/568030830.db2.gz XIKRTKZKGVSKOZ-HXUWFJFHSA-N 1 0 365.477 5.076 20 0 FKADRO Cc1csc(C(C)(C)[NH2+]Cc2sc3c(cccc3Cl)c2C)n1 ZINC000549749147 568030863 /nfs/dbraw/zinc/03/08/63/568030863.db2.gz JNCCJKUZQMSGBM-UHFFFAOYSA-N 1 0 350.940 5.653 20 0 FKADRO CSCc1cnc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)s1 ZINC000549750224 568030916 /nfs/dbraw/zinc/03/09/16/568030916.db2.gz VCPCQXBRCVEPTP-CYBMUJFWSA-N 1 0 359.347 5.090 20 0 FKADRO CSCc1cnc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)s1 ZINC000549750225 568030927 /nfs/dbraw/zinc/03/09/27/568030927.db2.gz VCPCQXBRCVEPTP-ZDUSSCGKSA-N 1 0 359.347 5.090 20 0 FKADRO CSCc1cnc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)s1 ZINC000549750984 568030977 /nfs/dbraw/zinc/03/09/77/568030977.db2.gz PMNCLYCQDYORCC-KRWDZBQOSA-N 1 0 352.956 5.291 20 0 FKADRO CSCc1cnc(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)s1 ZINC000549750985 568030959 /nfs/dbraw/zinc/03/09/59/568030959.db2.gz PMNCLYCQDYORCC-QGZVFWFLSA-N 1 0 352.956 5.291 20 0 FKADRO C[C@H](Nc1ccc(NC(=O)CC[N@@H+]2CCCC[C@H]2C)cc1)c1ccccc1 ZINC000549754797 568031137 /nfs/dbraw/zinc/03/11/37/568031137.db2.gz SBXAVBOKNJVHOX-MOPGFXCFSA-N 1 0 365.521 5.063 20 0 FKADRO C[C@H](Nc1ccc(NC(=O)CC[N@@H+]2CCCC[C@@H]2C)cc1)c1ccccc1 ZINC000549754798 568031053 /nfs/dbraw/zinc/03/10/53/568031053.db2.gz SBXAVBOKNJVHOX-OALUTQOASA-N 1 0 365.521 5.063 20 0 FKADRO C[C@@H](Nc1ccc(NC(=O)CC[N@@H+]2CCCC[C@@H]2C)cc1)c1ccccc1 ZINC000549754799 568031051 /nfs/dbraw/zinc/03/10/51/568031051.db2.gz SBXAVBOKNJVHOX-RBUKOAKNSA-N 1 0 365.521 5.063 20 0 FKADRO C[C@@H](Nc1ccc(NC(=O)CC[N@@H+]2CCCC[C@H]2C)cc1)c1ccccc1 ZINC000549754800 568031106 /nfs/dbraw/zinc/03/11/06/568031106.db2.gz SBXAVBOKNJVHOX-RTBURBONSA-N 1 0 365.521 5.063 20 0 FKADRO CC[C@](C)([NH2+]Cc1sc2c(cccc2Cl)c1C)c1nccs1 ZINC000549760951 568031573 /nfs/dbraw/zinc/03/15/73/568031573.db2.gz MKWZAHKIYVBHIY-KRWDZBQOSA-N 1 0 350.940 5.735 20 0 FKADRO CC[C@@](C)([NH2+]Cc1sc2c(cccc2Cl)c1C)c1nccs1 ZINC000549760952 568031559 /nfs/dbraw/zinc/03/15/59/568031559.db2.gz MKWZAHKIYVBHIY-QGZVFWFLSA-N 1 0 350.940 5.735 20 0 FKADRO Cc1csc([C@@H]([NH2+]Cc2sc3c(cccc3Cl)c2C)C2CC2)n1 ZINC000549761102 568031547 /nfs/dbraw/zinc/03/15/47/568031547.db2.gz ULYQQUGDOKYGQV-INIZCTEOSA-N 1 0 362.951 5.869 20 0 FKADRO Cc1csc([C@H]([NH2+]Cc2sc3c(cccc3Cl)c2C)C2CC2)n1 ZINC000549761104 568031570 /nfs/dbraw/zinc/03/15/70/568031570.db2.gz ULYQQUGDOKYGQV-MRXNPFEDSA-N 1 0 362.951 5.869 20 0 FKADRO CCCCc1ccc([C@@H]([NH2+]Cc2cnc3n[nH]c(C)c3c2)C(C)C)cc1 ZINC000549761818 568031562 /nfs/dbraw/zinc/03/15/62/568031562.db2.gz UVQNLGNNICSGRQ-NRFANRHFSA-N 1 0 350.510 5.096 20 0 FKADRO CCCCc1ccc([C@H]([NH2+]Cc2cnc3n[nH]c(C)c3c2)C(C)C)cc1 ZINC000549761819 568031576 /nfs/dbraw/zinc/03/15/76/568031576.db2.gz UVQNLGNNICSGRQ-OAQYLSRUSA-N 1 0 350.510 5.096 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H](CCCO)c1ccccc1 ZINC000549764375 568031598 /nfs/dbraw/zinc/03/15/98/568031598.db2.gz QEQIQEFRDSPWTL-GOSISDBHSA-N 1 0 359.922 5.467 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H](CCCO)c1ccccc1 ZINC000549764376 568031596 /nfs/dbraw/zinc/03/15/96/568031596.db2.gz QEQIQEFRDSPWTL-SFHVURJKSA-N 1 0 359.922 5.467 20 0 FKADRO CCC[N@H+](Cc1ccc(C)cc1-c1cnn(C)c1)[C@@H]1CCCc2cccnc21 ZINC000549779065 568031932 /nfs/dbraw/zinc/03/19/32/568031932.db2.gz SCFJMPBQGVQWCK-HSZRJFAPSA-N 1 0 374.532 5.080 20 0 FKADRO CCC[N@H+](Cc1ccc(C)cc1-c1cnn(C)c1)[C@H]1CCCc2cccnc21 ZINC000549779068 568031938 /nfs/dbraw/zinc/03/19/38/568031938.db2.gz SCFJMPBQGVQWCK-QHCPKHFHSA-N 1 0 374.532 5.080 20 0 FKADRO Cc1oc(-c2ccsc2)nc1CN(C)[C@H](C)c1nc2ccccc2s1 ZINC000549781268 568032075 /nfs/dbraw/zinc/03/20/75/568032075.db2.gz FYECFCUASWQHPW-GFCCVEGCSA-N 1 0 369.515 5.514 20 0 FKADRO Cc1oc(-c2ccsc2)nc1CN(C)[C@@H](C)c1nc2ccccc2s1 ZINC000549781269 568032058 /nfs/dbraw/zinc/03/20/58/568032058.db2.gz FYECFCUASWQHPW-LBPRGKRZSA-N 1 0 369.515 5.514 20 0 FKADRO Clc1ccc(-c2ccccc2C[NH2+]Cc2cccc3c2OCO3)cc1 ZINC000549805880 568032648 /nfs/dbraw/zinc/03/26/48/568032648.db2.gz IVFREAGVIOZMBR-UHFFFAOYSA-N 1 0 351.833 5.026 20 0 FKADRO Cc1nocc1C[NH2+][C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000549816828 568033118 /nfs/dbraw/zinc/03/31/18/568033118.db2.gz BNEOBJCGXHPBFP-GFCCVEGCSA-N 1 0 366.408 5.581 20 0 FKADRO Cc1nocc1C[NH2+][C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000549816829 568033114 /nfs/dbraw/zinc/03/31/14/568033114.db2.gz BNEOBJCGXHPBFP-LBPRGKRZSA-N 1 0 366.408 5.581 20 0 FKADRO CCCC[C@@H]([NH2+]C1CCC(NC(C)=O)CC1)c1ccc(Cl)cc1Cl ZINC000549818463 568033522 /nfs/dbraw/zinc/03/35/22/568033522.db2.gz UHELRELNBUYSJI-LADRWXRNSA-N 1 0 371.352 5.262 20 0 FKADRO CCCC[C@H]([NH2+]C1CCC(NC(C)=O)CC1)c1ccc(Cl)cc1Cl ZINC000549818471 568033684 /nfs/dbraw/zinc/03/36/84/568033684.db2.gz UHELRELNBUYSJI-RJYAGPCLSA-N 1 0 371.352 5.262 20 0 FKADRO Cc1c2cccc(Cl)c2sc1CN[C@H](C)c1c(F)cncc1F ZINC000549822613 568035812 /nfs/dbraw/zinc/03/58/12/568035812.db2.gz HSKHUBZSAIVTBM-SNVBAGLBSA-N 1 0 352.837 5.387 20 0 FKADRO FC(F)(F)[C@H]1CC[N@H+](Cc2cnc(-c3ccsc3)s2)CC12CCC2 ZINC000549822851 568036598 /nfs/dbraw/zinc/03/65/98/568036598.db2.gz WZJDYUHALVFOCP-AWEZNQCLSA-N 1 0 372.481 5.426 20 0 FKADRO FC(F)(F)[C@@H]1CC[N@H+](Cc2cnc(-c3ccsc3)s2)CC12CCC2 ZINC000549822852 568036579 /nfs/dbraw/zinc/03/65/79/568036579.db2.gz WZJDYUHALVFOCP-CQSZACIVSA-N 1 0 372.481 5.426 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000549823371 568037156 /nfs/dbraw/zinc/03/71/56/568037156.db2.gz QQVXDTMZJPUGOG-KRWDZBQOSA-N 1 0 365.702 5.047 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000549823380 568037232 /nfs/dbraw/zinc/03/72/32/568037232.db2.gz QQVXDTMZJPUGOG-QGZVFWFLSA-N 1 0 365.702 5.047 20 0 FKADRO CC(C)(C)c1cnc(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)s1 ZINC000549827621 568032005 /nfs/dbraw/zinc/03/20/05/568032005.db2.gz DTMLXCVKVDUEDE-AWEZNQCLSA-N 1 0 356.457 5.266 20 0 FKADRO CC(C)(C)c1cnc(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)s1 ZINC000549827625 568032091 /nfs/dbraw/zinc/03/20/91/568032091.db2.gz DTMLXCVKVDUEDE-CQSZACIVSA-N 1 0 356.457 5.266 20 0 FKADRO CCCOc1c(Cl)cc(C[NH2+]Cc2coc3ccccc23)cc1OC ZINC000549827981 568032154 /nfs/dbraw/zinc/03/21/54/568032154.db2.gz IATIITFJWZSLJR-UHFFFAOYSA-N 1 0 359.853 5.173 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1Cl ZINC000549828906 568032308 /nfs/dbraw/zinc/03/23/08/568032308.db2.gz QSLXDGZGPADYQW-UONOGXRCSA-N 1 0 373.859 5.085 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1Cl ZINC000549828907 568032356 /nfs/dbraw/zinc/03/23/56/568032356.db2.gz QSLXDGZGPADYQW-ZIAGYGMSSA-N 1 0 373.859 5.085 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2cccc(OCC(F)(F)F)c2)cc1 ZINC000549829191 568032324 /nfs/dbraw/zinc/03/23/24/568032324.db2.gz VRHCDQSLOCLRID-UHFFFAOYSA-N 1 0 359.338 5.029 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2cnc(-c3ccsc3)s2)cc1 ZINC000549829449 568032289 /nfs/dbraw/zinc/03/22/89/568032289.db2.gz JUUSRRROUDEPFM-UHFFFAOYSA-N 1 0 350.459 5.273 20 0 FKADRO Clc1cccc(-c2n[nH]cc2C[NH2+]Cc2cc3ccccc3s2)c1 ZINC000549829476 568032315 /nfs/dbraw/zinc/03/23/15/568032315.db2.gz LCRMTZRFHAZUDK-UHFFFAOYSA-N 1 0 353.878 5.235 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1 ZINC000549830319 568032346 /nfs/dbraw/zinc/03/23/46/568032346.db2.gz GIMVDHNBZYBKNH-HNNXBMFYSA-N 1 0 366.408 5.229 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1 ZINC000549830323 568032367 /nfs/dbraw/zinc/03/23/67/568032367.db2.gz GIMVDHNBZYBKNH-OAHLLOKOSA-N 1 0 366.408 5.229 20 0 FKADRO Cc1ncc(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)n1-c1ccccc1 ZINC000549830548 568032441 /nfs/dbraw/zinc/03/24/41/568032441.db2.gz JUFKAPWVCWXMMZ-FQEVSTJZSA-N 1 0 373.422 5.007 20 0 FKADRO Cc1ncc(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)n1-c1ccccc1 ZINC000549830550 568032455 /nfs/dbraw/zinc/03/24/55/568032455.db2.gz JUFKAPWVCWXMMZ-HXUWFJFHSA-N 1 0 373.422 5.007 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(Br)s1 ZINC000549831158 568032705 /nfs/dbraw/zinc/03/27/05/568032705.db2.gz PFOAMKCQPXNAIZ-JTQLQIEISA-N 1 0 360.267 5.473 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(Br)s1 ZINC000549831159 568032653 /nfs/dbraw/zinc/03/26/53/568032653.db2.gz PFOAMKCQPXNAIZ-SNVBAGLBSA-N 1 0 360.267 5.473 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+]Cc1conc1Cc1ccccc1)c1ccccc1 ZINC000549831365 568032656 /nfs/dbraw/zinc/03/26/56/568032656.db2.gz VRNXMNYSBHDOIC-IBGZPJMESA-N 1 0 374.406 5.091 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+]Cc1conc1Cc1ccccc1)c1ccccc1 ZINC000549831366 568032641 /nfs/dbraw/zinc/03/26/41/568032641.db2.gz VRNXMNYSBHDOIC-LJQANCHMSA-N 1 0 374.406 5.091 20 0 FKADRO Cc1ccc(-c2ncc(C[NH2+]Cc3ccc(C(C)(F)F)cc3)s2)cc1 ZINC000549832713 568033020 /nfs/dbraw/zinc/03/30/20/568033020.db2.gz NOCANKFYABVQPX-UHFFFAOYSA-N 1 0 358.457 5.520 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc(OCc3ccncc3)cc2)cc1 ZINC000549832741 568034532 /nfs/dbraw/zinc/03/45/32/568034532.db2.gz DXESGSMPECAPKY-UHFFFAOYSA-N 1 0 368.427 5.062 20 0 FKADRO CCOc1c(Cl)cc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1OC ZINC000549833003 568032219 /nfs/dbraw/zinc/03/22/19/568032219.db2.gz IWDONOQZGSUIHV-UHFFFAOYSA-N 1 0 369.839 5.149 20 0 FKADRO FC(F)(F)c1cccc(CC[NH2+]CC(c2ccccc2)c2ccccc2)n1 ZINC000549833070 568032323 /nfs/dbraw/zinc/03/23/23/568032323.db2.gz LWNUSXGHTYDCKK-UHFFFAOYSA-N 1 0 370.418 5.065 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1cc[nH]c(=O)c1 ZINC000549860582 568037957 /nfs/dbraw/zinc/03/79/57/568037957.db2.gz IGNJLYSUCCZJSS-LLVKDONJSA-N 1 0 363.244 5.205 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1cc[nH]c(=O)c1 ZINC000549860585 568038025 /nfs/dbraw/zinc/03/80/25/568038025.db2.gz IGNJLYSUCCZJSS-NSHDSACASA-N 1 0 363.244 5.205 20 0 FKADRO C[C@@H](F)CC[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000549882916 568038383 /nfs/dbraw/zinc/03/83/83/568038383.db2.gz LDJUMXNADIACIA-GFCCVEGCSA-N 1 0 369.267 5.083 20 0 FKADRO C[C@H](F)CC[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000549882917 568038362 /nfs/dbraw/zinc/03/83/62/568038362.db2.gz LDJUMXNADIACIA-LBPRGKRZSA-N 1 0 369.267 5.083 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+]CC(c2ccccc2)c2ccccc2)c1 ZINC000549884213 568038373 /nfs/dbraw/zinc/03/83/73/568038373.db2.gz ZUZPGNUJCDTPRW-UHFFFAOYSA-N 1 0 370.418 5.065 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(F)c(Cl)c1 ZINC000549902017 568038805 /nfs/dbraw/zinc/03/88/05/568038805.db2.gz LKQUWXDKAIAOKU-OLZOCXBDSA-N 1 0 361.823 5.216 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1ccc(-n2cccn2)c(F)c1 ZINC000549902018 568038927 /nfs/dbraw/zinc/03/89/27/568038927.db2.gz LKQUWXDKAIAOKU-STQMWFEESA-N 1 0 361.823 5.216 20 0 FKADRO COC1(CC[N@@H+]2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CCC1 ZINC000549918405 568039519 /nfs/dbraw/zinc/03/95/19/568039519.db2.gz DGUDBPFPKJKCGY-IBGZPJMESA-N 1 0 368.521 5.561 20 0 FKADRO COC1(CC[N@@H+]2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CCC1 ZINC000549918406 568039558 /nfs/dbraw/zinc/03/95/58/568039558.db2.gz DGUDBPFPKJKCGY-LJQANCHMSA-N 1 0 368.521 5.561 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+]C1(c2ccc(Cl)cc2)CCOCC1 ZINC000549918784 568039524 /nfs/dbraw/zinc/03/95/24/568039524.db2.gz JGVWRSGYAAASAU-UHFFFAOYSA-N 1 0 372.940 5.216 20 0 FKADRO Cc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000549920982 568039464 /nfs/dbraw/zinc/03/94/64/568039464.db2.gz DQPHTZXWSUVJDY-KRWDZBQOSA-N 1 0 367.468 5.173 20 0 FKADRO Cc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000549920983 568039493 /nfs/dbraw/zinc/03/94/93/568039493.db2.gz DQPHTZXWSUVJDY-QGZVFWFLSA-N 1 0 367.468 5.173 20 0 FKADRO Fc1ccc(CC2([NH2+]Cc3ccsc3Cl)CCOCC2)c(Cl)c1 ZINC000549924159 568039516 /nfs/dbraw/zinc/03/95/16/568039516.db2.gz UFBQMSQKKJKHFE-UHFFFAOYSA-N 1 0 374.308 5.076 20 0 FKADRO Cc1ccc(C2(C[NH2+]Cc3cnc([C@@H]4CCCO4)s3)CCCC2)c(C)c1 ZINC000549926968 568039707 /nfs/dbraw/zinc/03/97/07/568039707.db2.gz HIGNPKJWEPAMBZ-FQEVSTJZSA-N 1 0 370.562 5.213 20 0 FKADRO Cc1ccc(C2(C[NH2+]Cc3cnc([C@H]4CCCO4)s3)CCCC2)c(C)c1 ZINC000549926969 568039693 /nfs/dbraw/zinc/03/96/93/568039693.db2.gz HIGNPKJWEPAMBZ-HXUWFJFHSA-N 1 0 370.562 5.213 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1cccc(N2CCCC2)c1 ZINC000549927693 568039627 /nfs/dbraw/zinc/03/96/27/568039627.db2.gz DLRBHDFTKMQJDI-GOSISDBHSA-N 1 0 351.538 5.218 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1cccc(N2CCCC2)c1 ZINC000549927694 568039685 /nfs/dbraw/zinc/03/96/85/568039685.db2.gz DLRBHDFTKMQJDI-SFHVURJKSA-N 1 0 351.538 5.218 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2cccc(F)c2Cl)ccc1OC(C)C ZINC000549927700 568039700 /nfs/dbraw/zinc/03/97/00/568039700.db2.gz DUNMYYIJUUTBFQ-CYBMUJFWSA-N 1 0 351.849 5.126 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2cccc(F)c2Cl)ccc1OC(C)C ZINC000549927701 568039696 /nfs/dbraw/zinc/03/96/96/568039696.db2.gz DUNMYYIJUUTBFQ-ZDUSSCGKSA-N 1 0 351.849 5.126 20 0 FKADRO COCc1ccc(C[NH2+][C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000549927912 568039672 /nfs/dbraw/zinc/03/96/72/568039672.db2.gz IFQAWXZQAJAJPI-HNNXBMFYSA-N 1 0 352.503 5.116 20 0 FKADRO COCc1ccc(C[NH2+][C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000549927914 568039619 /nfs/dbraw/zinc/03/96/19/568039619.db2.gz IFQAWXZQAJAJPI-OAHLLOKOSA-N 1 0 352.503 5.116 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)ccc1OC(C)C ZINC000549928461 568039657 /nfs/dbraw/zinc/03/96/57/568039657.db2.gz QCCZTLNVMVHAKQ-INIZCTEOSA-N 1 0 356.510 5.160 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)ccc1OC(C)C ZINC000549928462 568039667 /nfs/dbraw/zinc/03/96/67/568039667.db2.gz QCCZTLNVMVHAKQ-MRXNPFEDSA-N 1 0 356.510 5.160 20 0 FKADRO Cc1sc([C@H](C)[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)nc1-c1ccc(Cl)cc1 ZINC000549933944 568039880 /nfs/dbraw/zinc/03/98/80/568039880.db2.gz MGFGGGPHRGPWAE-PFHKOEEOSA-N 1 0 364.942 5.379 20 0 FKADRO Cc1ccsc1C[NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1 ZINC000549943115 568039995 /nfs/dbraw/zinc/03/99/95/568039995.db2.gz OZYIIWCOKRZPIB-UHFFFAOYSA-N 1 0 372.534 5.797 20 0 FKADRO Cc1sc(C2([NH2+]Cc3cccs3)CCC2)nc1-c1ccccc1F ZINC000549943133 568039932 /nfs/dbraw/zinc/03/99/32/568039932.db2.gz POMQNKXRQDPTNW-UHFFFAOYSA-N 1 0 358.507 5.488 20 0 FKADRO CCc1nc(C(C)C)ccc1CN[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000550000004 568042046 /nfs/dbraw/zinc/04/20/46/568042046.db2.gz LGZFGFSULRVHTD-LLVKDONJSA-N 1 0 357.445 5.094 20 0 FKADRO CCc1nc(C(C)C)ccc1CN[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000550000011 568042020 /nfs/dbraw/zinc/04/20/20/568042020.db2.gz LGZFGFSULRVHTD-NSHDSACASA-N 1 0 357.445 5.094 20 0 FKADRO C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000550029891 568042697 /nfs/dbraw/zinc/04/26/97/568042697.db2.gz ZUGDTAILVJOJKD-AAEUAGOBSA-N 1 0 366.292 5.226 20 0 FKADRO C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000550029895 568042852 /nfs/dbraw/zinc/04/28/52/568042852.db2.gz ZUGDTAILVJOJKD-DGCLKSJQSA-N 1 0 366.292 5.226 20 0 FKADRO C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000550029897 568042909 /nfs/dbraw/zinc/04/29/09/568042909.db2.gz ZUGDTAILVJOJKD-WCQYABFASA-N 1 0 366.292 5.226 20 0 FKADRO C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000550029899 568042883 /nfs/dbraw/zinc/04/28/83/568042883.db2.gz ZUGDTAILVJOJKD-YPMHNXCESA-N 1 0 366.292 5.226 20 0 FKADRO CC(=O)Nc1ccc(C[NH2+]Cc2sc3c(cccc3Cl)c2C)cc1 ZINC000550077965 568044105 /nfs/dbraw/zinc/04/41/05/568044105.db2.gz LHVVDTXHDJSCOP-UHFFFAOYSA-N 1 0 358.894 5.111 20 0 FKADRO Clc1ccc([C@@H]([NH2+]Cc2conc2Cc2ccccc2)C2CC2)cc1 ZINC000550078166 568044093 /nfs/dbraw/zinc/04/40/93/568044093.db2.gz UZQDNQBFCKYMGB-NRFANRHFSA-N 1 0 352.865 5.160 20 0 FKADRO Clc1ccc([C@H]([NH2+]Cc2conc2Cc2ccccc2)C2CC2)cc1 ZINC000550078167 568044160 /nfs/dbraw/zinc/04/41/60/568044160.db2.gz UZQDNQBFCKYMGB-OAQYLSRUSA-N 1 0 352.865 5.160 20 0 FKADRO Cc1nocc1C[NH2+]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000550080853 568044076 /nfs/dbraw/zinc/04/40/76/568044076.db2.gz ZFVSTWPTPUFGQO-GOSISDBHSA-N 1 0 365.864 5.039 20 0 FKADRO Cc1nocc1C[NH2+]C[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000550080854 568044148 /nfs/dbraw/zinc/04/41/48/568044148.db2.gz ZFVSTWPTPUFGQO-SFHVURJKSA-N 1 0 365.864 5.039 20 0 FKADRO Cc1sccc1C[NH2+][C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000550095836 568044220 /nfs/dbraw/zinc/04/42/20/568044220.db2.gz FFHFOZSMGOBVMP-HNNXBMFYSA-N 1 0 350.487 5.160 20 0 FKADRO Cc1sccc1C[NH2+][C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000550095845 568044288 /nfs/dbraw/zinc/04/42/88/568044288.db2.gz FFHFOZSMGOBVMP-OAHLLOKOSA-N 1 0 350.487 5.160 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](CC)c1ccc(OC)c(OC)c1 ZINC000550096521 568044302 /nfs/dbraw/zinc/04/43/02/568044302.db2.gz LYCSLSIFDSXXJJ-GOSISDBHSA-N 1 0 356.510 5.026 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1 ZINC000550096523 568044395 /nfs/dbraw/zinc/04/43/95/568044395.db2.gz LYCSLSIFDSXXJJ-SFHVURJKSA-N 1 0 356.510 5.026 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2cccc(OCc3ccccn3)c2)c1 ZINC000550096681 568044434 /nfs/dbraw/zinc/04/44/34/568044434.db2.gz KAJCHSYKGIPPGB-KRWDZBQOSA-N 1 0 366.892 5.473 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2cccc(OCc3ccccn3)c2)c1 ZINC000550096686 568044330 /nfs/dbraw/zinc/04/43/30/568044330.db2.gz KAJCHSYKGIPPGB-QGZVFWFLSA-N 1 0 366.892 5.473 20 0 FKADRO CCCOc1ccc(Oc2ncccc2C[NH2+]Cc2ccsc2C)cc1 ZINC000550096717 568044351 /nfs/dbraw/zinc/04/43/51/568044351.db2.gz KTMBJKJRZNFJCT-UHFFFAOYSA-N 1 0 368.502 5.322 20 0 FKADRO CCCOc1ccccc1Oc1ncccc1C[NH2+]Cc1ccsc1C ZINC000550096736 568044314 /nfs/dbraw/zinc/04/43/14/568044314.db2.gz LFEJVTPBHCOXHZ-UHFFFAOYSA-N 1 0 368.502 5.322 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(OCc3cccnc3)cc2)c1 ZINC000550097760 568044325 /nfs/dbraw/zinc/04/43/25/568044325.db2.gz TYXMNARWGHCRQG-KRWDZBQOSA-N 1 0 366.892 5.473 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(OCc3cccnc3)cc2)c1 ZINC000550097761 568044362 /nfs/dbraw/zinc/04/43/62/568044362.db2.gz TYXMNARWGHCRQG-QGZVFWFLSA-N 1 0 366.892 5.473 20 0 FKADRO c1ccc(COc2cccc(C[NH2+]Cc3ccc(C4CCC4)cc3)c2)nc1 ZINC000550099783 568044510 /nfs/dbraw/zinc/04/45/10/568044510.db2.gz NOHJLDFLQYFQRB-UHFFFAOYSA-N 1 0 358.485 5.218 20 0 FKADRO C[C@@H](Nc1ccccc1NC(=O)c1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000550100643 568044513 /nfs/dbraw/zinc/04/45/13/568044513.db2.gz AHNUOWZPGRGBQO-GOSISDBHSA-N 1 0 373.500 5.174 20 0 FKADRO C[C@H](Nc1ccccc1NC(=O)c1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000550100644 568044532 /nfs/dbraw/zinc/04/45/32/568044532.db2.gz AHNUOWZPGRGBQO-SFHVURJKSA-N 1 0 373.500 5.174 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000550105429 568044607 /nfs/dbraw/zinc/04/46/07/568044607.db2.gz FCLCUNAWPRZCHF-KRWDZBQOSA-N 1 0 361.489 5.552 20 0 FKADRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000550105430 568044611 /nfs/dbraw/zinc/04/46/11/568044611.db2.gz FCLCUNAWPRZCHF-QGZVFWFLSA-N 1 0 361.489 5.552 20 0 FKADRO COc1ccc(F)c(C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000550105970 568044594 /nfs/dbraw/zinc/04/45/94/568044594.db2.gz DOZITOBTJIDVFG-CYBMUJFWSA-N 1 0 356.466 5.117 20 0 FKADRO COc1ccc(F)c(C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000550105971 568044587 /nfs/dbraw/zinc/04/45/87/568044587.db2.gz DOZITOBTJIDVFG-ZDUSSCGKSA-N 1 0 356.466 5.117 20 0 FKADRO Cc1sccc1C[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000550123480 568040447 /nfs/dbraw/zinc/04/04/47/568040447.db2.gz VTEHIBLFTPPZCR-UHFFFAOYSA-N 1 0 373.525 5.258 20 0 FKADRO CSCc1cnc(CNCc2ccccc2Sc2ccccc2)s1 ZINC000550142579 568042899 /nfs/dbraw/zinc/04/28/99/568042899.db2.gz WTUXKOJQOABFGX-UHFFFAOYSA-N 1 0 372.584 5.447 20 0 FKADRO COc1ccc(F)c(C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 ZINC000550142882 568043069 /nfs/dbraw/zinc/04/30/69/568043069.db2.gz LWXVBKRZLYYDLN-GFCCVEGCSA-N 1 0 374.456 5.256 20 0 FKADRO COc1ccc(F)c(C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 ZINC000550142883 568043077 /nfs/dbraw/zinc/04/30/77/568043077.db2.gz LWXVBKRZLYYDLN-LBPRGKRZSA-N 1 0 374.456 5.256 20 0 FKADRO CSCc1cnc(CNCc2ccccc2Oc2ccc(C)cc2)s1 ZINC000550144181 568043354 /nfs/dbraw/zinc/04/33/54/568043354.db2.gz QMFJSYXWMOJQNO-UHFFFAOYSA-N 1 0 370.543 5.397 20 0 FKADRO COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]Cc3ccsc3C)s2)cc1 ZINC000550148037 568044143 /nfs/dbraw/zinc/04/41/43/568044143.db2.gz JWEFJJXVUUBXNT-GFCCVEGCSA-N 1 0 358.532 5.348 20 0 FKADRO COc1ccc(-c2nc(C)c([C@H](C)[NH2+]Cc3ccsc3C)s2)cc1 ZINC000550148038 568044123 /nfs/dbraw/zinc/04/41/23/568044123.db2.gz JWEFJJXVUUBXNT-LBPRGKRZSA-N 1 0 358.532 5.348 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+]C2(c3ccc(Cl)cc3)CCOCC2)c1 ZINC000550157009 568051707 /nfs/dbraw/zinc/05/17/07/568051707.db2.gz QKPCYHGSAPBHNU-UHFFFAOYSA-N 1 0 350.289 5.097 20 0 FKADRO CCCC[N@H+](Cc1nc2c3ccccc3oc2c(=O)[nH]1)C1CCCCC1 ZINC000550158271 568051736 /nfs/dbraw/zinc/05/17/36/568051736.db2.gz PSPPKPBUBAVTQH-UHFFFAOYSA-N 1 0 353.466 5.016 20 0 FKADRO Cc1sc(C2([NH2+]CCCOC(C)C)CCC2)nc1-c1ccccc1F ZINC000550158467 568051749 /nfs/dbraw/zinc/05/17/49/568051749.db2.gz SIVJYADUIQDQDW-UHFFFAOYSA-N 1 0 362.514 5.042 20 0 FKADRO CCOC1CC(C[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)C1 ZINC000550159087 568044645 /nfs/dbraw/zinc/04/46/45/568044645.db2.gz ACVYANBRVLUAAF-UHFFFAOYSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+]Cc2cccc(COCC(F)(F)F)c2)c1 ZINC000550174020 568044982 /nfs/dbraw/zinc/04/49/82/568044982.db2.gz DCQJHVKYYRPWNB-UHFFFAOYSA-N 1 0 357.803 5.017 20 0 FKADRO Cc1sccc1C[NH2+][C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000550174529 568044955 /nfs/dbraw/zinc/04/49/55/568044955.db2.gz OMJFFGUQAKRQKV-LLVKDONJSA-N 1 0 362.951 5.993 20 0 FKADRO Fc1ccc(C2([NH2+]Cc3ccc(C4CCC4)cc3)CCOCC2)c(F)c1 ZINC000550174999 568045124 /nfs/dbraw/zinc/04/51/24/568045124.db2.gz ZAFRUXGUEDEKSE-UHFFFAOYSA-N 1 0 357.444 5.028 20 0 FKADRO CCc1nocc1C[NH2+]Cc1ccccc1-c1ccc(Cl)cc1Cl ZINC000550175230 568045116 /nfs/dbraw/zinc/04/51/16/568045116.db2.gz VYJHLTVAHGFUEO-UHFFFAOYSA-N 1 0 361.272 5.501 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](OC2CCOCC2)c2ccccc2)c1 ZINC000550175404 568045106 /nfs/dbraw/zinc/04/51/06/568045106.db2.gz RYEBURDBJGGEQL-HTAPYJJXSA-N 1 0 373.924 5.063 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](OC2CCOCC2)c2ccccc2)c1 ZINC000550175405 568045094 /nfs/dbraw/zinc/04/50/94/568045094.db2.gz RYEBURDBJGGEQL-JTSKRJEESA-N 1 0 373.924 5.063 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](OC2CCOCC2)c2ccccc2)c1 ZINC000550175406 568045046 /nfs/dbraw/zinc/04/50/46/568045046.db2.gz RYEBURDBJGGEQL-VGOFRKELSA-N 1 0 373.924 5.063 20 0 FKADRO Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](OC2CCOCC2)c2ccccc2)c1 ZINC000550175407 568045127 /nfs/dbraw/zinc/04/51/27/568045127.db2.gz RYEBURDBJGGEQL-VGSWGCGISA-N 1 0 373.924 5.063 20 0 FKADRO CSCc1cnc(C[NH2+]C(C)(C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000550214195 568046090 /nfs/dbraw/zinc/04/60/90/568046090.db2.gz JLUCDAOIJDBKKW-UHFFFAOYSA-N 1 0 374.497 5.136 20 0 FKADRO FC(F)(F)c1ccc(-c2n[nH]cc2C[NH2+]Cc2coc3ccccc23)cc1 ZINC000550216540 568046217 /nfs/dbraw/zinc/04/62/17/568046217.db2.gz BKADAIJIWSDOFS-UHFFFAOYSA-N 1 0 371.362 5.132 20 0 FKADRO CSCc1cnc(CNc2ccc([NH+]3CCCCCC3)cc2C)s1 ZINC000550216687 568046270 /nfs/dbraw/zinc/04/62/70/568046270.db2.gz FNSGKAIOQLVKQX-UHFFFAOYSA-N 1 0 361.580 5.307 20 0 FKADRO C[C@@H]([NH2+]Cc1cc2ccccc2s1)c1ccc(-n2cccn2)c(F)c1 ZINC000550225302 568046379 /nfs/dbraw/zinc/04/63/79/568046379.db2.gz CZNRKYPLVYYPRJ-CQSZACIVSA-N 1 0 351.450 5.077 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)c1ccccc1 ZINC000550225488 568046352 /nfs/dbraw/zinc/04/63/52/568046352.db2.gz IQPGADUVQZRCJK-DFQSSKMNSA-N 1 0 362.439 5.434 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)c1ccccc1 ZINC000550225489 568046377 /nfs/dbraw/zinc/04/63/77/568046377.db2.gz IQPGADUVQZRCJK-MISYRCLQSA-N 1 0 362.439 5.434 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)c1ccccc1 ZINC000550225490 568046393 /nfs/dbraw/zinc/04/63/93/568046393.db2.gz IQPGADUVQZRCJK-YSIASYRMSA-N 1 0 362.439 5.434 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)c1ccccc1 ZINC000550225491 568046392 /nfs/dbraw/zinc/04/63/92/568046392.db2.gz IQPGADUVQZRCJK-YZGWKJHDSA-N 1 0 362.439 5.434 20 0 FKADRO CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cn1 ZINC000550225706 568046346 /nfs/dbraw/zinc/04/63/46/568046346.db2.gz MFXHDHXIOCKBRT-UHFFFAOYSA-N 1 0 367.443 5.251 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3coc4ccccc34)s2)cc1 ZINC000550225720 568046339 /nfs/dbraw/zinc/04/63/39/568046339.db2.gz MVQOJQIBEASLCE-UHFFFAOYSA-N 1 0 354.862 5.500 20 0 FKADRO Fc1ccc2nc(C[NH2+]CC[C@@H](c3ccccc3)C(F)(F)F)sc2c1 ZINC000550225770 568046411 /nfs/dbraw/zinc/04/64/11/568046411.db2.gz PHQOBCJBQHETOS-AWEZNQCLSA-N 1 0 368.399 5.261 20 0 FKADRO Fc1ccc2nc(C[NH2+]CC[C@H](c3ccccc3)C(F)(F)F)sc2c1 ZINC000550225771 568046370 /nfs/dbraw/zinc/04/63/70/568046370.db2.gz PHQOBCJBQHETOS-CQSZACIVSA-N 1 0 368.399 5.261 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2cnc(C3CCCCC3)s2)cc1 ZINC000550225809 568046398 /nfs/dbraw/zinc/04/63/98/568046398.db2.gz ROJLELCSJHRXEF-UHFFFAOYSA-N 1 0 350.478 5.592 20 0 FKADRO Fc1ccc(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c2ncccc12 ZINC000550226051 568046309 /nfs/dbraw/zinc/04/63/09/568046309.db2.gz FKHOUAIXZYIRMA-KRWDZBQOSA-N 1 0 362.370 5.200 20 0 FKADRO Fc1ccc(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c2ncccc12 ZINC000550226152 568046456 /nfs/dbraw/zinc/04/64/56/568046456.db2.gz FKHOUAIXZYIRMA-QGZVFWFLSA-N 1 0 362.370 5.200 20 0 FKADRO Fc1cc2cccnc2c(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000550226202 568046444 /nfs/dbraw/zinc/04/64/44/568046444.db2.gz HMUWWGLJZNTNLE-GOSISDBHSA-N 1 0 362.370 5.200 20 0 FKADRO Fc1cc2cccnc2c(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000550226203 568046458 /nfs/dbraw/zinc/04/64/58/568046458.db2.gz HMUWWGLJZNTNLE-SFHVURJKSA-N 1 0 362.370 5.200 20 0 FKADRO CCOc1cc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)ccc1OC(F)F ZINC000550226217 568046519 /nfs/dbraw/zinc/04/65/19/568046519.db2.gz ICQYENIBYCQOGW-UHFFFAOYSA-N 1 0 371.374 5.088 20 0 FKADRO COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccc(C(C)(F)F)cc1 ZINC000550226246 568046513 /nfs/dbraw/zinc/04/65/13/568046513.db2.gz JWWOCVDHZXHZDE-UHFFFAOYSA-N 1 0 368.427 5.159 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc(Sc3ccccn3)o2)cc1 ZINC000550226356 568046500 /nfs/dbraw/zinc/04/65/00/568046500.db2.gz KSPNXQKSIKUMGI-UHFFFAOYSA-N 1 0 360.429 5.227 20 0 FKADRO c1c2ccccc2sc1C[NH2+]Cc1ccccc1OCc1ccccn1 ZINC000550227087 568046508 /nfs/dbraw/zinc/04/65/08/568046508.db2.gz ALHWWYALOSLGMJ-UHFFFAOYSA-N 1 0 360.482 5.165 20 0 FKADRO Cc1nn(-c2ccccc2)cc1C[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000550227151 568046431 /nfs/dbraw/zinc/04/64/31/568046431.db2.gz PDFZUQQXRTYVIU-FQEVSTJZSA-N 1 0 373.422 5.007 20 0 FKADRO Cc1nn(-c2ccccc2)cc1C[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000550227154 568046454 /nfs/dbraw/zinc/04/64/54/568046454.db2.gz PDFZUQQXRTYVIU-HXUWFJFHSA-N 1 0 373.422 5.007 20 0 FKADRO Fc1ccc(-c2nc(C[NH2+]Cc3cc4ccccc4s3)cs2)cc1 ZINC000550227504 568046483 /nfs/dbraw/zinc/04/64/83/568046483.db2.gz HSDWXSMTZBPSLU-UHFFFAOYSA-N 1 0 354.475 5.454 20 0 FKADRO CCOc1cc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc(Cl)c1OC ZINC000550229264 568046446 /nfs/dbraw/zinc/04/64/46/568046446.db2.gz DGFHFRXXLHXRLH-UHFFFAOYSA-N 1 0 369.839 5.149 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2cccc(OCc3ccccn3)c2)cc1 ZINC000550229513 568046561 /nfs/dbraw/zinc/04/65/61/568046561.db2.gz MXSQYFYWFUFJOH-UHFFFAOYSA-N 1 0 368.427 5.062 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2ccccc2OCc2ccncc2)cc1 ZINC000550230251 568046554 /nfs/dbraw/zinc/04/65/54/568046554.db2.gz ZWKWZEXZAJVXSM-UHFFFAOYSA-N 1 0 368.427 5.062 20 0 FKADRO CCc1noc(C)c1C[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000550239883 568046917 /nfs/dbraw/zinc/04/69/17/568046917.db2.gz JLRZDWLXTVBFFP-UHFFFAOYSA-N 1 0 370.880 5.068 20 0 FKADRO C[C@@]1(C[NH2+]Cc2csc(COc3ccccc3)n2)C[C@H]1c1ccccc1 ZINC000550251643 568047806 /nfs/dbraw/zinc/04/78/06/568047806.db2.gz JANPKAZJUHXKSE-UNMCSNQZSA-N 1 0 364.514 5.006 20 0 FKADRO CCOCC(C)(C)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000550256584 568047882 /nfs/dbraw/zinc/04/78/82/568047882.db2.gz FCCCWSKOKOCUPD-UHFFFAOYSA-N 1 0 359.322 5.022 20 0 FKADRO CCc1sc(-c2nnc(CNC(C)(C)c3ccccc3C)o2)cc1C ZINC000550262332 568048022 /nfs/dbraw/zinc/04/80/22/568048022.db2.gz FOMGYXJHITXPCD-UHFFFAOYSA-N 1 0 355.507 5.002 20 0 FKADRO Cc1ccccc1C(C)(C)NCc1csc(COc2ccc(F)cc2)n1 ZINC000550262712 568047972 /nfs/dbraw/zinc/04/79/72/568047972.db2.gz PBWABVANPSPHHU-UHFFFAOYSA-N 1 0 370.493 5.195 20 0 FKADRO Fc1cc(C[NH2+]Cc2cnc(C3CCCCC3)s2)ccc1OC(F)F ZINC000550275018 568048293 /nfs/dbraw/zinc/04/82/93/568048293.db2.gz MXASSJFPZLBNMU-UHFFFAOYSA-N 1 0 370.440 5.221 20 0 FKADRO C[C@H]([NH2+]Cc1cc2ccccc2s1)c1ccc(-n2cccn2)c(F)c1 ZINC000550275723 568048288 /nfs/dbraw/zinc/04/82/88/568048288.db2.gz CZNRKYPLVYYPRJ-AWEZNQCLSA-N 1 0 351.450 5.077 20 0 FKADRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000550284631 568048553 /nfs/dbraw/zinc/04/85/53/568048553.db2.gz VRDAFCBKYQUMRQ-DLBZAZTESA-N 1 0 352.453 5.085 20 0 FKADRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000550284632 568048559 /nfs/dbraw/zinc/04/85/59/568048559.db2.gz VRDAFCBKYQUMRQ-IAGOWNOFSA-N 1 0 352.453 5.085 20 0 FKADRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000550284634 568048574 /nfs/dbraw/zinc/04/85/74/568048574.db2.gz VRDAFCBKYQUMRQ-IRXDYDNUSA-N 1 0 352.453 5.085 20 0 FKADRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000550284636 568048545 /nfs/dbraw/zinc/04/85/45/568048545.db2.gz VRDAFCBKYQUMRQ-SJORKVTESA-N 1 0 352.453 5.085 20 0 FKADRO Fc1ccc(CC2([NH2+]Cc3ccc(Cl)s3)CCOCC2)c(Cl)c1 ZINC000550307285 568049705 /nfs/dbraw/zinc/04/97/05/568049705.db2.gz BVEFPEHAQIPZPV-UHFFFAOYSA-N 1 0 374.308 5.076 20 0 FKADRO Fc1ccc(CC2([NH2+]Cc3sccc3Cl)CCOCC2)c(Cl)c1 ZINC000550308199 568049707 /nfs/dbraw/zinc/04/97/07/568049707.db2.gz OBFXIIDKEORRLT-UHFFFAOYSA-N 1 0 374.308 5.076 20 0 FKADRO Cc1sc(C2([NH2+]C[C@@H]3CCO[C@H](C)C3)CCC2)nc1-c1ccccc1F ZINC000550321636 568049796 /nfs/dbraw/zinc/04/97/96/568049796.db2.gz RBDGDEUADLGCPR-GDBMZVCRSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+]C[C@@H]3CCO[C@@H](C)C3)CCC2)nc1-c1ccccc1F ZINC000550321637 568049804 /nfs/dbraw/zinc/04/98/04/568049804.db2.gz RBDGDEUADLGCPR-GOEBONIOSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+]C[C@H]3CCO[C@@H](C)C3)CCC2)nc1-c1ccccc1F ZINC000550321638 568049775 /nfs/dbraw/zinc/04/97/75/568049775.db2.gz RBDGDEUADLGCPR-HOCLYGCPSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+]C[C@H]3CCO[C@H](C)C3)CCC2)nc1-c1ccccc1F ZINC000550321642 568049919 /nfs/dbraw/zinc/04/99/19/568049919.db2.gz RBDGDEUADLGCPR-ZBFHGGJFSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sccc1CNC1(c2nc(-c3ccccc3F)c(C)s2)CCC1 ZINC000550325674 568050115 /nfs/dbraw/zinc/05/01/15/568050115.db2.gz YUBIKVAZDWWHRF-UHFFFAOYSA-N 1 0 372.534 5.797 20 0 FKADRO CO[C@H](C)c1nc(C[NH2+][C@](C)(Cc2ccc(Cl)cc2)C(C)C)cs1 ZINC000550370655 568050732 /nfs/dbraw/zinc/05/07/32/568050732.db2.gz UHRVTBCIMPTOQW-AUUYWEPGSA-N 1 0 366.958 5.251 20 0 FKADRO CO[C@@H](C)c1nc(C[NH2+][C@](C)(Cc2ccc(Cl)cc2)C(C)C)cs1 ZINC000550370656 568050749 /nfs/dbraw/zinc/05/07/49/568050749.db2.gz UHRVTBCIMPTOQW-IFXJQAMLSA-N 1 0 366.958 5.251 20 0 FKADRO CO[C@H](C)c1nc(C[NH2+][C@@](C)(Cc2ccc(Cl)cc2)C(C)C)cs1 ZINC000550370657 568050736 /nfs/dbraw/zinc/05/07/36/568050736.db2.gz UHRVTBCIMPTOQW-KUHUBIRLSA-N 1 0 366.958 5.251 20 0 FKADRO CO[C@@H](C)c1nc(C[NH2+][C@@](C)(Cc2ccc(Cl)cc2)C(C)C)cs1 ZINC000550370658 568050683 /nfs/dbraw/zinc/05/06/83/568050683.db2.gz UHRVTBCIMPTOQW-LIRRHRJNSA-N 1 0 366.958 5.251 20 0 FKADRO CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@H](C)c2ccc(CC(C)C)cc2)cc1 ZINC000550428432 568050328 /nfs/dbraw/zinc/05/03/28/568050328.db2.gz DNYVWTCJMVDJBQ-MSOLQXFVSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(CC(C)C)cc2)cc1 ZINC000550428433 568050384 /nfs/dbraw/zinc/05/03/84/568050384.db2.gz DNYVWTCJMVDJBQ-QZTJIDSGSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(CC(C)C)cc2)cc1 ZINC000550428434 568050388 /nfs/dbraw/zinc/05/03/88/568050388.db2.gz DNYVWTCJMVDJBQ-ROUUACIJSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(CC(C)C)cc2)cc1 ZINC000550428435 568050349 /nfs/dbraw/zinc/05/03/49/568050349.db2.gz DNYVWTCJMVDJBQ-ZWKOTPCHSA-N 1 0 373.562 5.091 20 0 FKADRO Cc1sc(C2(N[C@@H](C)c3ccncc3)CCC2)nc1-c1ccccc1F ZINC000550526583 568070889 /nfs/dbraw/zinc/07/08/89/568070889.db2.gz BGSKXXGXAQOPGB-AWEZNQCLSA-N 1 0 367.493 5.383 20 0 FKADRO Cc1sc(C2(N[C@H](C)c3ccncc3)CCC2)nc1-c1ccccc1F ZINC000550526584 568070858 /nfs/dbraw/zinc/07/08/58/568070858.db2.gz BGSKXXGXAQOPGB-CQSZACIVSA-N 1 0 367.493 5.383 20 0 FKADRO CCCN1Cc2cccc(NC(=O)c3cc(Cl)c(F)cc3Cl)c2C1 ZINC000550546253 568068646 /nfs/dbraw/zinc/06/86/46/568068646.db2.gz FJVMPRDHIZOFOK-UHFFFAOYSA-N 1 0 367.251 5.110 20 0 FKADRO Cc1nc([C@@H](C)[N@H+]2CCCO[C@@H](C(C)C)C2)oc1-c1ccc(Cl)cc1 ZINC000550558306 568074441 /nfs/dbraw/zinc/07/44/41/568074441.db2.gz GXEWBOGFVILVHC-CRAIPNDOSA-N 1 0 362.901 5.111 20 0 FKADRO Cc1nc([C@H](C)[N@H+]2CCCO[C@@H](C(C)C)C2)oc1-c1ccc(Cl)cc1 ZINC000550558308 568074445 /nfs/dbraw/zinc/07/44/45/568074445.db2.gz GXEWBOGFVILVHC-MAUKXSAKSA-N 1 0 362.901 5.111 20 0 FKADRO Cc1nc([C@@H](C)[N@H+]2CCCO[C@H](C(C)C)C2)oc1-c1ccc(Cl)cc1 ZINC000550558310 568074480 /nfs/dbraw/zinc/07/44/80/568074480.db2.gz GXEWBOGFVILVHC-QAPCUYQASA-N 1 0 362.901 5.111 20 0 FKADRO Cc1nc([C@H](C)[N@H+]2CCCO[C@H](C(C)C)C2)oc1-c1ccc(Cl)cc1 ZINC000550558312 568074494 /nfs/dbraw/zinc/07/44/94/568074494.db2.gz GXEWBOGFVILVHC-YJBOKZPZSA-N 1 0 362.901 5.111 20 0 FKADRO C[C@@H]([NH2+]CCc1nccn1Cc1ccccc1)c1ccc(F)c2ccccc21 ZINC000550604982 568080622 /nfs/dbraw/zinc/08/06/22/568080622.db2.gz ITHIOCKSGIIXCB-GOSISDBHSA-N 1 0 373.475 5.117 20 0 FKADRO C[C@H]([NH2+]CCc1nccn1Cc1ccccc1)c1ccc(F)c2ccccc21 ZINC000550604983 568080785 /nfs/dbraw/zinc/08/07/85/568080785.db2.gz ITHIOCKSGIIXCB-SFHVURJKSA-N 1 0 373.475 5.117 20 0 FKADRO C[C@@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc(F)c2ccccc21 ZINC000550606721 568077797 /nfs/dbraw/zinc/07/77/97/568077797.db2.gz JXETWFVTZQJQDH-CYBMUJFWSA-N 1 0 353.828 5.131 20 0 FKADRO C[C@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc(F)c2ccccc21 ZINC000550606722 568077828 /nfs/dbraw/zinc/07/78/28/568077828.db2.gz JXETWFVTZQJQDH-ZDUSSCGKSA-N 1 0 353.828 5.131 20 0 FKADRO CCN(CC)[C@@H](C[NH2+]Cc1cnc(-c2ccccc2)s1)c1ccsc1 ZINC000550616144 568077883 /nfs/dbraw/zinc/07/78/83/568077883.db2.gz AYQGRULMQGNZEV-IBGZPJMESA-N 1 0 371.575 5.044 20 0 FKADRO CCN(CC)[C@H](C[NH2+]Cc1cnc(-c2ccccc2)s1)c1ccsc1 ZINC000550616147 568077858 /nfs/dbraw/zinc/07/78/58/568077858.db2.gz AYQGRULMQGNZEV-LJQANCHMSA-N 1 0 371.575 5.044 20 0 FKADRO Fc1ccc(Oc2ccc(C[NH2+]Cc3cnc4ccccc4c3)cc2)cc1 ZINC000550616834 568077875 /nfs/dbraw/zinc/07/78/75/568077875.db2.gz IJTHCSNBYMIEDB-UHFFFAOYSA-N 1 0 358.416 5.456 20 0 FKADRO COc1ccc([C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 ZINC000550618763 568078398 /nfs/dbraw/zinc/07/83/98/568078398.db2.gz HDSAUWNMWWHDDP-GOSISDBHSA-N 1 0 369.814 5.608 20 0 FKADRO COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 ZINC000550618764 568078454 /nfs/dbraw/zinc/07/84/54/568078454.db2.gz HDSAUWNMWWHDDP-SFHVURJKSA-N 1 0 369.814 5.608 20 0 FKADRO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(F)c2ccccc21 ZINC000550621290 568083545 /nfs/dbraw/zinc/08/35/45/568083545.db2.gz HUXGGDXKZKQCNO-KRWDZBQOSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(F)c2ccccc21 ZINC000550621291 568083539 /nfs/dbraw/zinc/08/35/39/568083539.db2.gz HUXGGDXKZKQCNO-QGZVFWFLSA-N 1 0 359.448 5.075 20 0 FKADRO COCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)cc1OC ZINC000550621985 568083568 /nfs/dbraw/zinc/08/35/68/568083568.db2.gz HVAYPYBTOKLFEV-DLBZAZTESA-N 1 0 369.505 5.010 20 0 FKADRO COCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)cc1OC ZINC000550621988 568083579 /nfs/dbraw/zinc/08/35/79/568083579.db2.gz HVAYPYBTOKLFEV-IAGOWNOFSA-N 1 0 369.505 5.010 20 0 FKADRO COCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)cc1OC ZINC000550621989 568083583 /nfs/dbraw/zinc/08/35/83/568083583.db2.gz HVAYPYBTOKLFEV-IRXDYDNUSA-N 1 0 369.505 5.010 20 0 FKADRO COCCOc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)cc1OC ZINC000550621990 568083560 /nfs/dbraw/zinc/08/35/60/568083560.db2.gz HVAYPYBTOKLFEV-SJORKVTESA-N 1 0 369.505 5.010 20 0 FKADRO C[C@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc(F)c2ccccc21 ZINC000550622175 568083605 /nfs/dbraw/zinc/08/36/05/568083605.db2.gz ISDIMCSWBQJHMP-KRWDZBQOSA-N 1 0 363.480 5.215 20 0 FKADRO C[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc(F)c2ccccc21 ZINC000550622176 568083621 /nfs/dbraw/zinc/08/36/21/568083621.db2.gz ISDIMCSWBQJHMP-QGZVFWFLSA-N 1 0 363.480 5.215 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)cc1 ZINC000550623017 568083663 /nfs/dbraw/zinc/08/36/63/568083663.db2.gz QXNHTUWMFGITSQ-DLBZAZTESA-N 1 0 365.521 5.506 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)cc1 ZINC000550623018 568083674 /nfs/dbraw/zinc/08/36/74/568083674.db2.gz QXNHTUWMFGITSQ-IAGOWNOFSA-N 1 0 365.521 5.506 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)cc1 ZINC000550623019 568083680 /nfs/dbraw/zinc/08/36/80/568083680.db2.gz QXNHTUWMFGITSQ-IRXDYDNUSA-N 1 0 365.521 5.506 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)cc1 ZINC000550623020 568083720 /nfs/dbraw/zinc/08/37/20/568083720.db2.gz QXNHTUWMFGITSQ-SJORKVTESA-N 1 0 365.521 5.506 20 0 FKADRO CCCC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000550623064 568083665 /nfs/dbraw/zinc/08/36/65/568083665.db2.gz SGJDPSRYGURHAL-INIZCTEOSA-N 1 0 364.464 5.568 20 0 FKADRO CCCC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000550623065 568083685 /nfs/dbraw/zinc/08/36/85/568083685.db2.gz SGJDPSRYGURHAL-MRXNPFEDSA-N 1 0 364.464 5.568 20 0 FKADRO CSc1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000550623131 568083687 /nfs/dbraw/zinc/08/36/87/568083687.db2.gz SLJHARQCKCTMEH-CYBMUJFWSA-N 1 0 354.338 5.010 20 0 FKADRO CSc1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000550623137 568083672 /nfs/dbraw/zinc/08/36/72/568083672.db2.gz SLJHARQCKCTMEH-ZDUSSCGKSA-N 1 0 354.338 5.010 20 0 FKADRO CCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)c1 ZINC000550623338 568083659 /nfs/dbraw/zinc/08/36/59/568083659.db2.gz VATJDIODSWQIKQ-HNNXBMFYSA-N 1 0 350.437 5.178 20 0 FKADRO CCC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)c1 ZINC000550623339 568083654 /nfs/dbraw/zinc/08/36/54/568083654.db2.gz VATJDIODSWQIKQ-OAHLLOKOSA-N 1 0 350.437 5.178 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(COCc2ccco2)c1)c1cccc(C2CC2)c1 ZINC000550623364 568083682 /nfs/dbraw/zinc/08/36/82/568083682.db2.gz VQGFECNOVSBUCG-GOSISDBHSA-N 1 0 361.485 5.725 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(COCc2ccco2)c1)c1cccc(C2CC2)c1 ZINC000550623365 568083696 /nfs/dbraw/zinc/08/36/96/568083696.db2.gz VQGFECNOVSBUCG-SFHVURJKSA-N 1 0 361.485 5.725 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)ccc1OC(F)F ZINC000550623913 568081116 /nfs/dbraw/zinc/08/11/16/568081116.db2.gz CSYBBZSGRMOULD-KBPBESRZSA-N 1 0 361.432 5.586 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)ccc1OC(F)F ZINC000550623916 568081142 /nfs/dbraw/zinc/08/11/42/568081142.db2.gz CSYBBZSGRMOULD-KGLIPLIRSA-N 1 0 361.432 5.586 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(C3CC3)c2)ccc1OC(F)F ZINC000550623917 568082157 /nfs/dbraw/zinc/08/21/57/568082157.db2.gz CSYBBZSGRMOULD-UONOGXRCSA-N 1 0 361.432 5.586 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(C3CC3)c2)ccc1OC(F)F ZINC000550623918 568082326 /nfs/dbraw/zinc/08/23/26/568082326.db2.gz CSYBBZSGRMOULD-ZIAGYGMSSA-N 1 0 361.432 5.586 20 0 FKADRO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)c3ccc(F)c4ccccc43)cn2)n1 ZINC000550624484 568082878 /nfs/dbraw/zinc/08/28/78/568082878.db2.gz SETLGGGPUJKCEX-KRWDZBQOSA-N 1 0 374.463 5.027 20 0 FKADRO Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)c3ccc(F)c4ccccc43)cn2)n1 ZINC000550624485 568082880 /nfs/dbraw/zinc/08/28/80/568082880.db2.gz SETLGGGPUJKCEX-QGZVFWFLSA-N 1 0 374.463 5.027 20 0 FKADRO CC(C)Oc1ccc(C[NH2+]Cc2cccc3[nH]ccc32)c(C(F)(F)F)c1 ZINC000550632835 568086888 /nfs/dbraw/zinc/08/68/88/568086888.db2.gz QOMFIIREGVJJAS-UHFFFAOYSA-N 1 0 362.395 5.264 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(C2CC2)c1 ZINC000550643920 568089479 /nfs/dbraw/zinc/08/94/79/568089479.db2.gz GZKNNMKQGQQOEV-KRWDZBQOSA-N 1 0 371.484 5.062 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(C2CC2)c1 ZINC000550643922 568089477 /nfs/dbraw/zinc/08/94/77/568089477.db2.gz GZKNNMKQGQQOEV-QGZVFWFLSA-N 1 0 371.484 5.062 20 0 FKADRO CC(C)(NCc1csc(-c2ccco2)n1)c1cccc(C(F)(F)F)c1 ZINC000550667115 568096931 /nfs/dbraw/zinc/09/69/31/568096931.db2.gz PRSZRXVAKQHQDO-UHFFFAOYSA-N 1 0 366.408 5.447 20 0 FKADRO COc1ccc(C[NH2+][C@H](c2ccc(Br)cc2)C2CCC2)cc1 ZINC000550672997 568099612 /nfs/dbraw/zinc/09/96/12/568099612.db2.gz XYARURXTSIZFMB-IBGZPJMESA-N 1 0 360.295 5.089 20 0 FKADRO COc1ccc(C[NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)cc1 ZINC000550672998 568099618 /nfs/dbraw/zinc/09/96/18/568099618.db2.gz XYARURXTSIZFMB-LJQANCHMSA-N 1 0 360.295 5.089 20 0 FKADRO Cc1ccsc1C[N@@H+](C)Cc1cc(Cl)ccc1OCc1cccnc1 ZINC000550681608 568100127 /nfs/dbraw/zinc/10/01/27/568100127.db2.gz SHVVQXBXFUUEFC-UHFFFAOYSA-N 1 0 372.921 5.316 20 0 FKADRO O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1ccc2c[nH+]cn2c1 ZINC000550689816 568100252 /nfs/dbraw/zinc/10/02/52/568100252.db2.gz BWEWHDPPRAWVLX-UHFFFAOYSA-N 1 0 365.795 5.046 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(COCC(F)(F)F)c1)c1cccc(C2CC2)c1 ZINC000550700672 568100351 /nfs/dbraw/zinc/10/03/51/568100351.db2.gz LAUYHQZFXHBZNI-HNNXBMFYSA-N 1 0 363.423 5.494 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(COCC(F)(F)F)c1)c1cccc(C2CC2)c1 ZINC000550700673 568100319 /nfs/dbraw/zinc/10/03/19/568100319.db2.gz LAUYHQZFXHBZNI-OAHLLOKOSA-N 1 0 363.423 5.494 20 0 FKADRO COCCCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)c1 ZINC000550701265 568100338 /nfs/dbraw/zinc/10/03/38/568100338.db2.gz XENYCBZEBZKRAD-KRWDZBQOSA-N 1 0 367.464 5.245 20 0 FKADRO COCCCOc1cccc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)c1 ZINC000550701266 568100329 /nfs/dbraw/zinc/10/03/29/568100329.db2.gz XENYCBZEBZKRAD-QGZVFWFLSA-N 1 0 367.464 5.245 20 0 FKADRO Cc1cc(C(=O)Nc2cc(C[NH+]3CCCC3)ccc2C)c2nccc(C)c2c1 ZINC000550715630 568100987 /nfs/dbraw/zinc/10/09/87/568100987.db2.gz RPKUQKSPSXARCA-UHFFFAOYSA-N 1 0 373.500 5.008 20 0 FKADRO Cc1nc(-c2cccc(N[C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c2)oc1C ZINC000550754365 568102624 /nfs/dbraw/zinc/10/26/24/568102624.db2.gz UELNUSABIZIQCN-FCHUYYIVSA-N 1 0 361.489 5.206 20 0 FKADRO Cc1nc(-c2cccc(N[C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c2)oc1C ZINC000550754366 568102655 /nfs/dbraw/zinc/10/26/55/568102655.db2.gz UELNUSABIZIQCN-FGZHOGPDSA-N 1 0 361.489 5.206 20 0 FKADRO Cc1nc(-c2cccc(N[C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c2)oc1C ZINC000550754367 568102661 /nfs/dbraw/zinc/10/26/61/568102661.db2.gz UELNUSABIZIQCN-VXKWHMMOSA-N 1 0 361.489 5.206 20 0 FKADRO Cc1nc(-c2cccc(N[C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c2)oc1C ZINC000550754368 568102646 /nfs/dbraw/zinc/10/26/46/568102646.db2.gz UELNUSABIZIQCN-YADHBBJMSA-N 1 0 361.489 5.206 20 0 FKADRO Fc1ccc([C@@H]2C[C@@H]([NH2+][C@@H](Cc3ccccc3Cl)C3CC3)CCO2)cc1 ZINC000550789606 568103342 /nfs/dbraw/zinc/10/33/42/568103342.db2.gz QOFYPLOPFRJSBO-BVSLBCMMSA-N 1 0 373.899 5.310 20 0 FKADRO Fc1ccc([C@@H]2C[C@H]([NH2+][C@H](Cc3ccccc3Cl)C3CC3)CCO2)cc1 ZINC000550789607 568103299 /nfs/dbraw/zinc/10/32/99/568103299.db2.gz QOFYPLOPFRJSBO-FCEUIQTBSA-N 1 0 373.899 5.310 20 0 FKADRO Fc1ccc([C@@H]2C[C@H]([NH2+][C@@H](Cc3ccccc3Cl)C3CC3)CCO2)cc1 ZINC000550789608 568102533 /nfs/dbraw/zinc/10/25/33/568102533.db2.gz QOFYPLOPFRJSBO-HJNYFJLDSA-N 1 0 373.899 5.310 20 0 FKADRO Fc1ccc([C@@H]2C[C@@H]([NH2+][C@H](Cc3ccccc3Cl)C3CC3)CCO2)cc1 ZINC000550789609 568102514 /nfs/dbraw/zinc/10/25/14/568102514.db2.gz QOFYPLOPFRJSBO-NNWRFLSQSA-N 1 0 373.899 5.310 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(F)c3ccccc31)CCO2 ZINC000550795424 568106696 /nfs/dbraw/zinc/10/66/96/568106696.db2.gz RWRROMKJQVHDPL-QKKBWIMNSA-N 1 0 351.421 5.162 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc(F)c3ccccc31)CCO2 ZINC000550795425 568106701 /nfs/dbraw/zinc/10/67/01/568106701.db2.gz RWRROMKJQVHDPL-SZNDQCEHSA-N 1 0 351.421 5.162 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)C[C@@H]1c1ccccc1 ZINC000550796772 568106810 /nfs/dbraw/zinc/10/68/10/568106810.db2.gz AMEBZOTYOQGLIZ-JKLQHZFJSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)C[C@H]1c1ccccc1 ZINC000550796773 568106804 /nfs/dbraw/zinc/10/68/04/568106804.db2.gz AMEBZOTYOQGLIZ-NMIHRBCNSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)C[C@H]1c1ccccc1 ZINC000550796774 568106837 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20 0 FKADRO C[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccc(C2CC2)c1 ZINC000550797113 568106885 /nfs/dbraw/zinc/10/68/85/568106885.db2.gz LMWYOHSTOUTNND-RBZFPXEDSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccc(C2CC2)c1 ZINC000550797114 568106895 /nfs/dbraw/zinc/10/68/95/568106895.db2.gz LMWYOHSTOUTNND-RNODOKPDSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccc(C2CC2)c1 ZINC000550797115 568106914 /nfs/dbraw/zinc/10/69/14/568106914.db2.gz LMWYOHSTOUTNND-XCLFUZPHSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccc(C2CC2)c1 ZINC000550797116 568106942 /nfs/dbraw/zinc/10/69/42/568106942.db2.gz LMWYOHSTOUTNND-ZUOKHONESA-N 1 0 371.322 5.523 20 0 FKADRO FC(F)c1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000550797573 568106907 /nfs/dbraw/zinc/10/69/07/568106907.db2.gz SDPFGQYFEXFPOX-GFCCVEGCSA-N 1 0 358.251 5.225 20 0 FKADRO FC(F)c1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000550797585 568106922 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FKADRO CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2coc3ccccc23)cc1 ZINC000550828211 568107494 /nfs/dbraw/zinc/10/74/94/568107494.db2.gz ZBEHRSKAMRPYKD-INIZCTEOSA-N 1 0 365.477 5.157 20 0 FKADRO CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2coc3ccccc23)cc1 ZINC000550828212 568107501 /nfs/dbraw/zinc/10/75/01/568107501.db2.gz ZBEHRSKAMRPYKD-MRXNPFEDSA-N 1 0 365.477 5.157 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000550831579 568107826 /nfs/dbraw/zinc/10/78/26/568107826.db2.gz XLRQGGNDXQBBKP-IXDGSTSKSA-N 1 0 367.493 5.249 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000550831580 568107796 /nfs/dbraw/zinc/10/77/96/568107796.db2.gz XLRQGGNDXQBBKP-OMWUSAIZSA-N 1 0 367.493 5.249 20 0 FKADRO CCOc1cccc([C@@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2OC)c1 ZINC000550834709 568107789 /nfs/dbraw/zinc/10/77/89/568107789.db2.gz CHGVSXNVHWJIMH-GFCCVEGCSA-N 1 0 354.277 5.252 20 0 FKADRO Cc1cc([C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c2cccnc2)ccc1F ZINC000550835425 568107819 /nfs/dbraw/zinc/10/78/19/568107819.db2.gz JGJHGNUEHZBHIJ-KJXAQDMKSA-N 1 0 364.439 5.293 20 0 FKADRO Cc1cc([C@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c2cccnc2)ccc1F ZINC000550835426 568107808 /nfs/dbraw/zinc/10/78/08/568107808.db2.gz JGJHGNUEHZBHIJ-RRPUWOKSSA-N 1 0 364.439 5.293 20 0 FKADRO Cc1c(C[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)oc2ccc(F)cc12 ZINC000550840491 568112913 /nfs/dbraw/zinc/11/29/13/568112913.db2.gz OSISBUOCUVMJLG-UHFFFAOYSA-N 1 0 369.827 5.009 20 0 FKADRO CCCOc1ccc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)c(C)c1 ZINC000550843476 568109201 /nfs/dbraw/zinc/10/92/01/568109201.db2.gz SDXQOYLTPJEJRH-UHFFFAOYSA-N 1 0 366.505 5.022 20 0 FKADRO c1ccc(C[C@@H]([NH2+]Cc2ccc(C3CCCCC3)cc2)c2cccnc2)nc1 ZINC000550843969 568109307 /nfs/dbraw/zinc/10/93/07/568109307.db2.gz CZPMQMDKDUSJQC-RUZDIDTESA-N 1 0 371.528 5.598 20 0 FKADRO c1ccc(C[C@H]([NH2+]Cc2ccc(C3CCCCC3)cc2)c2cccnc2)nc1 ZINC000550843970 568109282 /nfs/dbraw/zinc/10/92/82/568109282.db2.gz CZPMQMDKDUSJQC-VWLOTQADSA-N 1 0 371.528 5.598 20 0 FKADRO COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C3CCCCC3)cc2)s1 ZINC000550844036 568109335 /nfs/dbraw/zinc/10/93/35/568109335.db2.gz GILDMOAHXRHTIA-INIZCTEOSA-N 1 0 372.578 5.539 20 0 FKADRO COCCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C3CCCCC3)cc2)s1 ZINC000550844037 568109293 /nfs/dbraw/zinc/10/92/93/568109293.db2.gz GILDMOAHXRHTIA-MRXNPFEDSA-N 1 0 372.578 5.539 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000550844156 568109311 /nfs/dbraw/zinc/10/93/11/568109311.db2.gz KAQXVXWCCZGORE-GOSISDBHSA-N 1 0 364.533 5.287 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000550844157 568109328 /nfs/dbraw/zinc/10/93/28/568109328.db2.gz KAQXVXWCCZGORE-SFHVURJKSA-N 1 0 364.533 5.287 20 0 FKADRO COc1ccncc1C[NH2+][C@H](C)c1ccc(-c2ccccc2Cl)s1 ZINC000550846397 568109361 /nfs/dbraw/zinc/10/93/61/568109361.db2.gz AKIAVWUWNCSSQL-CYBMUJFWSA-N 1 0 358.894 5.323 20 0 FKADRO COc1ccncc1C[NH2+][C@@H](C)c1ccc(-c2ccccc2Cl)s1 ZINC000550846398 568109428 /nfs/dbraw/zinc/10/94/28/568109428.db2.gz AKIAVWUWNCSSQL-ZDUSSCGKSA-N 1 0 358.894 5.323 20 0 FKADRO C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]CC(C)(C)C(C)(C)C ZINC000550846455 568109437 /nfs/dbraw/zinc/10/94/37/568109437.db2.gz DLKXASMSSDBALU-CYBMUJFWSA-N 1 0 358.448 5.084 20 0 FKADRO C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]CC(C)(C)C(C)(C)C ZINC000550846456 568109464 /nfs/dbraw/zinc/10/94/64/568109464.db2.gz DLKXASMSSDBALU-ZDUSSCGKSA-N 1 0 358.448 5.084 20 0 FKADRO COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)cc2)c2ccc(F)cc2)cc1 ZINC000550846970 568109528 /nfs/dbraw/zinc/10/95/28/568109528.db2.gz CEIAKTUZJLVJDL-NRFANRHFSA-N 1 0 355.840 5.367 20 0 FKADRO CCCCOc1cc(C[NH2+]Cc2ccccc2C(F)(F)F)ccc1OC ZINC000550846995 568109526 /nfs/dbraw/zinc/10/95/26/568109526.db2.gz MKXRVMUQZMDYRN-UHFFFAOYSA-N 1 0 367.411 5.183 20 0 FKADRO Fc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)cc1F ZINC000550847061 568109558 /nfs/dbraw/zinc/10/95/58/568109558.db2.gz NPFLNTMUXWWVBJ-UHFFFAOYSA-N 1 0 361.338 5.325 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000550847905 568109531 /nfs/dbraw/zinc/10/95/31/568109531.db2.gz PPCSPBZXSBKXPF-FOIQADDNSA-N 1 0 363.530 5.358 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000550847906 568109487 /nfs/dbraw/zinc/10/94/87/568109487.db2.gz PPCSPBZXSBKXPF-MGPUTAFESA-N 1 0 363.530 5.358 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC000550847907 568109500 /nfs/dbraw/zinc/10/95/00/568109500.db2.gz PPCSPBZXSBKXPF-QRWLVFNGSA-N 1 0 363.530 5.358 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC000550847908 568109535 /nfs/dbraw/zinc/10/95/35/568109535.db2.gz PPCSPBZXSBKXPF-YWZLYKJASA-N 1 0 363.530 5.358 20 0 FKADRO Cc1nc2c(s1)[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)CCC2 ZINC000550855607 568109625 /nfs/dbraw/zinc/10/96/25/568109625.db2.gz BMVWUICCSBDPLF-CABCVRRESA-N 1 0 354.441 5.155 20 0 FKADRO Cc1nc2c(s1)[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)CCC2 ZINC000550855611 568109591 /nfs/dbraw/zinc/10/95/91/568109591.db2.gz BMVWUICCSBDPLF-GJZGRUSLSA-N 1 0 354.441 5.155 20 0 FKADRO Cc1nc2c(s1)[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)CCC2 ZINC000550855612 568109602 /nfs/dbraw/zinc/10/96/02/568109602.db2.gz BMVWUICCSBDPLF-HUUCEWRRSA-N 1 0 354.441 5.155 20 0 FKADRO Cc1nc2c(s1)[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)CCC2 ZINC000550855613 568109566 /nfs/dbraw/zinc/10/95/66/568109566.db2.gz BMVWUICCSBDPLF-LSDHHAIUSA-N 1 0 354.441 5.155 20 0 FKADRO Cc1c([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cnn1C(C)C ZINC000550855706 568109576 /nfs/dbraw/zinc/10/95/76/568109576.db2.gz MJHIZMCKEOJRJG-KBXCAEBGSA-N 1 0 353.432 5.159 20 0 FKADRO Cc1c([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cnn1C(C)C ZINC000550855709 568109616 /nfs/dbraw/zinc/10/96/16/568109616.db2.gz MJHIZMCKEOJRJG-KDOFPFPSSA-N 1 0 353.432 5.159 20 0 FKADRO Cc1c([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cnn1C(C)C ZINC000550855710 568109598 /nfs/dbraw/zinc/10/95/98/568109598.db2.gz MJHIZMCKEOJRJG-KSSFIOAISA-N 1 0 353.432 5.159 20 0 FKADRO Cc1c([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cnn1C(C)C ZINC000550855711 568109600 /nfs/dbraw/zinc/10/96/00/568109600.db2.gz MJHIZMCKEOJRJG-RDTXWAMCSA-N 1 0 353.432 5.159 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)[C@@H](C)c1ccc(Cl)cc1 ZINC000550856215 568109735 /nfs/dbraw/zinc/10/97/35/568109735.db2.gz IMILDFMKJVNORJ-CHWSQXEVSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)[C@@H](C)c1ccc(Cl)cc1 ZINC000550856216 568109737 /nfs/dbraw/zinc/10/97/37/568109737.db2.gz IMILDFMKJVNORJ-OLZOCXBDSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)[C@H](C)c1ccc(Cl)cc1 ZINC000550856217 568109733 /nfs/dbraw/zinc/10/97/33/568109733.db2.gz IMILDFMKJVNORJ-QWHCGFSZSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCc1cccc(C(F)(F)F)n1 ZINC000550856218 568109730 /nfs/dbraw/zinc/10/97/30/568109730.db2.gz IMILDFMKJVNORJ-STQMWFEESA-N 1 0 356.819 5.078 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1sccc1Br ZINC000550856499 568109685 /nfs/dbraw/zinc/10/96/85/568109685.db2.gz JZVPZRIYXLGQPD-JTQLQIEISA-N 1 0 360.267 5.473 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1sccc1Br ZINC000550856500 568109682 /nfs/dbraw/zinc/10/96/82/568109682.db2.gz JZVPZRIYXLGQPD-SNVBAGLBSA-N 1 0 360.267 5.473 20 0 FKADRO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]Cc1ccc(C(C)(F)F)cc1 ZINC000550856646 568109981 /nfs/dbraw/zinc/10/99/81/568109981.db2.gz LUANHFVRLBRIFM-LBPRGKRZSA-N 1 0 352.494 5.712 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)ccc1OC(F)F ZINC000550856857 568109068 /nfs/dbraw/zinc/10/90/68/568109068.db2.gz ZKWJTWPIPNPFDI-GFCCVEGCSA-N 1 0 371.374 5.259 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)ccc1OC(F)F ZINC000550856858 568109088 /nfs/dbraw/zinc/10/90/88/568109088.db2.gz ZKWJTWPIPNPFDI-LBPRGKRZSA-N 1 0 371.374 5.259 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@H](c1ncc[nH]1)C1CCCCC1)c1ccccc1 ZINC000550857066 568109496 /nfs/dbraw/zinc/10/94/96/568109496.db2.gz MYEMTKUFDZFOBQ-MSOLQXFVSA-N 1 0 365.443 5.357 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@@H](c1ncc[nH]1)C1CCCCC1)c1ccccc1 ZINC000550857067 568109489 /nfs/dbraw/zinc/10/94/89/568109489.db2.gz MYEMTKUFDZFOBQ-QZTJIDSGSA-N 1 0 365.443 5.357 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+][C@H](c1ncc[nH]1)C1CCCCC1)c1ccccc1 ZINC000550857068 568109498 /nfs/dbraw/zinc/10/94/98/568109498.db2.gz MYEMTKUFDZFOBQ-ROUUACIJSA-N 1 0 365.443 5.357 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+][C@@H](c1ncc[nH]1)C1CCCCC1)c1ccccc1 ZINC000550857069 568109537 /nfs/dbraw/zinc/10/95/37/568109537.db2.gz MYEMTKUFDZFOBQ-ZWKOTPCHSA-N 1 0 365.443 5.357 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(-n2ccnc2)cc1 ZINC000550857244 568109605 /nfs/dbraw/zinc/10/96/05/568109605.db2.gz PPZNDGCGSPOVFZ-JXFKEZNVSA-N 1 0 373.422 5.259 20 0 FKADRO C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccc(-n2ccnc2)cc1 ZINC000550857245 568109613 /nfs/dbraw/zinc/10/96/13/568109613.db2.gz PPZNDGCGSPOVFZ-OXJNMPFZSA-N 1 0 373.422 5.259 20 0 FKADRO C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccc(-n2ccnc2)cc1 ZINC000550857246 568109621 /nfs/dbraw/zinc/10/96/21/568109621.db2.gz PPZNDGCGSPOVFZ-OXQOHEQNSA-N 1 0 373.422 5.259 20 0 FKADRO C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(-n2ccnc2)cc1 ZINC000550857247 568109587 /nfs/dbraw/zinc/10/95/87/568109587.db2.gz PPZNDGCGSPOVFZ-UZLBHIALSA-N 1 0 373.422 5.259 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)c2ccccc21 ZINC000550857446 568115292 /nfs/dbraw/zinc/11/52/92/568115292.db2.gz SWBNZSMEKITUJD-PMACEKPBSA-N 1 0 373.443 5.070 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)c2ccccc21 ZINC000550857447 568115339 /nfs/dbraw/zinc/11/53/39/568115339.db2.gz SWBNZSMEKITUJD-UXHICEINSA-N 1 0 373.443 5.070 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)c2ccccc21 ZINC000550857448 568115346 /nfs/dbraw/zinc/11/53/46/568115346.db2.gz SWBNZSMEKITUJD-VQTJNVASSA-N 1 0 373.443 5.070 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)c2ccccc21 ZINC000550857449 568115318 /nfs/dbraw/zinc/11/53/18/568115318.db2.gz SWBNZSMEKITUJD-WOJBJXKFSA-N 1 0 373.443 5.070 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2cc3ccccc3s2)ccc1OC(F)F ZINC000550857452 568115360 /nfs/dbraw/zinc/11/53/60/568115360.db2.gz SYILAXGKBQHYNW-GFCCVEGCSA-N 1 0 363.429 5.362 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2cc3ccccc3s2)ccc1OC(F)F ZINC000550857453 568115431 /nfs/dbraw/zinc/11/54/31/568115431.db2.gz SYILAXGKBQHYNW-LBPRGKRZSA-N 1 0 363.429 5.362 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1 ZINC000550857479 568115461 /nfs/dbraw/zinc/11/54/61/568115461.db2.gz UIUSUSBUVXZMNS-LLVKDONJSA-N 1 0 362.317 5.013 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1 ZINC000550857480 568115438 /nfs/dbraw/zinc/11/54/38/568115438.db2.gz UIUSUSBUVXZMNS-NSHDSACASA-N 1 0 362.317 5.013 20 0 FKADRO FC(F)(F)c1cccc(CC[NH2+][C@H]2CCSc3c(Cl)cccc32)n1 ZINC000550857556 568115441 /nfs/dbraw/zinc/11/54/41/568115441.db2.gz BJZSDJYMADPPQM-AWEZNQCLSA-N 1 0 372.843 5.123 20 0 FKADRO FC(F)(F)c1cccc(CC[NH2+][C@@H]2CCSc3c(Cl)cccc32)n1 ZINC000550857557 568115457 /nfs/dbraw/zinc/11/54/57/568115457.db2.gz BJZSDJYMADPPQM-CQSZACIVSA-N 1 0 372.843 5.123 20 0 FKADRO COC[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cccc(C(F)(F)F)c1 ZINC000550857799 568115488 /nfs/dbraw/zinc/11/54/88/568115488.db2.gz ZAXMRRGKIUHYSU-KRWDZBQOSA-N 1 0 373.365 5.294 20 0 FKADRO COC[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cccc(C(F)(F)F)c1 ZINC000550857800 568115529 /nfs/dbraw/zinc/11/55/29/568115529.db2.gz ZAXMRRGKIUHYSU-QGZVFWFLSA-N 1 0 373.365 5.294 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cc(Br)cs1 ZINC000550857951 568115476 /nfs/dbraw/zinc/11/54/76/568115476.db2.gz GBSKHHZMFCDBFW-JTQLQIEISA-N 1 0 360.267 5.473 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cc(Br)cs1 ZINC000550857952 568115486 /nfs/dbraw/zinc/11/54/86/568115486.db2.gz GBSKHHZMFCDBFW-SNVBAGLBSA-N 1 0 360.267 5.473 20 0 FKADRO C[C@H](NCc1ccc(C(C)(F)F)cc1)c1nc(-c2ccccc2)cs1 ZINC000550858077 568115539 /nfs/dbraw/zinc/11/55/39/568115539.db2.gz ILZHZSOYXXBDHR-AWEZNQCLSA-N 1 0 358.457 5.773 20 0 FKADRO C[C@@H](NCc1ccc(C(C)(F)F)cc1)c1nc(-c2ccccc2)cs1 ZINC000550858078 568115510 /nfs/dbraw/zinc/11/55/10/568115510.db2.gz ILZHZSOYXXBDHR-CQSZACIVSA-N 1 0 358.457 5.773 20 0 FKADRO CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000550858092 568115544 /nfs/dbraw/zinc/11/55/44/568115544.db2.gz JJURKOOYXIUPMM-IPELMVKDSA-N 1 0 351.412 5.088 20 0 FKADRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000550858093 568115512 /nfs/dbraw/zinc/11/55/12/568115512.db2.gz JJURKOOYXIUPMM-LZQZEXGQSA-N 1 0 351.412 5.088 20 0 FKADRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000550858094 568115509 /nfs/dbraw/zinc/11/55/09/568115509.db2.gz JJURKOOYXIUPMM-MNEFBYGVSA-N 1 0 351.412 5.088 20 0 FKADRO CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000550858095 568115502 /nfs/dbraw/zinc/11/55/02/568115502.db2.gz JJURKOOYXIUPMM-SNRMKQJTSA-N 1 0 351.412 5.088 20 0 FKADRO Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1 ZINC000550858255 568115593 /nfs/dbraw/zinc/11/55/93/568115593.db2.gz PAUNJMDPFCGCLH-HNNXBMFYSA-N 1 0 355.432 5.143 20 0 FKADRO Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1 ZINC000550858256 568115608 /nfs/dbraw/zinc/11/56/08/568115608.db2.gz PAUNJMDPFCGCLH-OAHLLOKOSA-N 1 0 355.432 5.143 20 0 FKADRO C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 ZINC000550858463 568115720 /nfs/dbraw/zinc/11/57/20/568115720.db2.gz XHPWOUGRJJXYNL-DZGCQCFKSA-N 1 0 368.468 5.409 20 0 FKADRO C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 ZINC000550858464 568115672 /nfs/dbraw/zinc/11/56/72/568115672.db2.gz XHPWOUGRJJXYNL-HIFRSBDPSA-N 1 0 368.468 5.409 20 0 FKADRO C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 ZINC000550858465 568115675 /nfs/dbraw/zinc/11/56/75/568115675.db2.gz XHPWOUGRJJXYNL-UKRRQHHQSA-N 1 0 368.468 5.409 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 ZINC000550858466 568115713 /nfs/dbraw/zinc/11/57/13/568115713.db2.gz XHPWOUGRJJXYNL-ZFWWWQNUSA-N 1 0 368.468 5.409 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000550858483 568115687 /nfs/dbraw/zinc/11/56/87/568115687.db2.gz XTLXBGDIQAZZFH-INIZCTEOSA-N 1 0 370.365 5.379 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000550858484 568115724 /nfs/dbraw/zinc/11/57/24/568115724.db2.gz XTLXBGDIQAZZFH-MRXNPFEDSA-N 1 0 370.365 5.379 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@H]1CCCOc2c(C)cc(C(C)(C)C)cc21 ZINC000550858756 568115798 /nfs/dbraw/zinc/11/57/98/568115798.db2.gz JNTSLGKQYBYHFK-FQEVSTJZSA-N 1 0 356.510 5.155 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@@H]1CCCOc2c(C)cc(C(C)(C)C)cc21 ZINC000550858757 568115809 /nfs/dbraw/zinc/11/58/09/568115809.db2.gz JNTSLGKQYBYHFK-HXUWFJFHSA-N 1 0 356.510 5.155 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)c1ccc(-n2cccn2)c(F)c1 ZINC000550860488 568116023 /nfs/dbraw/zinc/11/60/23/568116023.db2.gz JTMSIDZUHMMLLS-QVKFZJNVSA-N 1 0 374.463 5.221 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)c1ccc(-n2cccn2)c(F)c1 ZINC000550860489 568116030 /nfs/dbraw/zinc/11/60/30/568116030.db2.gz JTMSIDZUHMMLLS-VFNWGFHPSA-N 1 0 374.463 5.221 20 0 FKADRO Cc1cccc(COc2ccc([C@@H](C)[NH2+][C@@H](C)c3cc[nH]c(=O)c3)cc2)c1 ZINC000550860732 568116033 /nfs/dbraw/zinc/11/60/33/568116033.db2.gz NYVYSWJEWBEKJH-MSOLQXFVSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1cccc(COc2ccc([C@@H](C)[NH2+][C@H](C)c3cc[nH]c(=O)c3)cc2)c1 ZINC000550860733 568116005 /nfs/dbraw/zinc/11/60/05/568116005.db2.gz NYVYSWJEWBEKJH-QZTJIDSGSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1cccc(COc2ccc([C@H](C)[NH2+][C@@H](C)c3cc[nH]c(=O)c3)cc2)c1 ZINC000550860734 568115978 /nfs/dbraw/zinc/11/59/78/568115978.db2.gz NYVYSWJEWBEKJH-ROUUACIJSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1cccc(COc2ccc([C@H](C)[NH2+][C@H](C)c3cc[nH]c(=O)c3)cc2)c1 ZINC000550860735 568115987 /nfs/dbraw/zinc/11/59/87/568115987.db2.gz NYVYSWJEWBEKJH-ZWKOTPCHSA-N 1 0 362.473 5.086 20 0 FKADRO CSc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1F ZINC000550860886 568116017 /nfs/dbraw/zinc/11/60/17/568116017.db2.gz QGFWPLFGJMLRTD-KGLIPLIRSA-N 1 0 373.472 5.284 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1F ZINC000550860887 568115974 /nfs/dbraw/zinc/11/59/74/568115974.db2.gz QGFWPLFGJMLRTD-ZIAGYGMSSA-N 1 0 373.472 5.284 20 0 FKADRO COCC1(CC[NH2+][C@H](C)c2csc(-c3csc(C)n3)c2)CCC1 ZINC000550863862 568116079 /nfs/dbraw/zinc/11/60/79/568116079.db2.gz VYFZUJDQGXXSEI-CYBMUJFWSA-N 1 0 350.553 5.037 20 0 FKADRO COCC1(CC[NH2+][C@@H](C)c2csc(-c3csc(C)n3)c2)CCC1 ZINC000550863865 568116036 /nfs/dbraw/zinc/11/60/36/568116036.db2.gz VYFZUJDQGXXSEI-ZDUSSCGKSA-N 1 0 350.553 5.037 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(-c2ccncc2)cc1 ZINC000550881668 568116080 /nfs/dbraw/zinc/11/60/80/568116080.db2.gz ANNMKWGAOXJFJM-HNNXBMFYSA-N 1 0 371.406 5.056 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(-c2ccncc2)cc1 ZINC000550881671 568113141 /nfs/dbraw/zinc/11/31/41/568113141.db2.gz ANNMKWGAOXJFJM-OAHLLOKOSA-N 1 0 371.406 5.056 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+][C@H]2CCSc3c(Cl)cccc32)c1 ZINC000550882030 568115783 /nfs/dbraw/zinc/11/57/83/568115783.db2.gz GRTBLFVYUUGPHC-HNNXBMFYSA-N 1 0 372.843 5.123 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+][C@@H]2CCSc3c(Cl)cccc32)c1 ZINC000550882031 568115847 /nfs/dbraw/zinc/11/58/47/568115847.db2.gz GRTBLFVYUUGPHC-OAHLLOKOSA-N 1 0 372.843 5.123 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 ZINC000550882139 568115857 /nfs/dbraw/zinc/11/58/57/568115857.db2.gz IKSVSEUFDCWSOI-LLVKDONJSA-N 1 0 362.317 5.013 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 ZINC000550882140 568116008 /nfs/dbraw/zinc/11/60/08/568116008.db2.gz IKSVSEUFDCWSOI-NSHDSACASA-N 1 0 362.317 5.013 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+][C@H]2CCSc3ccc(Cl)cc32)c1 ZINC000550882718 568116614 /nfs/dbraw/zinc/11/66/14/568116614.db2.gz RPWPZVYRHXQEJB-HNNXBMFYSA-N 1 0 372.843 5.123 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)c1 ZINC000550882719 568116617 /nfs/dbraw/zinc/11/66/17/568116617.db2.gz RPWPZVYRHXQEJB-OAHLLOKOSA-N 1 0 372.843 5.123 20 0 FKADRO FC(F)(F)c1ccnc(CC[NH2+]C(c2ccccc2)c2ccccc2)c1 ZINC000550885237 568116862 /nfs/dbraw/zinc/11/68/62/568116862.db2.gz FJKGKCVHHWYDQT-UHFFFAOYSA-N 1 0 356.391 5.022 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000550887509 568118340 /nfs/dbraw/zinc/11/83/40/568118340.db2.gz RQVXXUSAOCBZKF-HKUYNNGSSA-N 1 0 361.514 5.339 20 0 FKADRO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000550887523 568118332 /nfs/dbraw/zinc/11/83/32/568118332.db2.gz RQVXXUSAOCBZKF-IEBWSBKVSA-N 1 0 361.514 5.339 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000550887524 568118345 /nfs/dbraw/zinc/11/83/45/568118345.db2.gz RQVXXUSAOCBZKF-MJGOQNOKSA-N 1 0 361.514 5.339 20 0 FKADRO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000550887526 568118383 /nfs/dbraw/zinc/11/83/83/568118383.db2.gz RQVXXUSAOCBZKF-PKOBYXMFSA-N 1 0 361.514 5.339 20 0 FKADRO C[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1cn2ccccc2n1 ZINC000550888177 568116064 /nfs/dbraw/zinc/11/60/64/568116064.db2.gz ZZSGNHDPXYFEOG-AWEZNQCLSA-N 1 0 374.469 5.055 20 0 FKADRO C[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1cn2ccccc2n1 ZINC000550888179 568116085 /nfs/dbraw/zinc/11/60/85/568116085.db2.gz ZZSGNHDPXYFEOG-CQSZACIVSA-N 1 0 374.469 5.055 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1)c1cn2ccccc2n1 ZINC000550889267 568116166 /nfs/dbraw/zinc/11/61/66/568116166.db2.gz APTUOECFKWQEFF-INIZCTEOSA-N 1 0 361.420 5.117 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1)c1cn2ccccc2n1 ZINC000550889268 568116141 /nfs/dbraw/zinc/11/61/41/568116141.db2.gz APTUOECFKWQEFF-MRXNPFEDSA-N 1 0 361.420 5.117 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1cccc(-c2ccncc2)c1 ZINC000550894773 568116330 /nfs/dbraw/zinc/11/63/30/568116330.db2.gz HOCVIABEECOZFN-AWEZNQCLSA-N 1 0 372.390 5.340 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1cccc(-c2ccncc2)c1 ZINC000550894774 568116333 /nfs/dbraw/zinc/11/63/33/568116333.db2.gz HOCVIABEECOZFN-CQSZACIVSA-N 1 0 372.390 5.340 20 0 FKADRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(OC(F)F)c(F)c2)c2ccsc2S1 ZINC000550895410 568116316 /nfs/dbraw/zinc/11/63/16/568116316.db2.gz PFOBXBFOVLNFMV-TVQRCGJNSA-N 1 0 359.438 5.204 20 0 FKADRO C[C@H]1C[C@H]([NH2+]Cc2ccc(OC(F)F)c(F)c2)c2ccsc2S1 ZINC000550895411 568116305 /nfs/dbraw/zinc/11/63/05/568116305.db2.gz PFOBXBFOVLNFMV-ZANVPECISA-N 1 0 359.438 5.204 20 0 FKADRO Cc1nccnc1CC[NH2+][C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000550895455 568116326 /nfs/dbraw/zinc/11/63/26/568116326.db2.gz SPOIDBSFFFYMOC-AWEZNQCLSA-N 1 0 357.910 5.060 20 0 FKADRO Cc1nccnc1CC[NH2+][C@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000550895456 568116308 /nfs/dbraw/zinc/11/63/08/568116308.db2.gz SPOIDBSFFFYMOC-CQSZACIVSA-N 1 0 357.910 5.060 20 0 FKADRO Fc1cc(C[NH2+]C(c2ccccc2)c2ccccc2)ccc1OC(F)F ZINC000550898330 568116507 /nfs/dbraw/zinc/11/65/07/568116507.db2.gz WUABXXNSKJFHCC-UHFFFAOYSA-N 1 0 357.375 5.306 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)c1cn[nH]c1 ZINC000550901668 568116188 /nfs/dbraw/zinc/11/61/88/568116188.db2.gz KQCGNTAVYWSOTQ-NEPJUHHUSA-N 1 0 365.424 5.569 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000550901669 568116222 /nfs/dbraw/zinc/11/62/22/568116222.db2.gz KQCGNTAVYWSOTQ-NWDGAFQWSA-N 1 0 365.424 5.569 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)c1cn[nH]c1 ZINC000550901670 568116282 /nfs/dbraw/zinc/11/62/82/568116282.db2.gz KQCGNTAVYWSOTQ-RYUDHWBXSA-N 1 0 365.424 5.569 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)c1cn[nH]c1 ZINC000550901671 568116264 /nfs/dbraw/zinc/11/62/64/568116264.db2.gz KQCGNTAVYWSOTQ-VXGBXAGGSA-N 1 0 365.424 5.569 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1cn2ccccc2n1 ZINC000550901710 568116277 /nfs/dbraw/zinc/11/62/77/568116277.db2.gz LSUXJZMUMMNQRP-OALUTQOASA-N 1 0 371.484 5.325 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1cn2ccccc2n1 ZINC000550901711 568116234 /nfs/dbraw/zinc/11/62/34/568116234.db2.gz LSUXJZMUMMNQRP-RBUKOAKNSA-N 1 0 371.484 5.325 20 0 FKADRO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CCCC12CCOCC2 ZINC000550930036 568120410 /nfs/dbraw/zinc/12/04/10/568120410.db2.gz BMQISTSKOSRFQC-DYESRHJHSA-N 1 0 354.538 5.163 20 0 FKADRO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CCCC12CCOCC2 ZINC000550930037 568120416 /nfs/dbraw/zinc/12/04/16/568120416.db2.gz BMQISTSKOSRFQC-LAUBAEHRSA-N 1 0 354.538 5.163 20 0 FKADRO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CCCC12CCOCC2 ZINC000550930038 568120390 /nfs/dbraw/zinc/12/03/90/568120390.db2.gz BMQISTSKOSRFQC-UTKZUKDTSA-N 1 0 354.538 5.163 20 0 FKADRO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CCCC12CCOCC2 ZINC000550930039 568120393 /nfs/dbraw/zinc/12/03/93/568120393.db2.gz BMQISTSKOSRFQC-UWJYYQICSA-N 1 0 354.538 5.163 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H]2CCCc3c(O)cccc32)ccc1OCC(C)C ZINC000550931974 568120532 /nfs/dbraw/zinc/12/05/32/568120532.db2.gz IJOCKQGYQNGFHE-JXFKEZNVSA-N 1 0 369.505 5.164 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H]2CCCc3c(O)cccc32)ccc1OCC(C)C ZINC000550931977 568120551 /nfs/dbraw/zinc/12/05/51/568120551.db2.gz IJOCKQGYQNGFHE-OXJNMPFZSA-N 1 0 369.505 5.164 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H]2CCCc3c(O)cccc32)ccc1OCC(C)C ZINC000550931979 568120518 /nfs/dbraw/zinc/12/05/18/568120518.db2.gz IJOCKQGYQNGFHE-OXQOHEQNSA-N 1 0 369.505 5.164 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H]2CCCc3c(O)cccc32)ccc1OCC(C)C ZINC000550931981 568120505 /nfs/dbraw/zinc/12/05/05/568120505.db2.gz IJOCKQGYQNGFHE-UZLBHIALSA-N 1 0 369.505 5.164 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000550932936 568120652 /nfs/dbraw/zinc/12/06/52/568120652.db2.gz YWNBUEHDFJNPGS-GOSISDBHSA-N 1 0 370.905 5.336 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000550932942 568120668 /nfs/dbraw/zinc/12/06/68/568120668.db2.gz YWNBUEHDFJNPGS-SFHVURJKSA-N 1 0 370.905 5.336 20 0 FKADRO COC1CCC([NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)CC1 ZINC000550945244 568120856 /nfs/dbraw/zinc/12/08/56/568120856.db2.gz NGOYVDHYIDIIJQ-UHFFFAOYSA-N 1 0 374.525 5.184 20 0 FKADRO Cc1sc(C2([NH2+][C@H](C)c3cccs3)CCC2)nc1-c1ccccc1F ZINC000550945393 568120895 /nfs/dbraw/zinc/12/08/95/568120895.db2.gz PGQIROQAHPXLFQ-CYBMUJFWSA-N 1 0 372.534 6.049 20 0 FKADRO Cc1sc(C2([NH2+][C@@H](C)c3cccs3)CCC2)nc1-c1ccccc1F ZINC000550945394 568120925 /nfs/dbraw/zinc/12/09/25/568120925.db2.gz PGQIROQAHPXLFQ-ZDUSSCGKSA-N 1 0 372.534 6.049 20 0 FKADRO Cc1sc(C2([NH2+][C@H](C)[C@@H]3CCCOC3)CCC2)nc1-c1ccccc1F ZINC000550945453 568120921 /nfs/dbraw/zinc/12/09/21/568120921.db2.gz RMIVTQQCVCKDCK-GDBMZVCRSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+][C@@H](C)[C@@H]3CCCOC3)CCC2)nc1-c1ccccc1F ZINC000550945454 568120909 /nfs/dbraw/zinc/12/09/09/568120909.db2.gz RMIVTQQCVCKDCK-GOEBONIOSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+][C@@H](C)[C@H]3CCCOC3)CCC2)nc1-c1ccccc1F ZINC000550945455 568120863 /nfs/dbraw/zinc/12/08/63/568120863.db2.gz RMIVTQQCVCKDCK-HOCLYGCPSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1sc(C2([NH2+][C@H](C)[C@H]3CCCOC3)CCC2)nc1-c1ccccc1F ZINC000550945456 568120923 /nfs/dbraw/zinc/12/09/23/568120923.db2.gz RMIVTQQCVCKDCK-ZBFHGGJFSA-N 1 0 374.525 5.042 20 0 FKADRO Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000550970573 568122763 /nfs/dbraw/zinc/12/27/63/568122763.db2.gz PNHCMEPWCVUZHY-FQEVSTJZSA-N 1 0 372.299 5.015 20 0 FKADRO Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000550970577 568122804 /nfs/dbraw/zinc/12/28/04/568122804.db2.gz PNHCMEPWCVUZHY-HXUWFJFHSA-N 1 0 372.299 5.015 20 0 FKADRO CC(C)([NH2+]Cc1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 ZINC000550978137 568126128 /nfs/dbraw/zinc/12/61/28/568126128.db2.gz OVVJYWXOWPNMPN-UHFFFAOYSA-N 1 0 350.409 5.340 20 0 FKADRO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000550991377 568126362 /nfs/dbraw/zinc/12/63/62/568126362.db2.gz HQZUUVPSIWGUMU-DOTOQJQBSA-N 1 0 353.491 5.129 20 0 FKADRO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000550991378 568126378 /nfs/dbraw/zinc/12/63/78/568126378.db2.gz HQZUUVPSIWGUMU-NVXWUHKLSA-N 1 0 353.491 5.129 20 0 FKADRO C[C@H]([NH2+]Cc1ccccc1Cn1cccn1)c1ccc(F)c2ccccc21 ZINC000550996577 568127049 /nfs/dbraw/zinc/12/70/49/568127049.db2.gz BELMNCNOPQOMFF-KRWDZBQOSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@@H]([NH2+]Cc1ccccc1Cn1cccn1)c1ccc(F)c2ccccc21 ZINC000550996578 568127037 /nfs/dbraw/zinc/12/70/37/568127037.db2.gz BELMNCNOPQOMFF-QGZVFWFLSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(COCC(F)(F)F)cc1)c1cccc(C2CC2)c1 ZINC000550997737 568127102 /nfs/dbraw/zinc/12/71/02/568127102.db2.gz PJOJILLSHYTBIG-HNNXBMFYSA-N 1 0 363.423 5.494 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(COCC(F)(F)F)cc1)c1cccc(C2CC2)c1 ZINC000550997738 568127122 /nfs/dbraw/zinc/12/71/22/568127122.db2.gz PJOJILLSHYTBIG-OAHLLOKOSA-N 1 0 363.423 5.494 20 0 FKADRO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CC2 ZINC000551003188 568127183 /nfs/dbraw/zinc/12/71/83/568127183.db2.gz JITUVAPGBXICID-GOSISDBHSA-N 1 0 358.869 5.380 20 0 FKADRO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CC2 ZINC000551003191 568127188 /nfs/dbraw/zinc/12/71/88/568127188.db2.gz JITUVAPGBXICID-SFHVURJKSA-N 1 0 358.869 5.380 20 0 FKADRO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000551007884 568127443 /nfs/dbraw/zinc/12/74/43/568127443.db2.gz OWWQHASKJXXAAP-INIZCTEOSA-N 1 0 370.512 5.057 20 0 FKADRO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000551007885 568127469 /nfs/dbraw/zinc/12/74/69/568127469.db2.gz OWWQHASKJXXAAP-MRXNPFEDSA-N 1 0 370.512 5.057 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1cccc(C2CC2)c1 ZINC000551008657 568127437 /nfs/dbraw/zinc/12/74/37/568127437.db2.gz YWSFQGIFFPXBEJ-KRWDZBQOSA-N 1 0 362.517 5.544 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1cccc(C2CC2)c1 ZINC000551008663 568127465 /nfs/dbraw/zinc/12/74/65/568127465.db2.gz YWSFQGIFFPXBEJ-QGZVFWFLSA-N 1 0 362.517 5.544 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cccc(C2CC2)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000551009207 568127483 /nfs/dbraw/zinc/12/74/83/568127483.db2.gz RLMWSOWCMNVPNE-CVEARBPZSA-N 1 0 363.505 5.260 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cccc(C2CC2)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000551009208 568127522 /nfs/dbraw/zinc/12/75/22/568127522.db2.gz RLMWSOWCMNVPNE-HOTGVXAUSA-N 1 0 363.505 5.260 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cccc(C2CC2)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000551009209 568127497 /nfs/dbraw/zinc/12/74/97/568127497.db2.gz RLMWSOWCMNVPNE-HZPDHXFCSA-N 1 0 363.505 5.260 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1cccc(C2CC2)c1 ZINC000551009210 568127479 /nfs/dbraw/zinc/12/74/79/568127479.db2.gz RLMWSOWCMNVPNE-JKSUJKDBSA-N 1 0 363.505 5.260 20 0 FKADRO C[C@@H](C[N@H+](C)CCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 ZINC000551012740 568129319 /nfs/dbraw/zinc/12/93/19/568129319.db2.gz VJSGGUZQMMGWDA-FQEVSTJZSA-N 1 0 372.512 5.418 20 0 FKADRO C[C@H](C[N@H+](C)CCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 ZINC000551012742 568129416 /nfs/dbraw/zinc/12/94/16/568129416.db2.gz VJSGGUZQMMGWDA-HXUWFJFHSA-N 1 0 372.512 5.418 20 0 FKADRO CCOc1cccc([C@@H](C)[NH2+][C@H]2CCc3sc(Br)cc32)c1 ZINC000551029628 568133845 /nfs/dbraw/zinc/13/38/45/568133845.db2.gz MHTTZFABJUQZAP-ABAIWWIYSA-N 1 0 366.324 5.247 20 0 FKADRO CCOc1cccc([C@@H](C)[NH2+][C@@H]2CCc3sc(Br)cc32)c1 ZINC000551029629 568133848 /nfs/dbraw/zinc/13/38/48/568133848.db2.gz MHTTZFABJUQZAP-IAQYHMDHSA-N 1 0 366.324 5.247 20 0 FKADRO CCOc1cccc([C@H](C)[NH2+][C@H]2CCc3sc(Br)cc32)c1 ZINC000551029630 568133864 /nfs/dbraw/zinc/13/38/64/568133864.db2.gz MHTTZFABJUQZAP-NHYWBVRUSA-N 1 0 366.324 5.247 20 0 FKADRO CCOc1cccc([C@H](C)[NH2+][C@@H]2CCc3sc(Br)cc32)c1 ZINC000551029631 568133851 /nfs/dbraw/zinc/13/38/51/568133851.db2.gz MHTTZFABJUQZAP-XHDPSFHLSA-N 1 0 366.324 5.247 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(F)c2ccccc21)c1nnc2n1CCCCC2 ZINC000551029935 568133830 /nfs/dbraw/zinc/13/38/30/568133830.db2.gz UDWRAZICCVMXSK-FOIQADDNSA-N 1 0 366.484 5.099 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1nnc2n1CCCCC2 ZINC000551029936 568133832 /nfs/dbraw/zinc/13/38/32/568133832.db2.gz UDWRAZICCVMXSK-MGPUTAFESA-N 1 0 366.484 5.099 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(F)c2ccccc21)c1nnc2n1CCCCC2 ZINC000551029937 568133879 /nfs/dbraw/zinc/13/38/79/568133879.db2.gz UDWRAZICCVMXSK-QRWLVFNGSA-N 1 0 366.484 5.099 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1nnc2n1CCCCC2 ZINC000551029938 568133888 /nfs/dbraw/zinc/13/38/88/568133888.db2.gz UDWRAZICCVMXSK-YWZLYKJASA-N 1 0 366.484 5.099 20 0 FKADRO COc1cccc(Oc2ncccc2C[NH2+][C@H](C)c2cccc(C3CC3)c2)c1 ZINC000551051140 568136740 /nfs/dbraw/zinc/13/67/40/568136740.db2.gz NVGOHSYSRVAVAE-QGZVFWFLSA-N 1 0 374.484 5.611 20 0 FKADRO CC(C)([NH2+]Cc1ccc(OC(F)F)cc1)c1cccc(C(F)(F)F)c1 ZINC000551051279 568136726 /nfs/dbraw/zinc/13/67/26/568136726.db2.gz KGZPCYWCDFKMCU-UHFFFAOYSA-N 1 0 359.338 5.332 20 0 FKADRO CCn1c(C[NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)nc2ccccc21 ZINC000551051298 568136746 /nfs/dbraw/zinc/13/67/46/568136746.db2.gz MDSYVJLFDDEPGV-UHFFFAOYSA-N 1 0 361.411 5.100 20 0 FKADRO Cc1cccnc1[C@@H]([NH2+][C@H]1CCc2sc(Br)cc21)C(C)C ZINC000551052055 568137005 /nfs/dbraw/zinc/13/70/05/568137005.db2.gz YEVIUEMDVFHEFX-BBRMVZONSA-N 1 0 365.340 5.188 20 0 FKADRO Cc1cccnc1[C@@H]([NH2+][C@@H]1CCc2sc(Br)cc21)C(C)C ZINC000551052056 568136986 /nfs/dbraw/zinc/13/69/86/568136986.db2.gz YEVIUEMDVFHEFX-CJNGLKHVSA-N 1 0 365.340 5.188 20 0 FKADRO Cc1cccnc1[C@H]([NH2+][C@@H]1CCc2sc(Br)cc21)C(C)C ZINC000551052057 568136999 /nfs/dbraw/zinc/13/69/99/568136999.db2.gz YEVIUEMDVFHEFX-CZUORRHYSA-N 1 0 365.340 5.188 20 0 FKADRO Cc1cccnc1[C@H]([NH2+][C@H]1CCc2sc(Br)cc21)C(C)C ZINC000551052058 568137055 /nfs/dbraw/zinc/13/70/55/568137055.db2.gz YEVIUEMDVFHEFX-XJKSGUPXSA-N 1 0 365.340 5.188 20 0 FKADRO CC(C)([NH2+]Cc1cccc(OC(F)F)c1)c1cccc(C(F)(F)F)c1 ZINC000551053173 568137366 /nfs/dbraw/zinc/13/73/66/568137366.db2.gz JBFABDIYBANCGT-UHFFFAOYSA-N 1 0 359.338 5.332 20 0 FKADRO c1ccc(COc2ccc(C[NH+]3CCC(OC4CCCC4)CC3)cc2)cc1 ZINC000551061981 568138680 /nfs/dbraw/zinc/13/86/80/568138680.db2.gz GJFLBDMMPUFYHZ-UHFFFAOYSA-N 1 0 365.517 5.189 20 0 FKADRO C[C@@H](N[C@@H](C)c1noc(-c2ccccc2)n1)c1ccc(F)c2ccccc21 ZINC000551063578 568139060 /nfs/dbraw/zinc/13/90/60/568139060.db2.gz VXJAVKBPHGCPAV-CABCVRRESA-N 1 0 361.420 5.441 20 0 FKADRO C[C@H](N[C@@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063579 568139025 /nfs/dbraw/zinc/13/90/25/568139025.db2.gz VXJAVKBPHGCPAV-GJZGRUSLSA-N 1 0 361.420 5.441 20 0 FKADRO C[C@@H](N[C@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063580 568139013 /nfs/dbraw/zinc/13/90/13/568139013.db2.gz VXJAVKBPHGCPAV-HUUCEWRRSA-N 1 0 361.420 5.441 20 0 FKADRO C[C@@H](N[C@@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063581 568139099 /nfs/dbraw/zinc/13/90/99/568139099.db2.gz VXJAVKBPHGCPAV-LSDHHAIUSA-N 1 0 361.420 5.441 20 0 FKADRO O=C(CC[N@H+](CC1CC1)C1CCCCC1)Nc1c(Cl)cccc1Cl ZINC000551065772 568139450 /nfs/dbraw/zinc/13/94/50/568139450.db2.gz XZNOJYUWFVLFDI-UHFFFAOYSA-N 1 0 369.336 5.367 20 0 FKADRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1ccccc1 ZINC000551066947 568139445 /nfs/dbraw/zinc/13/94/45/568139445.db2.gz XDVADMIPPRTQOF-JENIJYKNSA-N 1 0 351.465 5.184 20 0 FKADRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1ccccc1 ZINC000551066949 568139489 /nfs/dbraw/zinc/13/94/89/568139489.db2.gz XDVADMIPPRTQOF-LNLFQRSKSA-N 1 0 351.465 5.184 20 0 FKADRO C[C@@H]([NH2+]C[C@H](C[C@H](C)O)c1ccccc1)c1ccc(F)c2ccccc21 ZINC000551066950 568139491 /nfs/dbraw/zinc/13/94/91/568139491.db2.gz XDVADMIPPRTQOF-SCTDSRPQSA-N 1 0 351.465 5.184 20 0 FKADRO C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)c1ccc(F)c2ccccc21 ZINC000551066951 568139517 /nfs/dbraw/zinc/13/95/17/568139517.db2.gz XDVADMIPPRTQOF-YQVWRLOYSA-N 1 0 351.465 5.184 20 0 FKADRO C[C@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccc(F)c2ccccc21 ZINC000551085778 568141454 /nfs/dbraw/zinc/14/14/54/568141454.db2.gz HPAYCTQHHWXXJE-INIZCTEOSA-N 1 0 359.448 5.230 20 0 FKADRO C[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccc(F)c2ccccc21 ZINC000551085779 568141525 /nfs/dbraw/zinc/14/15/25/568141525.db2.gz HPAYCTQHHWXXJE-MRXNPFEDSA-N 1 0 359.448 5.230 20 0 FKADRO C[C@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1cccc(C2CC2)c1 ZINC000551086586 568142722 /nfs/dbraw/zinc/14/27/22/568142722.db2.gz VTBHZBLPBTYETI-AWEZNQCLSA-N 1 0 355.432 5.202 20 0 FKADRO C[C@@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1cccc(C2CC2)c1 ZINC000551086593 568147700 /nfs/dbraw/zinc/14/77/00/568147700.db2.gz VTBHZBLPBTYETI-CQSZACIVSA-N 1 0 355.432 5.202 20 0 FKADRO FC1(F)CC[C@@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)C1 ZINC000551093635 568161524 /nfs/dbraw/zinc/16/15/24/568161524.db2.gz SWZHAKXYAPJKNQ-GFCCVEGCSA-N 1 0 354.828 5.096 20 0 FKADRO FC1(F)CC[C@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)C1 ZINC000551093639 568161448 /nfs/dbraw/zinc/16/14/48/568161448.db2.gz SWZHAKXYAPJKNQ-LBPRGKRZSA-N 1 0 354.828 5.096 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@H](C)c1cccc(C2CC2)c1 ZINC000551166481 568150462 /nfs/dbraw/zinc/15/04/62/568150462.db2.gz NERKPIHQOJORBO-CHWSQXEVSA-N 1 0 365.443 5.351 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@H](C)c1cccc(C2CC2)c1 ZINC000551166482 568150488 /nfs/dbraw/zinc/15/04/88/568150488.db2.gz NERKPIHQOJORBO-OLZOCXBDSA-N 1 0 365.443 5.351 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@@H](C)c1cccc(C2CC2)c1 ZINC000551166483 568150493 /nfs/dbraw/zinc/15/04/93/568150493.db2.gz NERKPIHQOJORBO-QWHCGFSZSA-N 1 0 365.443 5.351 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@@H](C)c1cccc(C2CC2)c1 ZINC000551166484 568150423 /nfs/dbraw/zinc/15/04/23/568150423.db2.gz NERKPIHQOJORBO-STQMWFEESA-N 1 0 365.443 5.351 20 0 FKADRO Fc1cc(Cl)ccc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000551175932 568150248 /nfs/dbraw/zinc/15/02/48/568150248.db2.gz QKCPSIOPNHOOJG-GFCCVEGCSA-N 1 0 360.679 5.080 20 0 FKADRO Fc1cc(Cl)ccc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000551175933 568150162 /nfs/dbraw/zinc/15/01/62/568150162.db2.gz QKCPSIOPNHOOJG-LBPRGKRZSA-N 1 0 360.679 5.080 20 0 FKADRO C[C@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(C2CC2)c1 ZINC000551177099 568160185 /nfs/dbraw/zinc/16/01/85/568160185.db2.gz RBDSIDDMOFKQOO-JAGHRAMZSA-N 1 0 366.471 5.020 20 0 FKADRO C[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(C2CC2)c1 ZINC000551177106 568160158 /nfs/dbraw/zinc/16/01/58/568160158.db2.gz RBDSIDDMOFKQOO-WPUWVODUSA-N 1 0 366.471 5.020 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551184710 568157606 /nfs/dbraw/zinc/15/76/06/568157606.db2.gz FFOBBHPTZPJLGX-UHFFFAOYSA-N 1 0 358.894 5.152 20 0 FKADRO Cc1nc(C2(NCc3ccc(-c4ccc(Cl)cc4)cc3)CCCC2)no1 ZINC000551185061 568157728 /nfs/dbraw/zinc/15/77/28/568157728.db2.gz MYRDUWCIPDWFCR-UHFFFAOYSA-N 1 0 367.880 5.258 20 0 FKADRO CCc1nc([C@@H](C)NCc2cnc(-c3ccc(Cl)cc3)s2)cs1 ZINC000551185295 568157717 /nfs/dbraw/zinc/15/77/17/568157717.db2.gz QVYDSEJFUPUOIY-LLVKDONJSA-N 1 0 363.939 5.333 20 0 FKADRO CCc1nc([C@H](C)NCc2cnc(-c3ccc(Cl)cc3)s2)cs1 ZINC000551185296 568157760 /nfs/dbraw/zinc/15/77/60/568157760.db2.gz QVYDSEJFUPUOIY-NSHDSACASA-N 1 0 363.939 5.333 20 0 FKADRO CC(C)C[C@@H]([NH2+]Cc1cnn(C(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000551188196 568157799 /nfs/dbraw/zinc/15/77/99/568157799.db2.gz CFCNNDSPXHJUEK-GOSISDBHSA-N 1 0 353.432 5.360 20 0 FKADRO CC(C)C[C@H]([NH2+]Cc1cnn(C(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000551188205 568157866 /nfs/dbraw/zinc/15/78/66/568157866.db2.gz CFCNNDSPXHJUEK-SFHVURJKSA-N 1 0 353.432 5.360 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CSc4ccccc43)s2)cc1 ZINC000551188229 568158073 /nfs/dbraw/zinc/15/80/73/568158073.db2.gz CSXYHQFSFZKIBG-INIZCTEOSA-N 1 0 358.919 5.400 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CSc4ccccc43)s2)cc1 ZINC000551188230 568158646 /nfs/dbraw/zinc/15/86/46/568158646.db2.gz CSXYHQFSFZKIBG-MRXNPFEDSA-N 1 0 358.919 5.400 20 0 FKADRO CC[C@@](C)(NCc1cnc(-c2ccc(Cl)cc2)s1)c1nccs1 ZINC000551188322 568159828 /nfs/dbraw/zinc/15/98/28/568159828.db2.gz HVCNVZLAXSRWAT-QGZVFWFLSA-N 1 0 363.939 5.335 20 0 FKADRO Fc1ccc(C2([NH2+]Cc3cnc(-c4ccc(Cl)cc4)s3)CC2)cc1 ZINC000551188369 568159941 /nfs/dbraw/zinc/15/99/41/568159941.db2.gz JSVACHOLOGMDHA-UHFFFAOYSA-N 1 0 358.869 5.382 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)c1ccncc1F ZINC000551199078 568164923 /nfs/dbraw/zinc/16/49/23/568164923.db2.gz VUCACRVZLMZMKJ-BJOOFOGMSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)c1ccncc1F ZINC000551199079 568164933 /nfs/dbraw/zinc/16/49/33/568164933.db2.gz VUCACRVZLMZMKJ-IWEFOYFVSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)c1ccncc1F ZINC000551199080 568164900 /nfs/dbraw/zinc/16/49/00/568164900.db2.gz VUCACRVZLMZMKJ-ULFGMLNVSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)c1ccncc1F ZINC000551199081 568164896 /nfs/dbraw/zinc/16/48/96/568164896.db2.gz VUCACRVZLMZMKJ-XZOAIXRZSA-N 1 0 352.375 5.226 20 0 FKADRO CCOCc1ccccc1C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551199833 568165465 /nfs/dbraw/zinc/16/54/65/568165465.db2.gz HSEWOUDADLAMGB-UHFFFAOYSA-N 1 0 372.921 5.290 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3coc4ccccc34)cs2)cs1 ZINC000551205258 568168057 /nfs/dbraw/zinc/16/80/57/568168057.db2.gz IMAXOAKTFLVJIB-GFCCVEGCSA-N 1 0 354.500 5.777 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]Cc3coc4ccccc34)cs2)cs1 ZINC000551205259 568168000 /nfs/dbraw/zinc/16/80/00/568168000.db2.gz IMAXOAKTFLVJIB-LBPRGKRZSA-N 1 0 354.500 5.777 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1coc2ccccc12 ZINC000551208846 568170208 /nfs/dbraw/zinc/17/02/08/568170208.db2.gz XOIJPMFINITDHD-INIZCTEOSA-N 1 0 350.462 5.063 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1coc2ccccc12 ZINC000551208847 568170190 /nfs/dbraw/zinc/17/01/90/568170190.db2.gz XOIJPMFINITDHD-MRXNPFEDSA-N 1 0 350.462 5.063 20 0 FKADRO COc1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1OCc1ccccc1 ZINC000551212098 568174797 /nfs/dbraw/zinc/17/47/97/568174797.db2.gz RTRJVROWIWHVRP-KRWDZBQOSA-N 1 0 367.514 5.057 20 0 FKADRO Cc1ccc(NC(=O)C[C@@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c(Cl)c1 ZINC000551212257 568174872 /nfs/dbraw/zinc/17/48/72/568174872.db2.gz XKIUSKNJWMSXFZ-QGPMSJSTSA-N 1 0 374.887 5.040 20 0 FKADRO Cc1ccc(NC(=O)C[C@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c(Cl)c1 ZINC000551212258 568174880 /nfs/dbraw/zinc/17/48/80/568174880.db2.gz XKIUSKNJWMSXFZ-ZVZYQTTQSA-N 1 0 374.887 5.040 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3ccc4ncccc4c3)s2)cc1 ZINC000551219377 568178433 /nfs/dbraw/zinc/17/84/33/568178433.db2.gz KTMRRVRMPHFAKI-UHFFFAOYSA-N 1 0 365.889 5.302 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]CC3=Cc4ccccc4OC3)s2)cc1 ZINC000551219669 568178409 /nfs/dbraw/zinc/17/84/09/568178409.db2.gz SPWRFGCGUDEFCK-UHFFFAOYSA-N 1 0 368.889 5.029 20 0 FKADRO CCCc1ccc([C@H]([NH2+]Cc2cnn(C(C)C)c2)c2cccs2)cc1 ZINC000551220527 568178442 /nfs/dbraw/zinc/17/84/42/568178442.db2.gz OVIJAYZVUOLOQX-NRFANRHFSA-N 1 0 353.535 5.357 20 0 FKADRO CCCc1ccc([C@@H]([NH2+]Cc2cnn(C(C)C)c2)c2cccs2)cc1 ZINC000551220528 568178400 /nfs/dbraw/zinc/17/84/00/568178400.db2.gz OVIJAYZVUOLOQX-OAQYLSRUSA-N 1 0 353.535 5.357 20 0 FKADRO COc1ccccc1[C@@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551221875 568178709 /nfs/dbraw/zinc/17/87/09/568178709.db2.gz ATWYFPHQFYDFLP-CYBMUJFWSA-N 1 0 358.894 5.323 20 0 FKADRO COc1ccccc1[C@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551221876 568178795 /nfs/dbraw/zinc/17/87/95/568178795.db2.gz ATWYFPHQFYDFLP-ZDUSSCGKSA-N 1 0 358.894 5.323 20 0 FKADRO CC(C)c1ccc([C@H]([NH2+]Cc2cnn(C(C)C)c2)c2cccs2)cc1 ZINC000551222057 568178814 /nfs/dbraw/zinc/17/88/14/568178814.db2.gz FIJVHCYNVVHTFT-NRFANRHFSA-N 1 0 353.535 5.528 20 0 FKADRO CC(C)c1ccc([C@@H]([NH2+]Cc2cnn(C(C)C)c2)c2cccs2)cc1 ZINC000551222062 568178856 /nfs/dbraw/zinc/17/88/56/568178856.db2.gz FIJVHCYNVVHTFT-OAQYLSRUSA-N 1 0 353.535 5.528 20 0 FKADRO Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000551222813 568178912 /nfs/dbraw/zinc/17/89/12/568178912.db2.gz MNPGSDRXAXNWIO-IDHHARJASA-N 1 0 374.887 5.040 20 0 FKADRO Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000551222814 568178947 /nfs/dbraw/zinc/17/89/47/568178947.db2.gz MNPGSDRXAXNWIO-QOKNQOGYSA-N 1 0 374.887 5.040 20 0 FKADRO CCOc1cccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000551225886 568179034 /nfs/dbraw/zinc/17/90/34/568179034.db2.gz UWDITMYSEQCJPR-UHFFFAOYSA-N 1 0 358.894 5.152 20 0 FKADRO Fc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 ZINC000551226158 568179045 /nfs/dbraw/zinc/17/90/45/568179045.db2.gz GTPNPINXFPFKJW-IBGZPJMESA-N 1 0 367.386 5.102 20 0 FKADRO Fc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 ZINC000551226159 568179043 /nfs/dbraw/zinc/17/90/43/568179043.db2.gz GTPNPINXFPFKJW-LJQANCHMSA-N 1 0 367.386 5.102 20 0 FKADRO Cc1ccsc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000551226858 568179104 /nfs/dbraw/zinc/17/91/04/568179104.db2.gz AXRCWBQDDSGHMK-GOSISDBHSA-N 1 0 369.452 5.333 20 0 FKADRO Cc1ccsc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000551226859 568179144 /nfs/dbraw/zinc/17/91/44/568179144.db2.gz AXRCWBQDDSGHMK-SFHVURJKSA-N 1 0 369.452 5.333 20 0 FKADRO Clc1csc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000551226952 568179170 /nfs/dbraw/zinc/17/91/70/568179170.db2.gz FISUKTZGQKICPH-UHFFFAOYSA-N 1 0 355.315 5.468 20 0 FKADRO Fc1ccccc1COc1cccc(C[NH2+][C@H]2CCCc3occc32)c1 ZINC000551228512 568179281 /nfs/dbraw/zinc/17/92/81/568179281.db2.gz GLLWYOJWSRYNGD-NRFANRHFSA-N 1 0 351.421 5.165 20 0 FKADRO Fc1ccccc1COc1cccc(C[NH2+][C@@H]2CCCc3occc32)c1 ZINC000551228513 568179298 /nfs/dbraw/zinc/17/92/98/568179298.db2.gz GLLWYOJWSRYNGD-OAQYLSRUSA-N 1 0 351.421 5.165 20 0 FKADRO c1cc(-c2ncc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)s2)cs1 ZINC000551228650 568179305 /nfs/dbraw/zinc/17/93/05/568179305.db2.gz ZCIOGUDGEBMGPQ-UHFFFAOYSA-N 1 0 370.543 5.483 20 0 FKADRO CCOc1cc(C[NH2+]Cc2sccc2C)ccc1OCc1ccccc1 ZINC000551228758 568179296 /nfs/dbraw/zinc/17/92/96/568179296.db2.gz BBIWHSYJCXAPQW-UHFFFAOYSA-N 1 0 367.514 5.324 20 0 FKADRO COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)s2)c2ccc(C)cc2)cc1 ZINC000551228906 568179339 /nfs/dbraw/zinc/17/93/39/568179339.db2.gz FZHATNLPWVHIPK-FQEVSTJZSA-N 1 0 357.906 5.598 20 0 FKADRO COc1ccc([C@H]([NH2+]Cc2ccc(Cl)s2)c2ccc(C)cc2)cc1 ZINC000551228910 568179358 /nfs/dbraw/zinc/17/93/58/568179358.db2.gz FZHATNLPWVHIPK-HXUWFJFHSA-N 1 0 357.906 5.598 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)cc1 ZINC000551229172 568179476 /nfs/dbraw/zinc/17/94/76/568179476.db2.gz IXAKSIZKUPIACY-QHCPKHFHSA-N 1 0 365.448 5.112 20 0 FKADRO FC(F)(F)c1cccc(C2(C[NH2+]C3CCCCCC3)CCOCC2)c1 ZINC000551229193 568179409 /nfs/dbraw/zinc/17/94/09/568179409.db2.gz JLJNGACXMFZIGG-UHFFFAOYSA-N 1 0 355.444 5.066 20 0 FKADRO CCc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)o1 ZINC000551230354 568179473 /nfs/dbraw/zinc/17/94/73/568179473.db2.gz XXRSEGBXBAJHJQ-IBGZPJMESA-N 1 0 367.411 5.118 20 0 FKADRO CCc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)o1 ZINC000551230355 568179431 /nfs/dbraw/zinc/17/94/31/568179431.db2.gz XXRSEGBXBAJHJQ-LJQANCHMSA-N 1 0 367.411 5.118 20 0 FKADRO C[N@@H+]1Cc2ccc(NCc3cnc(-c4ccc(Cl)cc4)s3)cc2C1 ZINC000551230724 568179501 /nfs/dbraw/zinc/17/95/01/568179501.db2.gz CEYUBDDPOPWJRN-UHFFFAOYSA-N 1 0 355.894 5.021 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2ccc(Cl)c3cccnc23)cc1Cl ZINC000551231012 568179499 /nfs/dbraw/zinc/17/94/99/568179499.db2.gz HSEVYLOEANTLEF-UHFFFAOYSA-N 1 0 361.272 5.230 20 0 FKADRO C[NH+](C)CCc1ccc(NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551231312 568179603 /nfs/dbraw/zinc/17/96/03/568179603.db2.gz MMKDGNTVAKQGRX-UHFFFAOYSA-N 1 0 371.937 5.180 20 0 FKADRO CCCNc1ccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551231418 568179606 /nfs/dbraw/zinc/17/96/06/568179606.db2.gz OFAPTUYTKBVPER-UHFFFAOYSA-N 1 0 371.937 5.575 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cccc(-c3ccncc3)c2)cc1Cl ZINC000551235922 568179826 /nfs/dbraw/zinc/17/98/26/568179826.db2.gz AEYXLFHZDQYNHB-UHFFFAOYSA-N 1 0 352.865 5.091 20 0 FKADRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551236201 568179795 /nfs/dbraw/zinc/17/97/95/568179795.db2.gz KTENHMBJMQAGPT-DLBZAZTESA-N 1 0 364.942 5.147 20 0 FKADRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551236202 568179781 /nfs/dbraw/zinc/17/97/81/568179781.db2.gz KTENHMBJMQAGPT-IAGOWNOFSA-N 1 0 364.942 5.147 20 0 FKADRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551236203 568179833 /nfs/dbraw/zinc/17/98/33/568179833.db2.gz KTENHMBJMQAGPT-IRXDYDNUSA-N 1 0 364.942 5.147 20 0 FKADRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551236204 568179794 /nfs/dbraw/zinc/17/97/94/568179794.db2.gz KTENHMBJMQAGPT-SJORKVTESA-N 1 0 364.942 5.147 20 0 FKADRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551236563 568179774 /nfs/dbraw/zinc/17/97/74/568179774.db2.gz RAJLRPMPHQTNGT-GOSISDBHSA-N 1 0 370.905 5.385 20 0 FKADRO C[C@H]1CC(CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C)O1 ZINC000551236949 568179816 /nfs/dbraw/zinc/17/98/16/568179816.db2.gz DGMNPRQOXXBXNZ-KBPBESRZSA-N 1 0 364.942 5.147 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C)O1 ZINC000551236950 568179815 /nfs/dbraw/zinc/17/98/15/568179815.db2.gz DGMNPRQOXXBXNZ-QDMKHBRRSA-N 1 0 364.942 5.147 20 0 FKADRO C[C@@H]1CC(CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C[C@@H](C)O1 ZINC000551236951 568179768 /nfs/dbraw/zinc/17/97/68/568179768.db2.gz DGMNPRQOXXBXNZ-ZIAGYGMSSA-N 1 0 364.942 5.147 20 0 FKADRO Cc1csc([C@H](C)C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)n1 ZINC000551238187 568179966 /nfs/dbraw/zinc/17/99/66/568179966.db2.gz VQTSFCITOXHAJA-LLVKDONJSA-N 1 0 363.939 5.122 20 0 FKADRO Cc1csc([C@@H](C)C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)n1 ZINC000551238192 568179956 /nfs/dbraw/zinc/17/99/56/568179956.db2.gz VQTSFCITOXHAJA-NSHDSACASA-N 1 0 363.939 5.122 20 0 FKADRO Cc1cc([C@@H](NCc2ccc(C(C)(F)F)cc2)c2cccnc2)ccc1F ZINC000551238669 568179977 /nfs/dbraw/zinc/17/99/77/568179977.db2.gz ALRCZABROLQVKF-OAQYLSRUSA-N 1 0 370.418 5.520 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(-c2ccncc2)cc1 ZINC000551238748 568179938 /nfs/dbraw/zinc/17/99/38/568179938.db2.gz DJRFEXZGUKTERP-INIZCTEOSA-N 1 0 352.428 5.711 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(-c2ccncc2)cc1 ZINC000551238749 568179963 /nfs/dbraw/zinc/17/99/63/568179963.db2.gz DJRFEXZGUKTERP-MRXNPFEDSA-N 1 0 352.428 5.711 20 0 FKADRO COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551238916 568180003 /nfs/dbraw/zinc/18/00/03/568180003.db2.gz GOTAVTNOMRCDRP-JOCHJYFZSA-N 1 0 374.509 5.379 20 0 FKADRO COc1ccc([C@H](Cc2ccncc2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551238917 568180052 /nfs/dbraw/zinc/18/00/52/568180052.db2.gz GOTAVTNOMRCDRP-QFIPXVFZSA-N 1 0 374.509 5.379 20 0 FKADRO C[C@@H]([NH2+]Cc1cc2ccccc2s1)c1nc2ccc(Cl)cc2n1C ZINC000551238930 568180049 /nfs/dbraw/zinc/18/00/49/568180049.db2.gz HOVWEDDLMSKCKO-GFCCVEGCSA-N 1 0 355.894 5.292 20 0 FKADRO C[C@H]([NH2+]Cc1cc2ccccc2s1)c1nc2ccc(Cl)cc2n1C ZINC000551238931 568180046 /nfs/dbraw/zinc/18/00/46/568180046.db2.gz HOVWEDDLMSKCKO-LBPRGKRZSA-N 1 0 355.894 5.292 20 0 FKADRO Fc1ccc(-c2ccc(C[NH2+][C@H]3CCCOc4ccccc43)s2)cc1 ZINC000551239387 568180037 /nfs/dbraw/zinc/18/00/37/568180037.db2.gz RVTHTXKAMJGWTF-IBGZPJMESA-N 1 0 353.462 5.558 20 0 FKADRO Fc1ccc(-c2ccc(C[NH2+][C@@H]3CCCOc4ccccc43)s2)cc1 ZINC000551239388 568179983 /nfs/dbraw/zinc/17/99/83/568179983.db2.gz RVTHTXKAMJGWTF-LJQANCHMSA-N 1 0 353.462 5.558 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000551239550 568179985 /nfs/dbraw/zinc/17/99/85/568179985.db2.gz WDFAYFKYPWVENY-KGYLQXTDSA-N 1 0 374.859 5.140 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000551239566 568180044 /nfs/dbraw/zinc/18/00/44/568180044.db2.gz WDFAYFKYPWVENY-WCFLWFBJSA-N 1 0 374.859 5.140 20 0 FKADRO C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1nccc2ccccc21 ZINC000551239658 568180090 /nfs/dbraw/zinc/18/00/90/568180090.db2.gz YQIQGZBOWCCDNW-BEFAXECRSA-N 1 0 358.407 5.622 20 0 FKADRO C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1nccc2ccccc21 ZINC000551239659 568180111 /nfs/dbraw/zinc/18/01/11/568180111.db2.gz YQIQGZBOWCCDNW-DNVCBOLYSA-N 1 0 358.407 5.622 20 0 FKADRO C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1nccc2ccccc21 ZINC000551239660 568180124 /nfs/dbraw/zinc/18/01/24/568180124.db2.gz YQIQGZBOWCCDNW-HNAYVOBHSA-N 1 0 358.407 5.622 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1nccc2ccccc21 ZINC000551239661 568180057 /nfs/dbraw/zinc/18/00/57/568180057.db2.gz YQIQGZBOWCCDNW-KXBFYZLASA-N 1 0 358.407 5.622 20 0 FKADRO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000551239671 568180066 /nfs/dbraw/zinc/18/00/66/568180066.db2.gz ZJJZNECXSNSALK-KGLIPLIRSA-N 1 0 373.859 5.085 20 0 FKADRO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000551239672 568180059 /nfs/dbraw/zinc/18/00/59/568180059.db2.gz ZJJZNECXSNSALK-ZIAGYGMSSA-N 1 0 373.859 5.085 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(N2CCOCC2)c1)c1cccc(-c2ccccc2)c1 ZINC000551239699 568180181 /nfs/dbraw/zinc/18/01/81/568180181.db2.gz ZWNRFWFVNAMLOF-FQEVSTJZSA-N 1 0 372.512 5.041 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(N2CCOCC2)c1)c1cccc(-c2ccccc2)c1 ZINC000551239700 568180166 /nfs/dbraw/zinc/18/01/66/568180166.db2.gz ZWNRFWFVNAMLOF-HXUWFJFHSA-N 1 0 372.512 5.041 20 0 FKADRO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCc1cccc(C(F)(F)F)n1 ZINC000551239914 568180147 /nfs/dbraw/zinc/18/01/47/568180147.db2.gz AIETXPNYDDTLSD-LLVKDONJSA-N 1 0 371.472 5.056 20 0 FKADRO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCc1cccc(C(F)(F)F)n1 ZINC000551239915 568180189 /nfs/dbraw/zinc/18/01/89/568180189.db2.gz AIETXPNYDDTLSD-NSHDSACASA-N 1 0 371.472 5.056 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1nc2ccc(Cl)cc2n1C ZINC000551239930 568180168 /nfs/dbraw/zinc/18/01/68/568180168.db2.gz AWKAWDZFPLJLAV-GFCCVEGCSA-N 1 0 363.839 5.189 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1nc2ccc(Cl)cc2n1C ZINC000551239931 568180183 /nfs/dbraw/zinc/18/01/83/568180183.db2.gz AWKAWDZFPLJLAV-LBPRGKRZSA-N 1 0 363.839 5.189 20 0 FKADRO CC(C)C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccccn1 ZINC000551239942 568180165 /nfs/dbraw/zinc/18/01/65/568180165.db2.gz BFPFNJILULQSHH-HKUYNNGSSA-N 1 0 350.428 5.495 20 0 FKADRO CC(C)C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccccn1 ZINC000551239943 568180178 /nfs/dbraw/zinc/18/01/78/568180178.db2.gz BFPFNJILULQSHH-IEBWSBKVSA-N 1 0 350.428 5.495 20 0 FKADRO CC(C)C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccccn1 ZINC000551239944 568180146 /nfs/dbraw/zinc/18/01/46/568180146.db2.gz BFPFNJILULQSHH-MJGOQNOKSA-N 1 0 350.428 5.495 20 0 FKADRO CC(C)C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccccn1 ZINC000551239945 568180248 /nfs/dbraw/zinc/18/02/48/568180248.db2.gz BFPFNJILULQSHH-PKOBYXMFSA-N 1 0 350.428 5.495 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cccc(-c2ccncc2)c1 ZINC000551239978 568180214 /nfs/dbraw/zinc/18/02/14/568180214.db2.gz CBNLSASELUNMER-INIZCTEOSA-N 1 0 352.428 5.711 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cccc(-c2ccncc2)c1 ZINC000551239979 568180263 /nfs/dbraw/zinc/18/02/63/568180263.db2.gz CBNLSASELUNMER-MRXNPFEDSA-N 1 0 352.428 5.711 20 0 FKADRO COc1ccc(OC)c([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000551240150 568180329 /nfs/dbraw/zinc/18/03/29/568180329.db2.gz DSCYVWPKTDYIQR-KBXCAEBGSA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc(OC)c([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000551240151 568180286 /nfs/dbraw/zinc/18/02/86/568180286.db2.gz DSCYVWPKTDYIQR-KDOFPFPSSA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc(OC)c([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000551240152 568180284 /nfs/dbraw/zinc/18/02/84/568180284.db2.gz DSCYVWPKTDYIQR-KSSFIOAISA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc(OC)c([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000551240153 568180321 /nfs/dbraw/zinc/18/03/21/568180321.db2.gz DSCYVWPKTDYIQR-RDTXWAMCSA-N 1 0 367.411 5.091 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1cnc2ccsc2c1 ZINC000551240222 568180323 /nfs/dbraw/zinc/18/03/23/568180323.db2.gz GHBUFHKWGCTHER-BBRMVZONSA-N 1 0 364.436 5.683 20 0 FKADRO C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1cnc2ccsc2c1 ZINC000551240223 568180276 /nfs/dbraw/zinc/18/02/76/568180276.db2.gz GHBUFHKWGCTHER-CJNGLKHVSA-N 1 0 364.436 5.683 20 0 FKADRO C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1cnc2ccsc2c1 ZINC000551240224 568180333 /nfs/dbraw/zinc/18/03/33/568180333.db2.gz GHBUFHKWGCTHER-CZUORRHYSA-N 1 0 364.436 5.683 20 0 FKADRO C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1cnc2ccsc2c1 ZINC000551240225 568180332 /nfs/dbraw/zinc/18/03/32/568180332.db2.gz GHBUFHKWGCTHER-XJKSGUPXSA-N 1 0 364.436 5.683 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240253 568180365 /nfs/dbraw/zinc/18/03/65/568180365.db2.gz HATFSFSKNCJPPG-HNNXBMFYSA-N 1 0 367.518 5.282 20 0 FKADRO CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240254 568180391 /nfs/dbraw/zinc/18/03/91/568180391.db2.gz HATFSFSKNCJPPG-OAHLLOKOSA-N 1 0 367.518 5.282 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(C(C)(F)F)cc1 ZINC000551240337 568180407 /nfs/dbraw/zinc/18/04/07/568180407.db2.gz JUQDMHGTVROQNV-INIZCTEOSA-N 1 0 374.475 5.429 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(C(C)(F)F)cc1 ZINC000551240338 568180477 /nfs/dbraw/zinc/18/04/77/568180477.db2.gz JUQDMHGTVROQNV-MRXNPFEDSA-N 1 0 374.475 5.429 20 0 FKADRO Fc1ccc([C@@H](C[C@H]2CCOC2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240341 568180470 /nfs/dbraw/zinc/18/04/70/568180470.db2.gz KBSKKPYRZZLFTQ-FOIQADDNSA-N 1 0 355.478 5.298 20 0 FKADRO Fc1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240342 568180423 /nfs/dbraw/zinc/18/04/23/568180423.db2.gz KBSKKPYRZZLFTQ-MGPUTAFESA-N 1 0 355.478 5.298 20 0 FKADRO Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240343 568180609 /nfs/dbraw/zinc/18/06/09/568180609.db2.gz KBSKKPYRZZLFTQ-QRWLVFNGSA-N 1 0 355.478 5.298 20 0 FKADRO Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000551240344 568180573 /nfs/dbraw/zinc/18/05/73/568180573.db2.gz KBSKKPYRZZLFTQ-YWZLYKJASA-N 1 0 355.478 5.298 20 0 FKADRO C[C@@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccc2ccccc2n1 ZINC000551240523 568180637 /nfs/dbraw/zinc/18/06/37/568180637.db2.gz MPKVGNDCTGMWMW-CRAIPNDOSA-N 1 0 358.407 5.622 20 0 FKADRO C[C@H]([NH2+]CC[C@H](c1ccccc1)C(F)(F)F)c1ccc2ccccc2n1 ZINC000551240524 568180671 /nfs/dbraw/zinc/18/06/71/568180671.db2.gz MPKVGNDCTGMWMW-MAUKXSAKSA-N 1 0 358.407 5.622 20 0 FKADRO C[C@@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccc2ccccc2n1 ZINC000551240525 568180674 /nfs/dbraw/zinc/18/06/74/568180674.db2.gz MPKVGNDCTGMWMW-QAPCUYQASA-N 1 0 358.407 5.622 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1ccc2ccccc2n1 ZINC000551240526 568180692 /nfs/dbraw/zinc/18/06/92/568180692.db2.gz MPKVGNDCTGMWMW-YJBOKZPZSA-N 1 0 358.407 5.622 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cc[nH]c(=O)c1)c1ccc(Br)cc1Cl ZINC000551240880 568181180 /nfs/dbraw/zinc/18/11/80/568181180.db2.gz FQLZCECXQLCWAO-BMIGLBTASA-N 1 0 369.690 5.005 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1cc[nH]c(=O)c1)c1ccc(Br)cc1Cl ZINC000551240885 568181310 /nfs/dbraw/zinc/18/13/10/568181310.db2.gz FQLZCECXQLCWAO-MEBBXXQBSA-N 1 0 369.690 5.005 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(Br)cc1Cl ZINC000551240887 568181323 /nfs/dbraw/zinc/18/13/23/568181323.db2.gz FQLZCECXQLCWAO-ZUZCIYMTSA-N 1 0 369.690 5.005 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccc(-n2cccn2)c(F)c1 ZINC000551241134 568181453 /nfs/dbraw/zinc/18/14/53/568181453.db2.gz HLGFPOJCEWJJLI-ACJLOTCBSA-N 1 0 371.456 5.038 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1OCC ZINC000551241137 568181406 /nfs/dbraw/zinc/18/14/06/568181406.db2.gz RAGRCYICLWMKGA-HNNXBMFYSA-N 1 0 363.448 5.447 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1ccc(-n2cccn2)c(F)c1 ZINC000551241138 568181460 /nfs/dbraw/zinc/18/14/60/568181460.db2.gz HLGFPOJCEWJJLI-FZKQIMNGSA-N 1 0 371.456 5.038 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1OCC ZINC000551241143 568181463 /nfs/dbraw/zinc/18/14/63/568181463.db2.gz RAGRCYICLWMKGA-OAHLLOKOSA-N 1 0 363.448 5.447 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000551241415 568181560 /nfs/dbraw/zinc/18/15/60/568181560.db2.gz KZKKGEPLZUIFMQ-KGLIPLIRSA-N 1 0 372.513 5.312 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000551241417 568181616 /nfs/dbraw/zinc/18/16/16/568181616.db2.gz KZKKGEPLZUIFMQ-ZIAGYGMSSA-N 1 0 372.513 5.312 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000551241650 568181655 /nfs/dbraw/zinc/18/16/55/568181655.db2.gz ULGCYVHVWJTEJA-CTNGQTDRSA-N 1 0 370.418 5.497 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000551241652 568181649 /nfs/dbraw/zinc/18/16/49/568181649.db2.gz ULGCYVHVWJTEJA-FPOVZHCZSA-N 1 0 370.418 5.497 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000551241653 568181684 /nfs/dbraw/zinc/18/16/84/568181684.db2.gz ULGCYVHVWJTEJA-PZJWPPBQSA-N 1 0 370.418 5.497 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000551241655 568181749 /nfs/dbraw/zinc/18/17/49/568181749.db2.gz ULGCYVHVWJTEJA-TZIWHRDSSA-N 1 0 370.418 5.497 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cc2ccccc2s1)c1ccc2[nH]c(=O)oc2c1 ZINC000551242217 568181847 /nfs/dbraw/zinc/18/18/47/568181847.db2.gz YKBDHRHOFGRTNJ-IBGZPJMESA-N 1 0 352.459 5.235 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cc2ccccc2s1)c1ccc2[nH]c(=O)oc2c1 ZINC000551242220 568181867 /nfs/dbraw/zinc/18/18/67/568181867.db2.gz YKBDHRHOFGRTNJ-LJQANCHMSA-N 1 0 352.459 5.235 20 0 FKADRO COCC1(CC[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCC1 ZINC000551242805 568182029 /nfs/dbraw/zinc/18/20/29/568182029.db2.gz WZSGXWALUDCNPY-KRWDZBQOSA-N 1 0 374.525 5.123 20 0 FKADRO COCC1(CC[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCC1 ZINC000551242808 568182052 /nfs/dbraw/zinc/18/20/52/568182052.db2.gz WZSGXWALUDCNPY-QGZVFWFLSA-N 1 0 374.525 5.123 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc(SCC(F)(F)F)cc1 ZINC000551243454 568182201 /nfs/dbraw/zinc/18/22/01/568182201.db2.gz HYAGDADSYQQBRR-LLVKDONJSA-N 1 0 358.429 5.051 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1 ZINC000551243455 568182164 /nfs/dbraw/zinc/18/21/64/568182164.db2.gz HYAGDADSYQQBRR-NSHDSACASA-N 1 0 358.429 5.051 20 0 FKADRO Cc1cnc([C@H](C)C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551245341 568187182 /nfs/dbraw/zinc/18/71/82/568187182.db2.gz UUPCWUFUNGEUEM-LLVKDONJSA-N 1 0 363.939 5.122 20 0 FKADRO Cc1cnc([C@@H](C)C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551245342 568187205 /nfs/dbraw/zinc/18/72/05/568187205.db2.gz UUPCWUFUNGEUEM-NSHDSACASA-N 1 0 363.939 5.122 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+]CCCCOc2ccc(Cl)cc2)s1 ZINC000551257588 568187964 /nfs/dbraw/zinc/18/79/64/568187964.db2.gz YCWTYIVELVPBIP-UHFFFAOYSA-N 1 0 352.931 5.043 20 0 FKADRO C[C@H]([NH2+]CCc1cc2ccccc2s1)c1nc(C(F)(F)F)cs1 ZINC000551262789 568188201 /nfs/dbraw/zinc/18/82/01/568188201.db2.gz HMYRROYAFCTBCY-JTQLQIEISA-N 1 0 356.438 5.270 20 0 FKADRO C[C@@H]([NH2+]CCc1cc2ccccc2s1)c1nc(C(F)(F)F)cs1 ZINC000551262790 568188203 /nfs/dbraw/zinc/18/82/03/568188203.db2.gz HMYRROYAFCTBCY-SNVBAGLBSA-N 1 0 356.438 5.270 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000551264385 568184330 /nfs/dbraw/zinc/18/43/30/568184330.db2.gz YVXWKYGWQHFSBC-DDTOSNHZSA-N 1 0 374.859 5.140 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000551264386 568184347 /nfs/dbraw/zinc/18/43/47/568184347.db2.gz YVXWKYGWQHFSBC-LEWSCRJBSA-N 1 0 374.859 5.140 20 0 FKADRO Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(COCc3ccccc3)cc1)CCC2 ZINC000551266797 568188831 /nfs/dbraw/zinc/18/88/31/568188831.db2.gz FFJDHCQPCKQZOK-RUZDIDTESA-N 1 0 373.496 5.276 20 0 FKADRO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(COCc3ccccc3)cc1)CCC2 ZINC000551266799 568188880 /nfs/dbraw/zinc/18/88/80/568188880.db2.gz FFJDHCQPCKQZOK-VWLOTQADSA-N 1 0 373.496 5.276 20 0 FKADRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000551267315 568188987 /nfs/dbraw/zinc/18/89/87/568188987.db2.gz BHUAWOZYAJJIPA-CABCVRRESA-N 1 0 353.510 5.050 20 0 FKADRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000551267317 568188947 /nfs/dbraw/zinc/18/89/47/568188947.db2.gz BHUAWOZYAJJIPA-GJZGRUSLSA-N 1 0 353.510 5.050 20 0 FKADRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000551267318 568189009 /nfs/dbraw/zinc/18/90/09/568189009.db2.gz BHUAWOZYAJJIPA-HUUCEWRRSA-N 1 0 353.510 5.050 20 0 FKADRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000551267320 568188956 /nfs/dbraw/zinc/18/89/56/568188956.db2.gz BHUAWOZYAJJIPA-LSDHHAIUSA-N 1 0 353.510 5.050 20 0 FKADRO Fc1ccc2nc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)sc2c1 ZINC000551269462 568189390 /nfs/dbraw/zinc/18/93/90/568189390.db2.gz RGBJUGNELQDXSJ-UHFFFAOYSA-N 1 0 356.466 5.047 20 0 FKADRO CSc1ccc([C@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1F ZINC000551271495 568190168 /nfs/dbraw/zinc/19/01/68/568190168.db2.gz BBGPBNUNGBSWTH-JTQLQIEISA-N 1 0 359.388 5.139 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1F ZINC000551271514 568190162 /nfs/dbraw/zinc/19/01/62/568190162.db2.gz BBGPBNUNGBSWTH-SNVBAGLBSA-N 1 0 359.388 5.139 20 0 FKADRO COCC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000551271769 568190173 /nfs/dbraw/zinc/19/01/73/568190173.db2.gz QMGCDNIWAMWCBB-KRWDZBQOSA-N 1 0 372.267 5.009 20 0 FKADRO COCC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000551271774 568190206 /nfs/dbraw/zinc/19/02/06/568190206.db2.gz QMGCDNIWAMWCBB-QGZVFWFLSA-N 1 0 372.267 5.009 20 0 FKADRO CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000551271872 568190179 /nfs/dbraw/zinc/19/01/79/568190179.db2.gz FKVIOSZFWXWDRS-AGHHOFFYSA-N 1 0 365.521 5.015 20 0 FKADRO CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000551271873 568190214 /nfs/dbraw/zinc/19/02/14/568190214.db2.gz FKVIOSZFWXWDRS-XJABCFGWSA-N 1 0 365.521 5.015 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1cccc(Br)c1 ZINC000551272893 568190223 /nfs/dbraw/zinc/19/02/23/568190223.db2.gz QIGQAFWVGJOMHP-JTQLQIEISA-N 1 0 374.200 5.040 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1cccc(Br)c1 ZINC000551272894 568190255 /nfs/dbraw/zinc/19/02/55/568190255.db2.gz QIGQAFWVGJOMHP-SNVBAGLBSA-N 1 0 374.200 5.040 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(F)cc1Cl ZINC000551273880 568190560 /nfs/dbraw/zinc/19/05/60/568190560.db2.gz DXCIEZXYKVVVLY-QWHCGFSZSA-N 1 0 361.823 5.216 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000551273881 568190552 /nfs/dbraw/zinc/19/05/52/568190552.db2.gz DXCIEZXYKVVVLY-STQMWFEESA-N 1 0 361.823 5.216 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)s1 ZINC000551274444 568190555 /nfs/dbraw/zinc/19/05/55/568190555.db2.gz QVTMNIUODMOKJC-SWLSCSKDSA-N 1 0 363.889 5.528 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)s1 ZINC000551274445 568190609 /nfs/dbraw/zinc/19/06/09/568190609.db2.gz QVTMNIUODMOKJC-WFASDCNBSA-N 1 0 363.889 5.528 20 0 FKADRO C[N@H+](Cc1ccccc1)C1CCC(Nc2ccc([C@@H]3CCOC3)cc2)CC1 ZINC000551275454 568193164 /nfs/dbraw/zinc/19/31/64/568193164.db2.gz SLLAVWPVYJTICF-DNFKCEGXSA-N 1 0 364.533 5.046 20 0 FKADRO C[N@H+](Cc1ccccc1)C1CCC(Nc2ccc([C@H]3CCOC3)cc2)CC1 ZINC000551275455 568193186 /nfs/dbraw/zinc/19/31/86/568193186.db2.gz SLLAVWPVYJTICF-KHRZNOOSSA-N 1 0 364.533 5.046 20 0 FKADRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000551279022 568195899 /nfs/dbraw/zinc/19/58/99/568195899.db2.gz BJTWWSAAPYHOLD-CABCVRRESA-N 1 0 355.551 5.382 20 0 FKADRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000551279023 568195905 /nfs/dbraw/zinc/19/59/05/568195905.db2.gz BJTWWSAAPYHOLD-GJZGRUSLSA-N 1 0 355.551 5.382 20 0 FKADRO Cc1cnc([C@H](C)C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000551279024 568195929 /nfs/dbraw/zinc/19/59/29/568195929.db2.gz BJTWWSAAPYHOLD-HUUCEWRRSA-N 1 0 355.551 5.382 20 0 FKADRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000551279025 568195936 /nfs/dbraw/zinc/19/59/36/568195936.db2.gz BJTWWSAAPYHOLD-LSDHHAIUSA-N 1 0 355.551 5.382 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cn2ccccc2n1)c1cccc(OCc2ccccc2)c1 ZINC000551279973 568196163 /nfs/dbraw/zinc/19/61/63/568196163.db2.gz LSUXJZMUMMNQRP-MOPGFXCFSA-N 1 0 371.484 5.325 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cccc(OCc2ccccc2)c1)c1cn2ccccc2n1 ZINC000551279975 568196131 /nfs/dbraw/zinc/19/61/31/568196131.db2.gz LSUXJZMUMMNQRP-RTBURBONSA-N 1 0 371.484 5.325 20 0 FKADRO Cc1csc([C@H](C)C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)n1 ZINC000551283121 568196387 /nfs/dbraw/zinc/19/63/87/568196387.db2.gz ICJJQQMRLIGXSE-CABCVRRESA-N 1 0 355.551 5.382 20 0 FKADRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)n1 ZINC000551283123 568196393 /nfs/dbraw/zinc/19/63/93/568196393.db2.gz ICJJQQMRLIGXSE-GJZGRUSLSA-N 1 0 355.551 5.382 20 0 FKADRO Cc1csc([C@H](C)C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)n1 ZINC000551283124 568196394 /nfs/dbraw/zinc/19/63/94/568196394.db2.gz ICJJQQMRLIGXSE-HUUCEWRRSA-N 1 0 355.551 5.382 20 0 FKADRO Cc1csc([C@@H](C)C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)n1 ZINC000551283125 568196360 /nfs/dbraw/zinc/19/63/60/568196360.db2.gz ICJJQQMRLIGXSE-LSDHHAIUSA-N 1 0 355.551 5.382 20 0 FKADRO C[C@H]([NH2+]Cc1ccccc1COc1ccccc1Cl)c1ccncc1F ZINC000551284248 568200162 /nfs/dbraw/zinc/20/01/62/568200162.db2.gz LSZSRRHSYYYUBF-HNNXBMFYSA-N 1 0 370.855 5.304 20 0 FKADRO C[C@@H]([NH2+]Cc1ccccc1COc1ccccc1Cl)c1ccncc1F ZINC000551284249 568200097 /nfs/dbraw/zinc/20/00/97/568200097.db2.gz LSZSRRHSYYYUBF-OAHLLOKOSA-N 1 0 370.855 5.304 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)ccn1 ZINC000551287813 568197915 /nfs/dbraw/zinc/19/79/15/568197915.db2.gz ZKSGXKMZYLWNIN-DLBZAZTESA-N 1 0 362.473 5.178 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)ccn1 ZINC000551287814 568197932 /nfs/dbraw/zinc/19/79/32/568197932.db2.gz ZKSGXKMZYLWNIN-IAGOWNOFSA-N 1 0 362.473 5.178 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)ccn1 ZINC000551287815 568197947 /nfs/dbraw/zinc/19/79/47/568197947.db2.gz ZKSGXKMZYLWNIN-IRXDYDNUSA-N 1 0 362.473 5.178 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)ccn1 ZINC000551287816 568197901 /nfs/dbraw/zinc/19/79/01/568197901.db2.gz ZKSGXKMZYLWNIN-SJORKVTESA-N 1 0 362.473 5.178 20 0 FKADRO CO[C@H](C)c1cccc(NC2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000551296979 568203181 /nfs/dbraw/zinc/20/31/81/568203181.db2.gz PDTACGIMXOQJAZ-FBHNJWQJSA-N 1 0 352.522 5.249 20 0 FKADRO CO[C@@H](C)c1cccc(NC2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000551296980 568203152 /nfs/dbraw/zinc/20/31/52/568203152.db2.gz PDTACGIMXOQJAZ-RHKCVOJBSA-N 1 0 352.522 5.249 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCCc2c(O)cccc21)c1ccc(OCC2CC2)c(F)c1 ZINC000551302647 568203431 /nfs/dbraw/zinc/20/34/31/568203431.db2.gz WFLFUXAFFURYEF-JLTOFOAXSA-N 1 0 355.453 5.048 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCCc2c(O)cccc21)c1ccc(OCC2CC2)c(F)c1 ZINC000551302652 568203462 /nfs/dbraw/zinc/20/34/62/568203462.db2.gz WFLFUXAFFURYEF-VBKZILBWSA-N 1 0 355.453 5.048 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCCc2c(O)cccc21)c1ccc(OCC2CC2)c(F)c1 ZINC000551302654 568203464 /nfs/dbraw/zinc/20/34/64/568203464.db2.gz WFLFUXAFFURYEF-VLIAUNLRSA-N 1 0 355.453 5.048 20 0 FKADRO C[C@H]([NH2+][C@H]1CCCc2c(O)cccc21)c1ccc(OCC2CC2)c(F)c1 ZINC000551302655 568203452 /nfs/dbraw/zinc/20/34/52/568203452.db2.gz WFLFUXAFFURYEF-XOBRGWDASA-N 1 0 355.453 5.048 20 0 FKADRO Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000551308908 568203732 /nfs/dbraw/zinc/20/37/32/568203732.db2.gz XWIBCVYRYDYSAP-CYBMUJFWSA-N 1 0 355.894 5.362 20 0 FKADRO Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000551308913 568203788 /nfs/dbraw/zinc/20/37/88/568203788.db2.gz XWIBCVYRYDYSAP-ZDUSSCGKSA-N 1 0 355.894 5.362 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000551309251 568203815 /nfs/dbraw/zinc/20/38/15/568203815.db2.gz LZRVVFAJCQVEDT-BPUTZDHNSA-N 1 0 368.908 5.167 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000551309252 568203849 /nfs/dbraw/zinc/20/38/49/568203849.db2.gz LZRVVFAJCQVEDT-FVQBIDKESA-N 1 0 368.908 5.167 20 0 FKADRO CN1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)C[C@@H]1c1ccccc1 ZINC000551310366 568203973 /nfs/dbraw/zinc/20/39/73/568203973.db2.gz CHFYJFMPDZBDMJ-JPAWQOSXSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)C[C@H]1c1ccccc1 ZINC000551310367 568203897 /nfs/dbraw/zinc/20/38/97/568203897.db2.gz CHFYJFMPDZBDMJ-OZIGNCPNSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)C[C@H]1c1ccccc1 ZINC000551310368 568203958 /nfs/dbraw/zinc/20/39/58/568203958.db2.gz CHFYJFMPDZBDMJ-YXTQBTIXSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)C[C@@H]1c1ccccc1 ZINC000551310369 568203908 /nfs/dbraw/zinc/20/39/08/568203908.db2.gz CHFYJFMPDZBDMJ-ZVVDCOBXSA-N 1 0 354.925 5.011 20 0 FKADRO CC[C@@H]([NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1)[C@@H]1CCOC1 ZINC000551319839 568210336 /nfs/dbraw/zinc/21/03/36/568210336.db2.gz YCHVBVUMQPVEMG-CRAIPNDOSA-N 1 0 374.525 5.042 20 0 FKADRO CC[C@@H]([NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1)[C@H]1CCOC1 ZINC000551319840 568210407 /nfs/dbraw/zinc/21/04/07/568210407.db2.gz YCHVBVUMQPVEMG-MAUKXSAKSA-N 1 0 374.525 5.042 20 0 FKADRO CC[C@H]([NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1)[C@@H]1CCOC1 ZINC000551319841 568210349 /nfs/dbraw/zinc/21/03/49/568210349.db2.gz YCHVBVUMQPVEMG-QAPCUYQASA-N 1 0 374.525 5.042 20 0 FKADRO CC[C@H]([NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1)[C@H]1CCOC1 ZINC000551319842 568210380 /nfs/dbraw/zinc/21/03/80/568210380.db2.gz YCHVBVUMQPVEMG-YJBOKZPZSA-N 1 0 374.525 5.042 20 0 FKADRO Cc1ccc(CN(Cc2ccco2)Cc2ccc(C(F)(F)F)cn2)s1 ZINC000551382388 568224858 /nfs/dbraw/zinc/22/48/58/568224858.db2.gz XGVWRMKBQWOJLL-UHFFFAOYSA-N 1 0 366.408 5.266 20 0 FKADRO CC(C)([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)c(Cl)c1 ZINC000551385065 568225234 /nfs/dbraw/zinc/22/52/34/568225234.db2.gz FIVIXCFEAGYCDO-UHFFFAOYSA-N 1 0 363.210 5.432 20 0 FKADRO Cc1ccc2c(c1)[nH]cc2C1=CC[N@H+](Cc2ccc(C(F)(F)F)cn2)CC1 ZINC000551386750 568221772 /nfs/dbraw/zinc/22/17/72/568221772.db2.gz BRYAWQJLHNJTNC-UHFFFAOYSA-N 1 0 371.406 5.179 20 0 FKADRO CC(C)COc1ccc(C(C)(C)[NH2+]Cc2ccc(C(F)(F)F)cn2)cc1 ZINC000551391305 568222221 /nfs/dbraw/zinc/22/22/21/568222221.db2.gz CAMMUAZGQNZIPZ-UHFFFAOYSA-N 1 0 366.427 5.160 20 0 FKADRO COCCC[N@@H+]1Cc2cccc(N[C@H](C)c3ccc4ccccc4c3)c2C1 ZINC000551394240 568223082 /nfs/dbraw/zinc/22/30/82/568223082.db2.gz AGQRPHWQZFPHRF-GOSISDBHSA-N 1 0 360.501 5.365 20 0 FKADRO COCCC[N@@H+]1Cc2cccc(N[C@@H](C)c3ccc4ccccc4c3)c2C1 ZINC000551394241 568223043 /nfs/dbraw/zinc/22/30/43/568223043.db2.gz AGQRPHWQZFPHRF-SFHVURJKSA-N 1 0 360.501 5.365 20 0 FKADRO FC(F)Oc1cccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000551394278 568223064 /nfs/dbraw/zinc/22/30/64/568223064.db2.gz BQZDFHJBPKJHDW-UHFFFAOYSA-N 1 0 357.322 5.086 20 0 FKADRO FC(F)(F)c1cccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000551394317 568223047 /nfs/dbraw/zinc/22/30/47/568223047.db2.gz DCCFOVCPIPTZHH-UHFFFAOYSA-N 1 0 359.313 5.503 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3cnc(-c4ccccc4)s3)CC2)c1 ZINC000551394334 568223101 /nfs/dbraw/zinc/22/31/01/568223101.db2.gz FEIZTNXMQLLLBG-UHFFFAOYSA-N 1 0 374.431 5.608 20 0 FKADRO C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000551394658 568223157 /nfs/dbraw/zinc/22/31/57/568223157.db2.gz LEYHRZDFWRFJTR-LQAWEQHXSA-N 1 0 354.803 5.241 20 0 FKADRO C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000551394659 568223174 /nfs/dbraw/zinc/22/31/74/568223174.db2.gz LEYHRZDFWRFJTR-NVGVWMPQSA-N 1 0 354.803 5.241 20 0 FKADRO C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000551394660 568223155 /nfs/dbraw/zinc/22/31/55/568223155.db2.gz LEYHRZDFWRFJTR-SSKCKEOISA-N 1 0 354.803 5.241 20 0 FKADRO C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000551394661 568223186 /nfs/dbraw/zinc/22/31/86/568223186.db2.gz LEYHRZDFWRFJTR-ZTFRIQLXSA-N 1 0 354.803 5.241 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3cccc(Br)c3)CC2)c1 ZINC000551394986 568223320 /nfs/dbraw/zinc/22/33/20/568223320.db2.gz MPIZDYSUFYEMJD-UHFFFAOYSA-N 1 0 370.212 5.247 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000551395963 568228266 /nfs/dbraw/zinc/22/82/66/568228266.db2.gz YVPZZYNRFKTKKQ-UHFFFAOYSA-N 1 0 359.313 5.503 20 0 FKADRO Brc1cncc([C@@H]([NH2+]Cc2cccc3ccccc32)C2CC2)c1 ZINC000551414373 568226361 /nfs/dbraw/zinc/22/63/61/568226361.db2.gz WFEGAVYNQOJPPF-FQEVSTJZSA-N 1 0 367.290 5.238 20 0 FKADRO Brc1cncc([C@H]([NH2+]Cc2cccc3ccccc32)C2CC2)c1 ZINC000551414374 568226352 /nfs/dbraw/zinc/22/63/52/568226352.db2.gz WFEGAVYNQOJPPF-HXUWFJFHSA-N 1 0 367.290 5.238 20 0 FKADRO CC(C)(NCc1coc(-c2c(F)cccc2F)n1)c1ccc(Cl)cc1 ZINC000551422325 568226598 /nfs/dbraw/zinc/22/65/98/568226598.db2.gz AOCOWXYTLXJZJA-UHFFFAOYSA-N 1 0 362.807 5.298 20 0 FKADRO Clc1ccc([C@@H]2CCCCC[C@H]2[NH2+]Cc2nnc(-c3ccco3)o2)cc1 ZINC000551424279 568226432 /nfs/dbraw/zinc/22/64/32/568226432.db2.gz WTIIBSTZOVTEBH-DLBZAZTESA-N 1 0 371.868 5.189 20 0 FKADRO Clc1ccc([C@H]2CCCCC[C@H]2[NH2+]Cc2nnc(-c3ccco3)o2)cc1 ZINC000551424280 568226430 /nfs/dbraw/zinc/22/64/30/568226430.db2.gz WTIIBSTZOVTEBH-IAGOWNOFSA-N 1 0 371.868 5.189 20 0 FKADRO Clc1ccc([C@@H]2CCCCC[C@@H]2[NH2+]Cc2nnc(-c3ccco3)o2)cc1 ZINC000551424281 568226410 /nfs/dbraw/zinc/22/64/10/568226410.db2.gz WTIIBSTZOVTEBH-IRXDYDNUSA-N 1 0 371.868 5.189 20 0 FKADRO CCn1c2ccc(F)cc2nc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000551463304 568230543 /nfs/dbraw/zinc/23/05/43/568230543.db2.gz GLFVEUBEBSXVIT-UHFFFAOYSA-N 1 0 357.860 5.018 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000551512936 568233688 /nfs/dbraw/zinc/23/36/88/568233688.db2.gz IKZWHYSDZVUWQW-DGRZLQMBSA-N 1 0 372.512 5.270 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000551512937 568233682 /nfs/dbraw/zinc/23/36/82/568233682.db2.gz IKZWHYSDZVUWQW-FQESCDNSSA-N 1 0 372.512 5.270 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000551512938 568233679 /nfs/dbraw/zinc/23/36/79/568233679.db2.gz IKZWHYSDZVUWQW-HSEVWJGZSA-N 1 0 372.512 5.270 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000551512939 568233706 /nfs/dbraw/zinc/23/37/06/568233706.db2.gz IKZWHYSDZVUWQW-RXFVGMGFSA-N 1 0 372.512 5.270 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)cc1Cl ZINC000551516001 568233783 /nfs/dbraw/zinc/23/37/83/568233783.db2.gz KMXCMKUPSPNFOD-QWRGUYRKSA-N 1 0 358.791 5.174 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)cc1Cl ZINC000551516007 568233770 /nfs/dbraw/zinc/23/37/70/568233770.db2.gz KMXCMKUPSPNFOD-WDEREUQCSA-N 1 0 358.791 5.174 20 0 FKADRO COCCc1nc(C)c([C@@H](C)[NH2+]CCCCc2ccc(Cl)s2)s1 ZINC000551520316 568233852 /nfs/dbraw/zinc/23/38/52/568233852.db2.gz RDDKRTKXBAHXOK-GFCCVEGCSA-N 1 0 372.987 5.029 20 0 FKADRO COCCc1nc(C)c([C@H](C)[NH2+]CCCCc2ccc(Cl)s2)s1 ZINC000551520322 568233894 /nfs/dbraw/zinc/23/38/94/568233894.db2.gz RDDKRTKXBAHXOK-LBPRGKRZSA-N 1 0 372.987 5.029 20 0 FKADRO CC[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1ccccc1Br ZINC000551522276 568234073 /nfs/dbraw/zinc/23/40/73/568234073.db2.gz BGENQSXUKLHMHH-GOSISDBHSA-N 1 0 355.279 5.238 20 0 FKADRO CC[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccccc1Br ZINC000551522277 568234061 /nfs/dbraw/zinc/23/40/61/568234061.db2.gz BGENQSXUKLHMHH-SFHVURJKSA-N 1 0 355.279 5.238 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cc1 ZINC000551522609 568231043 /nfs/dbraw/zinc/23/10/43/568231043.db2.gz PLPQMCNJGZSATO-DLBZAZTESA-N 1 0 357.542 5.537 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cc1 ZINC000551522610 568231061 /nfs/dbraw/zinc/23/10/61/568231061.db2.gz PLPQMCNJGZSATO-IAGOWNOFSA-N 1 0 357.542 5.537 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cc1 ZINC000551522611 568231040 /nfs/dbraw/zinc/23/10/40/568231040.db2.gz PLPQMCNJGZSATO-IRXDYDNUSA-N 1 0 357.542 5.537 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cc1 ZINC000551522612 568231096 /nfs/dbraw/zinc/23/10/96/568231096.db2.gz PLPQMCNJGZSATO-SJORKVTESA-N 1 0 357.542 5.537 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cc1Cl ZINC000551530230 568231320 /nfs/dbraw/zinc/23/13/20/568231320.db2.gz PIXZAWVMKCPGME-INIZCTEOSA-N 1 0 369.896 5.164 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cc1Cl ZINC000551530231 568231324 /nfs/dbraw/zinc/23/13/24/568231324.db2.gz PIXZAWVMKCPGME-MRXNPFEDSA-N 1 0 369.896 5.164 20 0 FKADRO FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000551530251 568231306 /nfs/dbraw/zinc/23/13/06/568231306.db2.gz PLCWCCMKDLAUOU-BZSNNMDCSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000551530255 568231327 /nfs/dbraw/zinc/23/13/27/568231327.db2.gz PLCWCCMKDLAUOU-FGTMMUONSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000551530257 568231323 /nfs/dbraw/zinc/23/13/23/568231323.db2.gz PLCWCCMKDLAUOU-OKZBNKHCSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000551530258 568231341 /nfs/dbraw/zinc/23/13/41/568231341.db2.gz PLCWCCMKDLAUOU-SQNIBIBYSA-N 1 0 353.428 5.033 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1cnc(C(C)(C)C)nc1 ZINC000551530856 568231383 /nfs/dbraw/zinc/23/13/83/568231383.db2.gz YUMGCJQGXOJUMH-IBGZPJMESA-N 1 0 365.546 5.218 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000551530954 568231364 /nfs/dbraw/zinc/23/13/64/568231364.db2.gz ZMWIYKYYKMKWCD-CABCVRRESA-N 1 0 367.880 5.217 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000551530955 568231395 /nfs/dbraw/zinc/23/13/95/568231395.db2.gz ZMWIYKYYKMKWCD-GJZGRUSLSA-N 1 0 367.880 5.217 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000551530956 568231393 /nfs/dbraw/zinc/23/13/93/568231393.db2.gz ZMWIYKYYKMKWCD-HUUCEWRRSA-N 1 0 367.880 5.217 20 0 FKADRO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1cnc(C(C)(C)C)nc1 ZINC000551530957 568231397 /nfs/dbraw/zinc/23/13/97/568231397.db2.gz YUMGCJQGXOJUMH-LJQANCHMSA-N 1 0 365.546 5.218 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000551530958 568231400 /nfs/dbraw/zinc/23/14/00/568231400.db2.gz ZMWIYKYYKMKWCD-LSDHHAIUSA-N 1 0 367.880 5.217 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)cc1Cl ZINC000551532723 568231531 /nfs/dbraw/zinc/23/15/31/568231531.db2.gz FEQPRWZBJGJGRZ-KBXCAEBGSA-N 1 0 372.921 5.440 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)cc1Cl ZINC000551532724 568231501 /nfs/dbraw/zinc/23/15/01/568231501.db2.gz FEQPRWZBJGJGRZ-KDOFPFPSSA-N 1 0 372.921 5.440 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)cc1Cl ZINC000551532725 568231537 /nfs/dbraw/zinc/23/15/37/568231537.db2.gz FEQPRWZBJGJGRZ-KSSFIOAISA-N 1 0 372.921 5.440 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)cc1Cl ZINC000551532726 568231526 /nfs/dbraw/zinc/23/15/26/568231526.db2.gz FEQPRWZBJGJGRZ-RDTXWAMCSA-N 1 0 372.921 5.440 20 0 FKADRO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551533349 568231596 /nfs/dbraw/zinc/23/15/96/568231596.db2.gz MCCPIBMMRDOXOJ-CHWSQXEVSA-N 1 0 350.915 5.267 20 0 FKADRO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551533351 568231577 /nfs/dbraw/zinc/23/15/77/568231577.db2.gz MCCPIBMMRDOXOJ-OLZOCXBDSA-N 1 0 350.915 5.267 20 0 FKADRO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551533353 568231634 /nfs/dbraw/zinc/23/16/34/568231634.db2.gz MCCPIBMMRDOXOJ-QWHCGFSZSA-N 1 0 350.915 5.267 20 0 FKADRO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551533354 568231583 /nfs/dbraw/zinc/23/15/83/568231583.db2.gz MCCPIBMMRDOXOJ-STQMWFEESA-N 1 0 350.915 5.267 20 0 FKADRO COc1cc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)ccc1C ZINC000551533614 568231614 /nfs/dbraw/zinc/23/16/14/568231614.db2.gz CGGBHQKIUYCDOF-UHFFFAOYSA-N 1 0 358.894 5.070 20 0 FKADRO CC(C)Oc1ccc([C@H](C)NC2CC[NH+](C(C)(C)C)CC2)cc1Cl ZINC000551533708 568231625 /nfs/dbraw/zinc/23/16/25/568231625.db2.gz NFUMNWKFADHMGK-HNNXBMFYSA-N 1 0 352.950 5.041 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)NC2CC[NH+](C(C)(C)C)CC2)cc1Cl ZINC000551533709 568231590 /nfs/dbraw/zinc/23/15/90/568231590.db2.gz NFUMNWKFADHMGK-OAHLLOKOSA-N 1 0 352.950 5.041 20 0 FKADRO CC(C)n1cc(C[NH2+][C@@H](c2ccccc2)c2ccc3ccccc3c2)cn1 ZINC000551534486 568231675 /nfs/dbraw/zinc/23/16/75/568231675.db2.gz MXVHVESXOIBVNZ-DEOSSOPVSA-N 1 0 355.485 5.496 20 0 FKADRO CC(C)n1cc(C[NH2+][C@H](c2ccccc2)c2ccc3ccccc3c2)cn1 ZINC000551534489 568231683 /nfs/dbraw/zinc/23/16/83/568231683.db2.gz MXVHVESXOIBVNZ-XMMPIXPASA-N 1 0 355.485 5.496 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)noc1C ZINC000551535306 568231753 /nfs/dbraw/zinc/23/17/53/568231753.db2.gz VEOCWTKKXSLXIC-PXAZEXFGSA-N 1 0 350.890 5.534 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)noc1C ZINC000551535307 568231729 /nfs/dbraw/zinc/23/17/29/568231729.db2.gz VEOCWTKKXSLXIC-SJCJKPOMSA-N 1 0 350.890 5.534 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)noc1C ZINC000551535308 568231783 /nfs/dbraw/zinc/23/17/83/568231783.db2.gz VEOCWTKKXSLXIC-SJKOYZFVSA-N 1 0 350.890 5.534 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)noc1C ZINC000551535309 568231769 /nfs/dbraw/zinc/23/17/69/568231769.db2.gz VEOCWTKKXSLXIC-YVEFUNNKSA-N 1 0 350.890 5.534 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc3ccccc3n2)cc1Cl ZINC000551535351 568231821 /nfs/dbraw/zinc/23/18/21/568231821.db2.gz WCZYOEKJKITRSY-HNNXBMFYSA-N 1 0 354.881 5.526 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc3ccccc3n2)cc1Cl ZINC000551535352 568231823 /nfs/dbraw/zinc/23/18/23/568231823.db2.gz WCZYOEKJKITRSY-OAHLLOKOSA-N 1 0 354.881 5.526 20 0 FKADRO Clc1ccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551535396 568231760 /nfs/dbraw/zinc/23/17/60/568231760.db2.gz YCDNTJNHPLKYAL-UHFFFAOYSA-N 1 0 355.315 5.468 20 0 FKADRO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CCO2 ZINC000551535914 568231795 /nfs/dbraw/zinc/23/17/95/568231795.db2.gz BVMCBHQNYZMCDW-KRWDZBQOSA-N 1 0 374.868 5.216 20 0 FKADRO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CCO2 ZINC000551535915 568231767 /nfs/dbraw/zinc/23/17/67/568231767.db2.gz BVMCBHQNYZMCDW-QGZVFWFLSA-N 1 0 374.868 5.216 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCO[C@H]3c3ccccc3)s2)cc1 ZINC000551536151 568231812 /nfs/dbraw/zinc/23/18/12/568231812.db2.gz JZUXJKWEAKKIQW-MOPGFXCFSA-N 1 0 370.905 5.083 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCO[C@H]3c3ccccc3)s2)cc1 ZINC000551536152 568231775 /nfs/dbraw/zinc/23/17/75/568231775.db2.gz JZUXJKWEAKKIQW-OALUTQOASA-N 1 0 370.905 5.083 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCO[C@@H]3c3ccccc3)s2)cc1 ZINC000551536153 568231777 /nfs/dbraw/zinc/23/17/77/568231777.db2.gz JZUXJKWEAKKIQW-RBUKOAKNSA-N 1 0 370.905 5.083 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCO[C@@H]3c3ccccc3)s2)cc1 ZINC000551536154 568231815 /nfs/dbraw/zinc/23/18/15/568231815.db2.gz JZUXJKWEAKKIQW-RTBURBONSA-N 1 0 370.905 5.083 20 0 FKADRO CC[C@H](C)c1ccc([C@H]([NH2+]Cc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000551538083 568231801 /nfs/dbraw/zinc/23/18/01/568231801.db2.gz FXMVUFWCGJEKCM-HTAPYJJXSA-N 1 0 373.562 5.091 20 0 FKADRO CC[C@H](C)c1ccc([C@@H]([NH2+]Cc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000551538084 568231793 /nfs/dbraw/zinc/23/17/93/568231793.db2.gz FXMVUFWCGJEKCM-JTSKRJEESA-N 1 0 373.562 5.091 20 0 FKADRO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000551538085 568231888 /nfs/dbraw/zinc/23/18/88/568231888.db2.gz FXMVUFWCGJEKCM-VGOFRKELSA-N 1 0 373.562 5.091 20 0 FKADRO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000551538086 568231849 /nfs/dbraw/zinc/23/18/49/568231849.db2.gz FXMVUFWCGJEKCM-VGSWGCGISA-N 1 0 373.562 5.091 20 0 FKADRO CC(C)n1cc(C[NH2+][C@@H](c2ccccc2)c2cccc3ccccc32)cn1 ZINC000551538215 568231847 /nfs/dbraw/zinc/23/18/47/568231847.db2.gz SARKKCPTMVPJER-DEOSSOPVSA-N 1 0 355.485 5.496 20 0 FKADRO CC(C)n1cc(C[NH2+][C@H](c2ccccc2)c2cccc3ccccc32)cn1 ZINC000551538217 568231878 /nfs/dbraw/zinc/23/18/78/568231878.db2.gz SARKKCPTMVPJER-XMMPIXPASA-N 1 0 355.485 5.496 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCCOc4ccccc43)s2)cc1 ZINC000551538302 568231890 /nfs/dbraw/zinc/23/18/90/568231890.db2.gz UWHQBCZOWARNPE-GOSISDBHSA-N 1 0 370.905 5.467 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCCOc4ccccc43)s2)cc1 ZINC000551538303 568231826 /nfs/dbraw/zinc/23/18/26/568231826.db2.gz UWHQBCZOWARNPE-SFHVURJKSA-N 1 0 370.905 5.467 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000551542371 568231869 /nfs/dbraw/zinc/23/18/69/568231869.db2.gz FKJVKHXNCXIUNB-SFHVURJKSA-N 1 0 374.937 5.228 20 0 FKADRO CC(C)(C)c1ncc(CN[C@@H](c2cc3ccccc3o2)c2ccccc2)cn1 ZINC000551546989 568231858 /nfs/dbraw/zinc/23/18/58/568231858.db2.gz FDONNQZUNMILNX-JOCHJYFZSA-N 1 0 371.484 5.400 20 0 FKADRO CC(C)(C)c1ncc(CN[C@H](c2cc3ccccc3o2)c2ccccc2)cn1 ZINC000551546992 568231842 /nfs/dbraw/zinc/23/18/42/568231842.db2.gz FDONNQZUNMILNX-QFIPXVFZSA-N 1 0 371.484 5.400 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+]Cc2ccccc2-c2ccc(Cl)cc2)cn1 ZINC000551547483 568231954 /nfs/dbraw/zinc/23/19/54/568231954.db2.gz OLGXNSNFRMSTPE-UHFFFAOYSA-N 1 0 365.908 5.384 20 0 FKADRO Fc1cc(F)cc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000551551397 568231935 /nfs/dbraw/zinc/23/19/35/568231935.db2.gz GHWSJCPTXVNLRG-UHFFFAOYSA-N 1 0 350.821 5.032 20 0 FKADRO Cc1ccccc1C([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccccc1C ZINC000551552832 568231902 /nfs/dbraw/zinc/23/19/02/568231902.db2.gz REYLZMQYZMIWLF-UHFFFAOYSA-N 1 0 359.517 5.270 20 0 FKADRO Cc1nc(C)c([C@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551557665 568232192 /nfs/dbraw/zinc/23/21/92/568232192.db2.gz IRJOHVKJLOFHPE-JTQLQIEISA-N 1 0 363.939 5.388 20 0 FKADRO Cc1nc(C)c([C@@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551557673 568232176 /nfs/dbraw/zinc/23/21/76/568232176.db2.gz IRJOHVKJLOFHPE-SNVBAGLBSA-N 1 0 363.939 5.388 20 0 FKADRO CC(C)N(Cc1cnc(-c2ccc(Cl)cc2)s1)Cc1ccccn1 ZINC000551557780 568232210 /nfs/dbraw/zinc/23/22/10/568232210.db2.gz JSWRYKAIJRVSPS-UHFFFAOYSA-N 1 0 357.910 5.269 20 0 FKADRO Cc1cc([C@@H]2CCCN2Cc2cnc(-c3ccc(Cl)cc3)s2)on1 ZINC000551558724 568232179 /nfs/dbraw/zinc/23/21/79/568232179.db2.gz ICJBGQPLTYLNNU-INIZCTEOSA-N 1 0 359.882 5.097 20 0 FKADRO Cc1cc([C@H]2CCCN2Cc2cnc(-c3ccc(Cl)cc3)s2)on1 ZINC000551558725 568232173 /nfs/dbraw/zinc/23/21/73/568232173.db2.gz ICJBGQPLTYLNNU-MRXNPFEDSA-N 1 0 359.882 5.097 20 0 FKADRO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551558944 568232291 /nfs/dbraw/zinc/23/22/91/568232291.db2.gz QEELBGIJIZTYPE-GFCCVEGCSA-N 1 0 360.832 5.238 20 0 FKADRO FC(F)(F)[C@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551558945 568232304 /nfs/dbraw/zinc/23/23/04/568232304.db2.gz QEELBGIJIZTYPE-LBPRGKRZSA-N 1 0 360.832 5.238 20 0 FKADRO C[N@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)[C@@H](CCO)c1ccccc1 ZINC000551560916 568232421 /nfs/dbraw/zinc/23/24/21/568232421.db2.gz WASZGEPELPZMDR-IBGZPJMESA-N 1 0 372.921 5.019 20 0 FKADRO C[N@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)[C@H](CCO)c1ccccc1 ZINC000551560921 568232449 /nfs/dbraw/zinc/23/24/49/568232449.db2.gz WASZGEPELPZMDR-LJQANCHMSA-N 1 0 372.921 5.019 20 0 FKADRO CCCCCOc1ccc([C@H]([NH2+]Cc2cnc3n2CCCC3)C2CC2)cc1 ZINC000551563564 568232509 /nfs/dbraw/zinc/23/25/09/568232509.db2.gz IDTBSGCYUIOMBH-HSZRJFAPSA-N 1 0 367.537 5.029 20 0 FKADRO CCCCCOc1ccc([C@@H]([NH2+]Cc2cnc3n2CCCC3)C2CC2)cc1 ZINC000551563573 568232545 /nfs/dbraw/zinc/23/25/45/568232545.db2.gz IDTBSGCYUIOMBH-QHCPKHFHSA-N 1 0 367.537 5.029 20 0 FKADRO Fc1cncc([C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C2CC2)c1 ZINC000551563835 568232535 /nfs/dbraw/zinc/23/25/35/568232535.db2.gz KUDFUOVZSGUWIV-GOSISDBHSA-N 1 0 373.884 5.239 20 0 FKADRO Fc1cncc([C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C2CC2)c1 ZINC000551563845 568232517 /nfs/dbraw/zinc/23/25/17/568232517.db2.gz KUDFUOVZSGUWIV-SFHVURJKSA-N 1 0 373.884 5.239 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@H]2CCCc3c4ccccc4sc32)ccn1 ZINC000551565279 568232485 /nfs/dbraw/zinc/23/24/85/568232485.db2.gz CZYBOOCGUQYNDN-HNNXBMFYSA-N 1 0 360.429 5.065 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@@H]2CCCc3c4ccccc4sc32)ccn1 ZINC000551565281 568232515 /nfs/dbraw/zinc/23/25/15/568232515.db2.gz CZYBOOCGUQYNDN-OAHLLOKOSA-N 1 0 360.429 5.065 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cc(F)cc(F)c1 ZINC000551565387 568232482 /nfs/dbraw/zinc/23/24/82/568232482.db2.gz UXLPTLMDQYUKIM-LLVKDONJSA-N 1 0 364.848 5.593 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cc(F)cc(F)c1 ZINC000551565388 568232543 /nfs/dbraw/zinc/23/25/43/568232543.db2.gz UXLPTLMDQYUKIM-NSHDSACASA-N 1 0 364.848 5.593 20 0 FKADRO c1ccc([C@H](NCc2ccc(OC3CCCC3)cc2)c2ccccn2)cc1 ZINC000551566078 568232513 /nfs/dbraw/zinc/23/25/13/568232513.db2.gz YLRVQYHYANGXKS-DEOSSOPVSA-N 1 0 358.485 5.282 20 0 FKADRO c1ccc([C@@H](NCc2ccc(OC3CCCC3)cc2)c2ccccn2)cc1 ZINC000551566082 568232540 /nfs/dbraw/zinc/23/25/40/568232540.db2.gz YLRVQYHYANGXKS-XMMPIXPASA-N 1 0 358.485 5.282 20 0 FKADRO CCn1ccnc1CNCc1cccc(Oc2cccc3ccccc32)c1 ZINC000551569038 568232573 /nfs/dbraw/zinc/23/25/73/568232573.db2.gz NCLFXZBWFXMGQI-UHFFFAOYSA-N 1 0 357.457 5.138 20 0 FKADRO Cc1cc(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)ccc1Cl ZINC000551569689 568232684 /nfs/dbraw/zinc/23/26/84/568232684.db2.gz MAEMODGRYFGVKY-KRWDZBQOSA-N 1 0 365.702 5.047 20 0 FKADRO Cc1cc(C[NH2+][C@@H](c2cncc(Br)c2)C2CC2)ccc1Cl ZINC000551569692 568232725 /nfs/dbraw/zinc/23/27/25/568232725.db2.gz MAEMODGRYFGVKY-QGZVFWFLSA-N 1 0 365.702 5.047 20 0 FKADRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551569786 568232803 /nfs/dbraw/zinc/23/28/03/568232803.db2.gz OFRLOPQUPIUCAK-KBXCAEBGSA-N 1 0 364.942 5.004 20 0 FKADRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551569787 568232777 /nfs/dbraw/zinc/23/27/77/568232777.db2.gz OFRLOPQUPIUCAK-KDOFPFPSSA-N 1 0 364.942 5.004 20 0 FKADRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551569788 568232802 /nfs/dbraw/zinc/23/28/02/568232802.db2.gz OFRLOPQUPIUCAK-KSSFIOAISA-N 1 0 364.942 5.004 20 0 FKADRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000551569789 568232767 /nfs/dbraw/zinc/23/27/67/568232767.db2.gz OFRLOPQUPIUCAK-RDTXWAMCSA-N 1 0 364.942 5.004 20 0 FKADRO CCCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(S(=O)(=O)CC)cc2)cc1 ZINC000551569867 568232781 /nfs/dbraw/zinc/23/27/81/568232781.db2.gz ISXVMPUOHRRITN-MSOLQXFVSA-N 1 0 373.562 5.235 20 0 FKADRO CCCCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(S(=O)(=O)CC)cc2)cc1 ZINC000551569868 568232794 /nfs/dbraw/zinc/23/27/94/568232794.db2.gz ISXVMPUOHRRITN-QZTJIDSGSA-N 1 0 373.562 5.235 20 0 FKADRO CCCCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(S(=O)(=O)CC)cc2)cc1 ZINC000551569869 568232792 /nfs/dbraw/zinc/23/27/92/568232792.db2.gz ISXVMPUOHRRITN-ROUUACIJSA-N 1 0 373.562 5.235 20 0 FKADRO CCCCc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(S(=O)(=O)CC)cc2)cc1 ZINC000551569870 568232786 /nfs/dbraw/zinc/23/27/86/568232786.db2.gz ISXVMPUOHRRITN-ZWKOTPCHSA-N 1 0 373.562 5.235 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccoc1 ZINC000551569884 568232765 /nfs/dbraw/zinc/23/27/65/568232765.db2.gz IYPJYTQZWZQYGT-ACJLOTCBSA-N 1 0 353.384 5.117 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccoc1 ZINC000551569885 568232743 /nfs/dbraw/zinc/23/27/43/568232743.db2.gz IYPJYTQZWZQYGT-FZKQIMNGSA-N 1 0 353.384 5.117 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccoc1 ZINC000551569886 568232734 /nfs/dbraw/zinc/23/27/34/568232734.db2.gz IYPJYTQZWZQYGT-SCLBCKFNSA-N 1 0 353.384 5.117 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccoc1 ZINC000551569887 568232757 /nfs/dbraw/zinc/23/27/57/568232757.db2.gz IYPJYTQZWZQYGT-UGSOOPFHSA-N 1 0 353.384 5.117 20 0 FKADRO CC[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccs1 ZINC000551569924 568232732 /nfs/dbraw/zinc/23/27/32/568232732.db2.gz KENULGSNCPBWJF-GDBMZVCRSA-N 1 0 351.313 5.098 20 0 FKADRO CC[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccs1 ZINC000551569925 568232772 /nfs/dbraw/zinc/23/27/72/568232772.db2.gz KENULGSNCPBWJF-GOEBONIOSA-N 1 0 351.313 5.098 20 0 FKADRO CC[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccs1 ZINC000551569926 568232768 /nfs/dbraw/zinc/23/27/68/568232768.db2.gz KENULGSNCPBWJF-HOCLYGCPSA-N 1 0 351.313 5.098 20 0 FKADRO CC[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccs1 ZINC000551569927 568232762 /nfs/dbraw/zinc/23/27/62/568232762.db2.gz KENULGSNCPBWJF-ZBFHGGJFSA-N 1 0 351.313 5.098 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)cc1Cl ZINC000551570090 568232770 /nfs/dbraw/zinc/23/27/70/568232770.db2.gz AKERSXQKBFZXID-GFCCVEGCSA-N 1 0 355.812 5.191 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)cc1Cl ZINC000551570091 568232790 /nfs/dbraw/zinc/23/27/90/568232790.db2.gz AKERSXQKBFZXID-LBPRGKRZSA-N 1 0 355.812 5.191 20 0 FKADRO c1cncc(-c2cccc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)c2)c1 ZINC000551570182 568232805 /nfs/dbraw/zinc/23/28/05/568232805.db2.gz UEHZOZPUKWYJPN-UHFFFAOYSA-N 1 0 358.485 5.360 20 0 FKADRO COc1cc2c(cc1OC)[C@H]([NH2+]C1(c3ccc(Cl)cc3)CCC1)CC2 ZINC000551570263 568232813 /nfs/dbraw/zinc/23/28/13/568232813.db2.gz LNYHLQOIEVBQGM-GOSISDBHSA-N 1 0 357.881 5.014 20 0 FKADRO COc1cc2c(cc1OC)[C@@H]([NH2+]C1(c3ccc(Cl)cc3)CCC1)CC2 ZINC000551570264 568232807 /nfs/dbraw/zinc/23/28/07/568232807.db2.gz LNYHLQOIEVBQGM-SFHVURJKSA-N 1 0 357.881 5.014 20 0 FKADRO Cc1n[nH]cc1C1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000551570358 568232877 /nfs/dbraw/zinc/23/28/77/568232877.db2.gz FGUZWPONOHEUDI-UHFFFAOYSA-N 1 0 355.869 5.011 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000551570413 568232850 /nfs/dbraw/zinc/23/28/50/568232850.db2.gz DIUOIXMBPJKNCD-KRWDZBQOSA-N 1 0 374.456 5.127 20 0 FKADRO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000551570414 568232818 /nfs/dbraw/zinc/23/28/18/568232818.db2.gz DIUOIXMBPJKNCD-QGZVFWFLSA-N 1 0 374.456 5.127 20 0 FKADRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1OC ZINC000551570752 568232873 /nfs/dbraw/zinc/23/28/73/568232873.db2.gz PROLLCBNVVEDEQ-KRWDZBQOSA-N 1 0 369.505 5.184 20 0 FKADRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1OC ZINC000551570760 568232840 /nfs/dbraw/zinc/23/28/40/568232840.db2.gz PROLLCBNVVEDEQ-QGZVFWFLSA-N 1 0 369.505 5.184 20 0 FKADRO Cc1ccccc1[C@H](C)[N@@H+](Cc1cn(C)nc1-c1ccncc1)CC(C)C ZINC000551570873 568232823 /nfs/dbraw/zinc/23/28/23/568232823.db2.gz IXRCZOPPPDAFPQ-IBGZPJMESA-N 1 0 362.521 5.010 20 0 FKADRO Cc1ccccc1[C@@H](C)[N@@H+](Cc1cn(C)nc1-c1ccncc1)CC(C)C ZINC000551570875 568232838 /nfs/dbraw/zinc/23/28/38/568232838.db2.gz IXRCZOPPPDAFPQ-LJQANCHMSA-N 1 0 362.521 5.010 20 0 FKADRO CCc1ccc([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)s1 ZINC000551571209 568232943 /nfs/dbraw/zinc/23/29/43/568232943.db2.gz SKBOYGQUNSXPGS-APPDUMDISA-N 1 0 365.340 5.270 20 0 FKADRO CCc1ccc([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)s1 ZINC000551571212 568232908 /nfs/dbraw/zinc/23/29/08/568232908.db2.gz SKBOYGQUNSXPGS-DIFFPNOSSA-N 1 0 365.340 5.270 20 0 FKADRO CCc1ccc([C@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)s1 ZINC000551571214 568232927 /nfs/dbraw/zinc/23/29/27/568232927.db2.gz SKBOYGQUNSXPGS-GTNSWQLSSA-N 1 0 365.340 5.270 20 0 FKADRO CCc1ccc([C@@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)s1 ZINC000551571216 568232886 /nfs/dbraw/zinc/23/28/86/568232886.db2.gz SKBOYGQUNSXPGS-PIGZYNQJSA-N 1 0 365.340 5.270 20 0 FKADRO Cc1nn2c(C[NH2+]C3(c4ccc(Cl)cc4)CCC3)c(C(C)C)nc2s1 ZINC000551571600 568232916 /nfs/dbraw/zinc/23/29/16/568232916.db2.gz MUNPDRATLXMYJW-UHFFFAOYSA-N 1 0 374.941 5.045 20 0 FKADRO CCc1cccnc1[C@@H](C)[NH2+][C@@H](CCOC)c1ccc(Cl)c(Cl)c1 ZINC000551571819 568232889 /nfs/dbraw/zinc/23/28/89/568232889.db2.gz VYJUJRUAPIEFNM-ACJLOTCBSA-N 1 0 367.320 5.379 20 0 FKADRO CCc1cccnc1[C@@H](C)[NH2+][C@H](CCOC)c1ccc(Cl)c(Cl)c1 ZINC000551571820 568232911 /nfs/dbraw/zinc/23/29/11/568232911.db2.gz VYJUJRUAPIEFNM-FZKQIMNGSA-N 1 0 367.320 5.379 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+][C@H](CCOC)c1ccc(Cl)c(Cl)c1 ZINC000551571821 568232922 /nfs/dbraw/zinc/23/29/22/568232922.db2.gz VYJUJRUAPIEFNM-SCLBCKFNSA-N 1 0 367.320 5.379 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+][C@@H](CCOC)c1ccc(Cl)c(Cl)c1 ZINC000551571822 568232941 /nfs/dbraw/zinc/23/29/41/568232941.db2.gz VYJUJRUAPIEFNM-UGSOOPFHSA-N 1 0 367.320 5.379 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)CCC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000551572305 568232926 /nfs/dbraw/zinc/23/29/26/568232926.db2.gz IHUWEQYNHWZQMU-HZMBPMFUSA-N 1 0 358.231 5.392 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)CCC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000551572310 568232940 /nfs/dbraw/zinc/23/29/40/568232940.db2.gz IHUWEQYNHWZQMU-IINYFYTJSA-N 1 0 358.231 5.392 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)CCC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000551572311 568232935 /nfs/dbraw/zinc/23/29/35/568232935.db2.gz IHUWEQYNHWZQMU-QMTHXVAHSA-N 1 0 358.231 5.392 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)CCC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000551572314 568232891 /nfs/dbraw/zinc/23/28/91/568232891.db2.gz IHUWEQYNHWZQMU-YGRLFVJLSA-N 1 0 358.231 5.392 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000551572678 568232914 /nfs/dbraw/zinc/23/29/14/568232914.db2.gz WGIFXGCZSJSAAG-HZMBPMFUSA-N 1 0 365.237 5.006 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000551572679 568232885 /nfs/dbraw/zinc/23/28/85/568232885.db2.gz WGIFXGCZSJSAAG-IINYFYTJSA-N 1 0 365.237 5.006 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000551572680 568232900 /nfs/dbraw/zinc/23/29/00/568232900.db2.gz WGIFXGCZSJSAAG-QMTHXVAHSA-N 1 0 365.237 5.006 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000551572681 568232945 /nfs/dbraw/zinc/23/29/45/568232945.db2.gz WGIFXGCZSJSAAG-YGRLFVJLSA-N 1 0 365.237 5.006 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](C)c2sc(C(C)C)nc2C)cc1Cl ZINC000551573575 568233132 /nfs/dbraw/zinc/23/31/32/568233132.db2.gz VZXNPULIJIZVEP-GFCCVEGCSA-N 1 0 352.931 5.478 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](C)c2sc(C(C)C)nc2C)cc1Cl ZINC000551573576 568233106 /nfs/dbraw/zinc/23/31/06/568233106.db2.gz VZXNPULIJIZVEP-LBPRGKRZSA-N 1 0 352.931 5.478 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000551573678 568233100 /nfs/dbraw/zinc/23/31/00/568233100.db2.gz YVXKUPOAUMMGAW-APPDUMDISA-N 1 0 373.711 5.470 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000551573679 568233089 /nfs/dbraw/zinc/23/30/89/568233089.db2.gz YVXKUPOAUMMGAW-DIFFPNOSSA-N 1 0 373.711 5.470 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000551573680 568233080 /nfs/dbraw/zinc/23/30/80/568233080.db2.gz YVXKUPOAUMMGAW-GTNSWQLSSA-N 1 0 373.711 5.470 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000551573681 568233074 /nfs/dbraw/zinc/23/30/74/568233074.db2.gz YVXKUPOAUMMGAW-PIGZYNQJSA-N 1 0 373.711 5.470 20 0 FKADRO FC(F)C1CCC([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551573701 568233134 /nfs/dbraw/zinc/23/31/34/568233134.db2.gz ZLPLJTMYHDRKBI-UHFFFAOYSA-N 1 0 356.869 5.377 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCCNc4ccccc43)s2)cc1 ZINC000551573706 568233128 /nfs/dbraw/zinc/23/31/28/568233128.db2.gz ZQEHCEXWIRZWJY-IBGZPJMESA-N 1 0 369.921 5.500 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCCNc4ccccc43)s2)cc1 ZINC000551573707 568233076 /nfs/dbraw/zinc/23/30/76/568233076.db2.gz ZQEHCEXWIRZWJY-LJQANCHMSA-N 1 0 369.921 5.500 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H](c3cccs3)C3CC3)s2)cc1 ZINC000551574218 568233095 /nfs/dbraw/zinc/23/30/95/568233095.db2.gz PFQNVZGCISRUNV-KRWDZBQOSA-N 1 0 360.935 5.766 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H](c3cccs3)C3CC3)s2)cc1 ZINC000551574224 568233112 /nfs/dbraw/zinc/23/31/12/568233112.db2.gz PFQNVZGCISRUNV-QGZVFWFLSA-N 1 0 360.935 5.766 20 0 FKADRO Cc1nccnc1[C@@H](C)NCc1cccc(Oc2cccc3ccccc32)c1 ZINC000551574684 568233082 /nfs/dbraw/zinc/23/30/82/568233082.db2.gz MQVJKWKFGGGWKX-GOSISDBHSA-N 1 0 369.468 5.581 20 0 FKADRO Cc1nccnc1[C@H](C)NCc1cccc(Oc2cccc3ccccc32)c1 ZINC000551574685 568233126 /nfs/dbraw/zinc/23/31/26/568233126.db2.gz MQVJKWKFGGGWKX-SFHVURJKSA-N 1 0 369.468 5.581 20 0 FKADRO FC(F)(F)c1cccc([C@@H]([NH2+]Cc2cccs2)C2CCOCC2)c1 ZINC000551576779 568233216 /nfs/dbraw/zinc/23/32/16/568233216.db2.gz XFDFWQUDHZZHII-KRWDZBQOSA-N 1 0 355.425 5.024 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cccs2)C2CCOCC2)c1 ZINC000551576785 568233254 /nfs/dbraw/zinc/23/32/54/568233254.db2.gz XFDFWQUDHZZHII-QGZVFWFLSA-N 1 0 355.425 5.024 20 0 FKADRO Fc1ccc2cc(C[NH2+]Cc3cnc(-c4ccc(Cl)cc4)s3)[nH]c2c1 ZINC000551577396 568233347 /nfs/dbraw/zinc/23/33/47/568233347.db2.gz XFYFWGSEIJIOAQ-UHFFFAOYSA-N 1 0 371.868 5.374 20 0 FKADRO Cc1c2cc(Cl)ccc2sc1C[NH2+]Cc1cnc(C(C)(C)C)nc1 ZINC000551579641 568233467 /nfs/dbraw/zinc/23/34/67/568233467.db2.gz PGIINMLYTSPYGB-UHFFFAOYSA-N 1 0 359.926 5.240 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3ccnc4ccccc34)s2)cc1 ZINC000551580534 568233529 /nfs/dbraw/zinc/23/35/29/568233529.db2.gz NOHLLYLYZDYPSB-UHFFFAOYSA-N 1 0 365.889 5.302 20 0 FKADRO COCC[C@H]([NH2+]Cc1cccc(COC)c1)c1ccc(Cl)c(Cl)c1 ZINC000551580786 568233672 /nfs/dbraw/zinc/23/36/72/568233672.db2.gz YWUSTVXFFYULIW-IBGZPJMESA-N 1 0 368.304 5.007 20 0 FKADRO COCC[C@@H]([NH2+]Cc1cccc(COC)c1)c1ccc(Cl)c(Cl)c1 ZINC000551580787 568233724 /nfs/dbraw/zinc/23/37/24/568233724.db2.gz YWUSTVXFFYULIW-LJQANCHMSA-N 1 0 368.304 5.007 20 0 FKADRO CC(C)c1ncc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551580835 568233721 /nfs/dbraw/zinc/23/37/21/568233721.db2.gz BTPXRZQBKUWTJU-UHFFFAOYSA-N 1 0 363.939 5.333 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cc(Cl)cc3cccnc32)cc1Cl ZINC000551582344 568232445 /nfs/dbraw/zinc/23/24/45/568232445.db2.gz MCPYBCCYABSWSK-UHFFFAOYSA-N 1 0 361.272 5.230 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3ccc4c(n3)CCCC4)s2)cc1 ZINC000551582463 568232452 /nfs/dbraw/zinc/23/24/52/568232452.db2.gz TXGPROORVMDPTL-UHFFFAOYSA-N 1 0 369.921 5.027 20 0 FKADRO COc1ccccc1C(C)(C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551582516 568232469 /nfs/dbraw/zinc/23/24/69/568232469.db2.gz VUIBELWJHAPRCB-UHFFFAOYSA-N 1 0 372.921 5.497 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cnc(-c3ccsc3)s2)cc1Cl ZINC000551584378 568235931 /nfs/dbraw/zinc/23/59/31/568235931.db2.gz DAZHRGVXEDDNCV-UHFFFAOYSA-N 1 0 364.923 5.214 20 0 FKADRO FC(F)(F)C[C@H]1CC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551584779 568235894 /nfs/dbraw/zinc/23/58/94/568235894.db2.gz PSNNMDUSCSXJQX-LLVKDONJSA-N 1 0 360.832 5.238 20 0 FKADRO FC(F)(F)C[C@@H]1CC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551584780 568235919 /nfs/dbraw/zinc/23/59/19/568235919.db2.gz PSNNMDUSCSXJQX-NSHDSACASA-N 1 0 360.832 5.238 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCOC4(CCCC4)C3)s2)cc1 ZINC000551584828 568235906 /nfs/dbraw/zinc/23/59/06/568235906.db2.gz KLVNCILAMNWRFC-INIZCTEOSA-N 1 0 362.926 5.045 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCOC4(CCCC4)C3)s2)cc1 ZINC000551584829 568235933 /nfs/dbraw/zinc/23/59/33/568235933.db2.gz KLVNCILAMNWRFC-MRXNPFEDSA-N 1 0 362.926 5.045 20 0 FKADRO Fc1cc(-c2ccncc2)ccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000551585796 568236073 /nfs/dbraw/zinc/23/60/73/568236073.db2.gz GAWCPMLEOWKEAK-UHFFFAOYSA-N 1 0 352.375 5.052 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cccc(-c3cccnc3)c2)cc1Cl ZINC000551586940 568236084 /nfs/dbraw/zinc/23/60/84/568236084.db2.gz RTEGVCQSBRFOIQ-UHFFFAOYSA-N 1 0 352.865 5.091 20 0 FKADRO CCOc1ccc(CNCc2csc(-c3ccsc3)n2)cc1Cl ZINC000551587566 568236123 /nfs/dbraw/zinc/23/61/23/568236123.db2.gz JAVUNMJZRCOQTR-UHFFFAOYSA-N 1 0 364.923 5.214 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cccc(-c3ccccn3)c2)cc1Cl ZINC000551588348 568236195 /nfs/dbraw/zinc/23/61/95/568236195.db2.gz SIJITTQDCITWLD-UHFFFAOYSA-N 1 0 352.865 5.091 20 0 FKADRO COc1cc(C)cc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000551588563 568236247 /nfs/dbraw/zinc/23/62/47/568236247.db2.gz VAXZQJOJMKYUKV-UHFFFAOYSA-N 1 0 358.894 5.070 20 0 FKADRO COC1CCC(C)(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551588750 568236371 /nfs/dbraw/zinc/23/63/71/568236371.db2.gz ZPVBGZNNZRMUFR-UHFFFAOYSA-N 1 0 364.942 5.148 20 0 FKADRO COc1cccc(C2([NH2+]Cc3cnc(-c4ccc(Cl)cc4)s3)CC2)c1 ZINC000551590199 568236453 /nfs/dbraw/zinc/23/64/53/568236453.db2.gz TYLYCHQDBUVCSE-UHFFFAOYSA-N 1 0 370.905 5.251 20 0 FKADRO COc1cccc2c1CC[C@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551591805 568236726 /nfs/dbraw/zinc/23/67/26/568236726.db2.gz BGEIMOUBLRBTTG-GOSISDBHSA-N 1 0 370.905 5.249 20 0 FKADRO COc1cccc2c1CC[C@@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551591806 568236720 /nfs/dbraw/zinc/23/67/20/568236720.db2.gz BGEIMOUBLRBTTG-SFHVURJKSA-N 1 0 370.905 5.249 20 0 FKADRO CCOCCC1(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CCC1 ZINC000551593106 568236750 /nfs/dbraw/zinc/23/67/50/568236750.db2.gz JPENMQJEWJSARJ-UHFFFAOYSA-N 1 0 364.942 5.150 20 0 FKADRO CC(C)(C)c1nnc(CNCc2ccc(-c3ccc(Cl)cc3)cc2)s1 ZINC000551593942 568236769 /nfs/dbraw/zinc/23/67/69/568236769.db2.gz QUPVSSVZXXVCKS-UHFFFAOYSA-N 1 0 371.937 5.446 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H]3CCCc4sccc43)s2)cc1 ZINC000551595824 568236783 /nfs/dbraw/zinc/23/67/83/568236783.db2.gz KEFGUXIWXCIRLB-INIZCTEOSA-N 1 0 360.935 5.692 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCCc4sccc43)s2)cc1 ZINC000551595825 568236785 /nfs/dbraw/zinc/23/67/85/568236785.db2.gz KEFGUXIWXCIRLB-MRXNPFEDSA-N 1 0 360.935 5.692 20 0 FKADRO COc1cc(C)ccc1C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551597437 568234152 /nfs/dbraw/zinc/23/41/52/568234152.db2.gz SAXGMMBNDQAZFB-UHFFFAOYSA-N 1 0 358.894 5.070 20 0 FKADRO Cc1ncccc1CN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551599663 568234133 /nfs/dbraw/zinc/23/41/33/568234133.db2.gz CYHLHPAQOONUHT-UHFFFAOYSA-N 1 0 362.317 5.060 20 0 FKADRO Cc1cccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000551615400 568234736 /nfs/dbraw/zinc/23/47/36/568234736.db2.gz OYZGCFPLOHVTEG-FQEVSTJZSA-N 1 0 363.423 5.271 20 0 FKADRO Cc1cccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000551615402 568234726 /nfs/dbraw/zinc/23/47/26/568234726.db2.gz OYZGCFPLOHVTEG-HXUWFJFHSA-N 1 0 363.423 5.271 20 0 FKADRO Cc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 ZINC000551615479 568234723 /nfs/dbraw/zinc/23/47/23/568234723.db2.gz PWZLLJDIFSMIOY-FQEVSTJZSA-N 1 0 363.423 5.271 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 ZINC000551615481 568234734 /nfs/dbraw/zinc/23/47/34/568234734.db2.gz PWZLLJDIFSMIOY-HXUWFJFHSA-N 1 0 363.423 5.271 20 0 FKADRO COCC[C@H]([NH2+]Cc1cnc(C(C)C)s1)c1ccc(Cl)c(Cl)c1 ZINC000551617263 568234813 /nfs/dbraw/zinc/23/48/13/568234813.db2.gz OIIWRYIAVIBOII-INIZCTEOSA-N 1 0 373.349 5.441 20 0 FKADRO COCC[C@@H]([NH2+]Cc1cnc(C(C)C)s1)c1ccc(Cl)c(Cl)c1 ZINC000551617265 568234787 /nfs/dbraw/zinc/23/47/87/568234787.db2.gz OIIWRYIAVIBOII-MRXNPFEDSA-N 1 0 373.349 5.441 20 0 FKADRO Cc1cc(C)c(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)cc1C ZINC000551620579 568234905 /nfs/dbraw/zinc/23/49/05/568234905.db2.gz ZIYORGSBPNCGLP-IBGZPJMESA-N 1 0 359.311 5.010 20 0 FKADRO Cc1cc(C)c(C[NH2+][C@@H](c2cncc(Br)c2)C2CC2)cc1C ZINC000551620581 568234926 /nfs/dbraw/zinc/23/49/26/568234926.db2.gz ZIYORGSBPNCGLP-LJQANCHMSA-N 1 0 359.311 5.010 20 0 FKADRO Cc1nc2ccccc2cc1C(=O)Nc1cccc2c1C[N@H+](CCC(C)C)C2 ZINC000551623017 568236972 /nfs/dbraw/zinc/23/69/72/568236972.db2.gz YILWBNDKTUPGKC-UHFFFAOYSA-N 1 0 373.500 5.157 20 0 FKADRO Cc1cccc(C2(C(=O)Nc3cccc4c3C[N@H+](CCC(C)C)C4)CC2)c1 ZINC000551651204 568238133 /nfs/dbraw/zinc/23/81/33/568238133.db2.gz XBWZDVITJFFUKT-UHFFFAOYSA-N 1 0 362.517 5.027 20 0 FKADRO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551698219 568241274 /nfs/dbraw/zinc/24/12/74/568241274.db2.gz SQILMDWLEZYFPF-LLVKDONJSA-N 1 0 362.317 5.312 20 0 FKADRO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551698220 568241264 /nfs/dbraw/zinc/24/12/64/568241264.db2.gz SQILMDWLEZYFPF-NSHDSACASA-N 1 0 362.317 5.312 20 0 FKADRO Fc1ccc([C@H]([NH2+]Cc2ccc(C(F)(F)F)cn2)C2CCCC2)cc1 ZINC000551703006 568241419 /nfs/dbraw/zinc/24/14/19/568241419.db2.gz KSDCVMZJLNGVIJ-GOSISDBHSA-N 1 0 352.375 5.261 20 0 FKADRO Fc1ccc([C@@H]([NH2+]Cc2ccc(C(F)(F)F)cn2)C2CCCC2)cc1 ZINC000551703007 568241382 /nfs/dbraw/zinc/24/13/82/568241382.db2.gz KSDCVMZJLNGVIJ-SFHVURJKSA-N 1 0 352.375 5.261 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+][C@@H](Cc2ccccc2)c2cccs2)nc1 ZINC000551704299 568241875 /nfs/dbraw/zinc/24/18/75/568241875.db2.gz VEJPJWKVMYEFLD-KRWDZBQOSA-N 1 0 362.420 5.236 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+][C@H](Cc2ccccc2)c2cccs2)nc1 ZINC000551704300 568241914 /nfs/dbraw/zinc/24/19/14/568241914.db2.gz VEJPJWKVMYEFLD-QGZVFWFLSA-N 1 0 362.420 5.236 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cc(F)c(F)c(F)c2)cc1OC ZINC000551705522 568241267 /nfs/dbraw/zinc/24/12/67/568241267.db2.gz AKKCDTZQTPNTAX-CYBMUJFWSA-N 1 0 367.411 5.142 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+]Cc2cc(F)c(F)c(F)c2)cc1OC ZINC000551705523 568241248 /nfs/dbraw/zinc/24/12/48/568241248.db2.gz AKKCDTZQTPNTAX-ZDUSSCGKSA-N 1 0 367.411 5.142 20 0 FKADRO FC(F)Oc1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000551705636 568242765 /nfs/dbraw/zinc/24/27/65/568242765.db2.gz GVEHLPFQHCPWHZ-UHFFFAOYSA-N 1 0 357.322 5.086 20 0 FKADRO CCCOc1ccc(C[NH2+]C2(c3ccc(Br)cc3)CC2)cc1 ZINC000551705887 568242779 /nfs/dbraw/zinc/24/27/79/568242779.db2.gz OJPGOLWBTDBQTF-UHFFFAOYSA-N 1 0 360.295 5.017 20 0 FKADRO FC(F)(F)CC1CC[NH+](Cc2cc(-c3ccc(Cl)cc3)no2)CC1 ZINC000551709296 568243561 /nfs/dbraw/zinc/24/35/61/568243561.db2.gz HGLRIUPTPCTMQX-UHFFFAOYSA-N 1 0 358.791 5.159 20 0 FKADRO CC(C)(NCc1csc(Cc2ccccc2)n1)c1ccc(Cl)cc1 ZINC000551722460 568244418 /nfs/dbraw/zinc/24/44/18/568244418.db2.gz HVDOFSIFXURLIB-UHFFFAOYSA-N 1 0 356.922 5.412 20 0 FKADRO CCOc1ccc(C(C)=O)cc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000551737573 568245603 /nfs/dbraw/zinc/24/56/03/568245603.db2.gz MTWOMKQHZWNQAY-UHFFFAOYSA-N 1 0 357.881 5.110 20 0 FKADRO Cc1nc(C(F)(F)F)c(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)s1 ZINC000551747725 568244428 /nfs/dbraw/zinc/24/44/28/568244428.db2.gz HPOHUFKMEICYLH-UHFFFAOYSA-N 1 0 360.832 5.293 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccco1 ZINC000551778962 568246354 /nfs/dbraw/zinc/24/63/54/568246354.db2.gz MWHBJNWPHFCLPM-PBHICJAKSA-N 1 0 351.874 5.149 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccco1 ZINC000551778966 568246410 /nfs/dbraw/zinc/24/64/10/568246410.db2.gz MWHBJNWPHFCLPM-RHSMWYFYSA-N 1 0 351.874 5.149 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccco1 ZINC000551778967 568246395 /nfs/dbraw/zinc/24/63/95/568246395.db2.gz MWHBJNWPHFCLPM-WMLDXEAASA-N 1 0 351.874 5.149 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccco1 ZINC000551778968 568246344 /nfs/dbraw/zinc/24/63/44/568246344.db2.gz MWHBJNWPHFCLPM-YOEHRIQHSA-N 1 0 351.874 5.149 20 0 FKADRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+]CCCCc1ccc(Cl)s1 ZINC000551779161 568246343 /nfs/dbraw/zinc/24/63/43/568246343.db2.gz RDHDAFRTGQMYGR-HNNXBMFYSA-N 1 0 364.942 5.040 20 0 FKADRO Cc1ccccc1NC(=O)C[C@@H](C)[NH2+]CCCCc1ccc(Cl)s1 ZINC000551779170 568246384 /nfs/dbraw/zinc/24/63/84/568246384.db2.gz RDHDAFRTGQMYGR-OAHLLOKOSA-N 1 0 364.942 5.040 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1Cl ZINC000551780054 568246348 /nfs/dbraw/zinc/24/63/48/568246348.db2.gz SFSLKYHYPPNJDT-QWRGUYRKSA-N 1 0 374.790 5.054 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1Cl ZINC000551780055 568246341 /nfs/dbraw/zinc/24/63/41/568246341.db2.gz SFSLKYHYPPNJDT-WDEREUQCSA-N 1 0 374.790 5.054 20 0 FKADRO C[C@H](CCC(C)(C)C)[NH2+]C1CCN(Cc2coc(-c3ccccc3)n2)CC1 ZINC000551780488 568246412 /nfs/dbraw/zinc/24/64/12/568246412.db2.gz DPQUNRDWVNWAEO-GOSISDBHSA-N 1 0 369.553 5.110 20 0 FKADRO C[C@@H](CCC(C)(C)C)[NH2+]C1CCN(Cc2coc(-c3ccccc3)n2)CC1 ZINC000551780489 568246405 /nfs/dbraw/zinc/24/64/05/568246405.db2.gz DPQUNRDWVNWAEO-SFHVURJKSA-N 1 0 369.553 5.110 20 0 FKADRO CC[C@H](C)c1nnc([C@@H](C)N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780524 568246392 /nfs/dbraw/zinc/24/63/92/568246392.db2.gz GBIFOWHWMNGKJP-BFHYXJOUSA-N 1 0 364.921 5.171 20 0 FKADRO CC[C@H](C)c1nnc([C@H](C)N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780525 568246402 /nfs/dbraw/zinc/24/64/02/568246402.db2.gz GBIFOWHWMNGKJP-IHRRRGAJSA-N 1 0 364.921 5.171 20 0 FKADRO CC[C@H](C)c1nnc([C@@H](C)N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780526 568246378 /nfs/dbraw/zinc/24/63/78/568246378.db2.gz GBIFOWHWMNGKJP-MELADBBJSA-N 1 0 364.921 5.171 20 0 FKADRO CC[C@H](C)c1nnc([C@H](C)N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780527 568246397 /nfs/dbraw/zinc/24/63/97/568246397.db2.gz GBIFOWHWMNGKJP-MJBXVCDLSA-N 1 0 364.921 5.171 20 0 FKADRO COc1ncc([C@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)cc1Cl ZINC000551780876 568246372 /nfs/dbraw/zinc/24/63/72/568246372.db2.gz OELJCSPAXAQCLC-JTQLQIEISA-N 1 0 371.695 5.390 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)cc1Cl ZINC000551780877 568246361 /nfs/dbraw/zinc/24/63/61/568246361.db2.gz OELJCSPAXAQCLC-SNVBAGLBSA-N 1 0 371.695 5.390 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC000551782971 568246426 /nfs/dbraw/zinc/24/64/26/568246426.db2.gz ZNRCETZWCQMKPH-BPXKWBHBSA-N 1 0 373.924 5.698 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC000551782972 568246433 /nfs/dbraw/zinc/24/64/33/568246433.db2.gz ZNRCETZWCQMKPH-DKZVUGQWSA-N 1 0 373.924 5.698 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC000551782973 568246452 /nfs/dbraw/zinc/24/64/52/568246452.db2.gz ZNRCETZWCQMKPH-NBCNXNJRSA-N 1 0 373.924 5.698 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC000551782974 568246446 /nfs/dbraw/zinc/24/64/46/568246446.db2.gz ZNRCETZWCQMKPH-XWFZLUIHSA-N 1 0 373.924 5.698 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)cn1 ZINC000551787158 568247038 /nfs/dbraw/zinc/24/70/38/568247038.db2.gz KCTSZKRJCFJPFL-UHFFFAOYSA-N 1 0 352.309 5.106 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)cc1 ZINC000551787728 568247015 /nfs/dbraw/zinc/24/70/15/568247015.db2.gz LLVJPYJJSGDWNN-CYFREDJKSA-N 1 0 360.501 5.701 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)cc1 ZINC000551787732 568247057 /nfs/dbraw/zinc/24/70/57/568247057.db2.gz LLVJPYJJSGDWNN-DVECYGJZSA-N 1 0 360.501 5.701 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)cc1 ZINC000551787734 568247052 /nfs/dbraw/zinc/24/70/52/568247052.db2.gz LLVJPYJJSGDWNN-NTKDMRAZSA-N 1 0 360.501 5.701 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)cc1 ZINC000551787735 568247013 /nfs/dbraw/zinc/24/70/13/568247013.db2.gz LLVJPYJJSGDWNN-YADARESESA-N 1 0 360.501 5.701 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000551787761 568246999 /nfs/dbraw/zinc/24/69/99/568246999.db2.gz LWPGAUGKBGPMIJ-QLODZENZSA-N 1 0 359.535 5.015 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)cc1 ZINC000551787764 568246995 /nfs/dbraw/zinc/24/69/95/568246995.db2.gz LWPGAUGKBGPMIJ-RJYGXOMWSA-N 1 0 359.535 5.015 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000551787765 568247024 /nfs/dbraw/zinc/24/70/24/568247024.db2.gz LWPGAUGKBGPMIJ-TZPNTHKFSA-N 1 0 359.535 5.015 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)cc1 ZINC000551787766 568247018 /nfs/dbraw/zinc/24/70/18/568247018.db2.gz LWPGAUGKBGPMIJ-XOWTYJCDSA-N 1 0 359.535 5.015 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc3cccnc32)cc1Cl ZINC000551788228 568247111 /nfs/dbraw/zinc/24/71/11/568247111.db2.gz ZYARKKPXTDFZGD-HNNXBMFYSA-N 1 0 354.881 5.526 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc3cccnc32)cc1Cl ZINC000551788229 568247094 /nfs/dbraw/zinc/24/70/94/568247094.db2.gz ZYARKKPXTDFZGD-OAHLLOKOSA-N 1 0 354.881 5.526 20 0 FKADRO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551788412 568247117 /nfs/dbraw/zinc/24/71/17/568247117.db2.gz GBYGOBKDBWMGIC-CYBMUJFWSA-N 1 0 350.890 5.091 20 0 FKADRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551788413 568247099 /nfs/dbraw/zinc/24/70/99/568247099.db2.gz GBYGOBKDBWMGIC-ZDUSSCGKSA-N 1 0 350.890 5.091 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000551788669 568247086 /nfs/dbraw/zinc/24/70/86/568247086.db2.gz DXJZMWRLNLZFDC-DOVSJBTNSA-N 1 0 364.514 5.023 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000551788670 568247107 /nfs/dbraw/zinc/24/71/07/568247107.db2.gz DXJZMWRLNLZFDC-LWILDLIXSA-N 1 0 364.514 5.023 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000551788671 568247081 /nfs/dbraw/zinc/24/70/81/568247081.db2.gz DXJZMWRLNLZFDC-NMSZZDKCSA-N 1 0 364.514 5.023 20 0 FKADRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000551788672 568247105 /nfs/dbraw/zinc/24/71/05/568247105.db2.gz DXJZMWRLNLZFDC-NOOVBMIQSA-N 1 0 364.514 5.023 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2-c2cnn(C)c2)cc1 ZINC000551789083 568247305 /nfs/dbraw/zinc/24/73/05/568247305.db2.gz KPNFUTOEKYGNOE-GOSISDBHSA-N 1 0 363.505 5.117 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+]Cc2ccccc2-c2cnn(C)c2)cc1 ZINC000551789085 568247307 /nfs/dbraw/zinc/24/73/07/568247307.db2.gz KPNFUTOEKYGNOE-SFHVURJKSA-N 1 0 363.505 5.117 20 0 FKADRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551789986 568247346 /nfs/dbraw/zinc/24/73/46/568247346.db2.gz VAJMRIJWSZCPJR-CHWSQXEVSA-N 1 0 350.890 5.186 20 0 FKADRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551789987 568247335 /nfs/dbraw/zinc/24/73/35/568247335.db2.gz VAJMRIJWSZCPJR-OLZOCXBDSA-N 1 0 350.890 5.186 20 0 FKADRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551789988 568247372 /nfs/dbraw/zinc/24/73/72/568247372.db2.gz VAJMRIJWSZCPJR-QWHCGFSZSA-N 1 0 350.890 5.186 20 0 FKADRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000551789989 568247355 /nfs/dbraw/zinc/24/73/55/568247355.db2.gz VAJMRIJWSZCPJR-STQMWFEESA-N 1 0 350.890 5.186 20 0 FKADRO CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3cnc(OC)c(Cl)c3)oc21 ZINC000551792845 568247580 /nfs/dbraw/zinc/24/75/80/568247580.db2.gz CGZOLUZJRBFJPL-CHWSQXEVSA-N 1 0 374.868 5.300 20 0 FKADRO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3cnc(OC)c(Cl)c3)oc21 ZINC000551792846 568247576 /nfs/dbraw/zinc/24/75/76/568247576.db2.gz CGZOLUZJRBFJPL-OLZOCXBDSA-N 1 0 374.868 5.300 20 0 FKADRO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3cnc(OC)c(Cl)c3)oc21 ZINC000551792847 568247508 /nfs/dbraw/zinc/24/75/08/568247508.db2.gz CGZOLUZJRBFJPL-QWHCGFSZSA-N 1 0 374.868 5.300 20 0 FKADRO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3cnc(OC)c(Cl)c3)oc21 ZINC000551792848 568247574 /nfs/dbraw/zinc/24/75/74/568247574.db2.gz CGZOLUZJRBFJPL-STQMWFEESA-N 1 0 374.868 5.300 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCCC3)nc2)cc1 ZINC000551794271 568245673 /nfs/dbraw/zinc/24/56/73/568245673.db2.gz PUIYEUBYXNVLAV-IBGZPJMESA-N 1 0 367.537 5.102 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCCC3)nc2)cc1 ZINC000551794272 568245747 /nfs/dbraw/zinc/24/57/47/568245747.db2.gz PUIYEUBYXNVLAV-LJQANCHMSA-N 1 0 367.537 5.102 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000551794358 568245802 /nfs/dbraw/zinc/24/58/02/568245802.db2.gz SBTHMRBSGUVUOB-INIZCTEOSA-N 1 0 360.929 5.040 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000551794359 568245815 /nfs/dbraw/zinc/24/58/15/568245815.db2.gz SBTHMRBSGUVUOB-MRXNPFEDSA-N 1 0 360.929 5.040 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+]Cc2cccc(NC(=O)CC)c2)cc1 ZINC000551795549 568249185 /nfs/dbraw/zinc/24/91/85/568249185.db2.gz GYFMMMUKONDTLI-KRWDZBQOSA-N 1 0 354.494 5.065 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cccc(NC(=O)CC)c2)cc1 ZINC000551795550 568249180 /nfs/dbraw/zinc/24/91/80/568249180.db2.gz GYFMMMUKONDTLI-QGZVFWFLSA-N 1 0 354.494 5.065 20 0 FKADRO CCCO[C@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551804776 568250920 /nfs/dbraw/zinc/25/09/20/568250920.db2.gz HKBHJQYJMGXMQK-KRWDZBQOSA-N 1 0 364.942 5.245 20 0 FKADRO CCCO[C@@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551804781 568250908 /nfs/dbraw/zinc/25/09/08/568250908.db2.gz HKBHJQYJMGXMQK-QGZVFWFLSA-N 1 0 364.942 5.245 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccc(Cl)c2ccccc21 ZINC000551805240 568250862 /nfs/dbraw/zinc/25/08/62/568250862.db2.gz DFPPVRMOFKPWHN-AWEZNQCLSA-N 1 0 353.897 5.432 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccc(Cl)c2ccccc21 ZINC000551805243 568250881 /nfs/dbraw/zinc/25/08/81/568250881.db2.gz DFPPVRMOFKPWHN-CQSZACIVSA-N 1 0 353.897 5.432 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CC2 ZINC000551811886 568250990 /nfs/dbraw/zinc/25/09/90/568250990.db2.gz IMFNXSKDTASDSM-IBGZPJMESA-N 1 0 370.905 5.249 20 0 FKADRO COc1ccc2c(c1)[C@H]([NH2+]Cc1cnc(-c3ccc(Cl)cc3)s1)CC2 ZINC000551811887 568250956 /nfs/dbraw/zinc/25/09/56/568250956.db2.gz IMFNXSKDTASDSM-LJQANCHMSA-N 1 0 370.905 5.249 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cccnc1 ZINC000551812314 568251023 /nfs/dbraw/zinc/25/10/23/568251023.db2.gz KSARLOPSBTXJDU-GOSISDBHSA-N 1 0 357.910 5.345 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cccnc1 ZINC000551812315 568251044 /nfs/dbraw/zinc/25/10/44/568251044.db2.gz KSARLOPSBTXJDU-SFHVURJKSA-N 1 0 357.910 5.345 20 0 FKADRO CCc1nc2c(s1)[C@H]([NH2+]Cc1ccc(OC3CCCC3)cc1)CCC2 ZINC000551812718 568251056 /nfs/dbraw/zinc/25/10/56/568251056.db2.gz FTNOHJXWWUBEKU-GOSISDBHSA-N 1 0 356.535 5.194 20 0 FKADRO CCc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(OC3CCCC3)cc1)CCC2 ZINC000551812723 568251010 /nfs/dbraw/zinc/25/10/10/568251010.db2.gz FTNOHJXWWUBEKU-SFHVURJKSA-N 1 0 356.535 5.194 20 0 FKADRO C[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc2c(c1)CCC2 ZINC000551812825 568251076 /nfs/dbraw/zinc/25/10/76/568251076.db2.gz NYJDOOGUMYEZRW-RBZFPXEDSA-N 1 0 371.322 5.135 20 0 FKADRO C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000551812829 568251053 /nfs/dbraw/zinc/25/10/53/568251053.db2.gz GKJKGUROIGPKJY-AWEZNQCLSA-N 1 0 371.937 5.452 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc2c(c1)CCC2 ZINC000551812830 568251074 /nfs/dbraw/zinc/25/10/74/568251074.db2.gz NYJDOOGUMYEZRW-RNODOKPDSA-N 1 0 371.322 5.135 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc2c(c1)CCC2 ZINC000551812832 568251026 /nfs/dbraw/zinc/25/10/26/568251026.db2.gz NYJDOOGUMYEZRW-XCLFUZPHSA-N 1 0 371.322 5.135 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc2c(c1)CCC2 ZINC000551812833 568251039 /nfs/dbraw/zinc/25/10/39/568251039.db2.gz NYJDOOGUMYEZRW-ZUOKHONESA-N 1 0 371.322 5.135 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000551812838 568251029 /nfs/dbraw/zinc/25/10/29/568251029.db2.gz GKJKGUROIGPKJY-CQSZACIVSA-N 1 0 371.937 5.452 20 0 FKADRO CCC[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cccnc1 ZINC000551814257 568251233 /nfs/dbraw/zinc/25/12/33/568251233.db2.gz XNKVGFYQHWAEIP-GOSISDBHSA-N 1 0 357.910 5.490 20 0 FKADRO CCC[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1cccnc1 ZINC000551814258 568251169 /nfs/dbraw/zinc/25/11/69/568251169.db2.gz XNKVGFYQHWAEIP-SFHVURJKSA-N 1 0 357.910 5.490 20 0 FKADRO C[C@@H]([NH2+]Cc1ccnc(OC(F)F)c1)c1ccc(-c2cccs2)cc1 ZINC000551814423 568251299 /nfs/dbraw/zinc/25/12/99/568251299.db2.gz ZPGSPLFVVZBFDE-CYBMUJFWSA-N 1 0 360.429 5.262 20 0 FKADRO C[C@H]([NH2+]Cc1ccnc(OC(F)F)c1)c1ccc(-c2cccs2)cc1 ZINC000551814424 568251235 /nfs/dbraw/zinc/25/12/35/568251235.db2.gz ZPGSPLFVVZBFDE-ZDUSSCGKSA-N 1 0 360.429 5.262 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)ccn1 ZINC000551816852 568251517 /nfs/dbraw/zinc/25/15/17/568251517.db2.gz MFBDOZAMJWUFIE-INIZCTEOSA-N 1 0 373.230 5.231 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)ccn1 ZINC000551816853 568251464 /nfs/dbraw/zinc/25/14/64/568251464.db2.gz MFBDOZAMJWUFIE-MRXNPFEDSA-N 1 0 373.230 5.231 20 0 FKADRO COc1ccsc1[C@@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551817248 568251451 /nfs/dbraw/zinc/25/14/51/568251451.db2.gz PDQFAVCAIAXGAY-LLVKDONJSA-N 1 0 364.923 5.384 20 0 FKADRO COc1ccsc1[C@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551817249 568251471 /nfs/dbraw/zinc/25/14/71/568251471.db2.gz PDQFAVCAIAXGAY-NSHDSACASA-N 1 0 364.923 5.384 20 0 FKADRO CCOc1ccc(C[NH2+][C@H]2C[C@H](C)Sc3sccc32)cc1Cl ZINC000551817513 568251496 /nfs/dbraw/zinc/25/14/96/568251496.db2.gz KGOGRKFEMWKILK-NHYWBVRUSA-N 1 0 353.940 5.515 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)cc1Cl ZINC000551817518 568251438 /nfs/dbraw/zinc/25/14/38/568251438.db2.gz KGOGRKFEMWKILK-XHDPSFHLSA-N 1 0 353.940 5.515 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000551817549 568251442 /nfs/dbraw/zinc/25/14/42/568251442.db2.gz LCDYCCALPBKVAX-ACJLOTCBSA-N 1 0 370.324 5.199 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000551817550 568251449 /nfs/dbraw/zinc/25/14/49/568251449.db2.gz LCDYCCALPBKVAX-FZKQIMNGSA-N 1 0 370.324 5.199 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000551817551 568251461 /nfs/dbraw/zinc/25/14/61/568251461.db2.gz LCDYCCALPBKVAX-SCLBCKFNSA-N 1 0 370.324 5.199 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000551817552 568251498 /nfs/dbraw/zinc/25/14/98/568251498.db2.gz LCDYCCALPBKVAX-UGSOOPFHSA-N 1 0 370.324 5.199 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(Oc2cccc3ccccc32)c1)c1cnn(C)c1 ZINC000551817867 568251491 /nfs/dbraw/zinc/25/14/91/568251491.db2.gz LSKXOUJRZVQHDR-KRWDZBQOSA-N 1 0 357.457 5.216 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Oc2cccc3ccccc32)c1)c1cnn(C)c1 ZINC000551817868 568251468 /nfs/dbraw/zinc/25/14/68/568251468.db2.gz LSKXOUJRZVQHDR-QGZVFWFLSA-N 1 0 357.457 5.216 20 0 FKADRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)CCC2 ZINC000551818031 568251475 /nfs/dbraw/zinc/25/14/75/568251475.db2.gz SICQFQOOIQXWDZ-PMACEKPBSA-N 1 0 371.322 5.271 20 0 FKADRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)CCC2 ZINC000551818032 568251515 /nfs/dbraw/zinc/25/15/15/568251515.db2.gz SICQFQOOIQXWDZ-UXHICEINSA-N 1 0 371.322 5.271 20 0 FKADRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)CCC2 ZINC000551818033 568251488 /nfs/dbraw/zinc/25/14/88/568251488.db2.gz SICQFQOOIQXWDZ-VQTJNVASSA-N 1 0 371.322 5.271 20 0 FKADRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)CCC2 ZINC000551818034 568251484 /nfs/dbraw/zinc/25/14/84/568251484.db2.gz SICQFQOOIQXWDZ-WOJBJXKFSA-N 1 0 371.322 5.271 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1csc(Cl)c1 ZINC000551818518 568251453 /nfs/dbraw/zinc/25/14/53/568251453.db2.gz VMGJQPYBFAKSFU-BJOHPYRUSA-N 1 0 371.731 5.361 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1csc(Cl)c1 ZINC000551818519 568251445 /nfs/dbraw/zinc/25/14/45/568251445.db2.gz VMGJQPYBFAKSFU-PSLIRLAXSA-N 1 0 371.731 5.361 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1csc(Cl)c1 ZINC000551818520 568251473 /nfs/dbraw/zinc/25/14/73/568251473.db2.gz VMGJQPYBFAKSFU-RFAUZJTJSA-N 1 0 371.731 5.361 20 0 FKADRO C[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1csc(Cl)c1 ZINC000551818521 568251519 /nfs/dbraw/zinc/25/15/19/568251519.db2.gz VMGJQPYBFAKSFU-VFZGTOFNSA-N 1 0 371.731 5.361 20 0 FKADRO CC(C)C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1cccc(C(F)(F)F)c1 ZINC000551818526 568251457 /nfs/dbraw/zinc/25/14/57/568251457.db2.gz VNDUDXPKAOARIA-GOSISDBHSA-N 1 0 365.443 5.115 20 0 FKADRO CC(C)C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1cccc(C(F)(F)F)c1 ZINC000551818527 568251505 /nfs/dbraw/zinc/25/15/05/568251505.db2.gz VNDUDXPKAOARIA-SFHVURJKSA-N 1 0 365.443 5.115 20 0 FKADRO CCC(CC)[N@H+](Cc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1)C1CC1 ZINC000551922787 568252622 /nfs/dbraw/zinc/25/26/22/568252622.db2.gz ODFOVKKEVGYJLW-UHFFFAOYSA-N 1 0 367.518 5.217 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1ccc(Cl)c(F)c1 ZINC000552002189 568253877 /nfs/dbraw/zinc/25/38/77/568253877.db2.gz CIPILLBSLGLBKP-AWEZNQCLSA-N 1 0 374.887 5.459 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1ccc(Cl)c(F)c1 ZINC000552002190 568253855 /nfs/dbraw/zinc/25/38/55/568253855.db2.gz CIPILLBSLGLBKP-CQSZACIVSA-N 1 0 374.887 5.459 20 0 FKADRO C[C@H]([NH2+]Cc1ccc2occc2c1)c1ccc(OCc2cccnc2)cc1 ZINC000552013698 568256426 /nfs/dbraw/zinc/25/64/26/568256426.db2.gz RHWBTNWLICQAPK-KRWDZBQOSA-N 1 0 358.441 5.258 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc2occc2c1)c1ccc(OCc2cccnc2)cc1 ZINC000552013699 568256459 /nfs/dbraw/zinc/25/64/59/568256459.db2.gz RHWBTNWLICQAPK-QGZVFWFLSA-N 1 0 358.441 5.258 20 0 FKADRO CC(C)(C)c1ncc(C[NH+]2CCC(OCC3CCCCC3)CC2)s1 ZINC000552019729 568256606 /nfs/dbraw/zinc/25/66/06/568256606.db2.gz LUDBDBHNWZTJAC-UHFFFAOYSA-N 1 0 350.572 5.002 20 0 FKADRO FC(F)(F)Oc1cccc([C@@H]([NH2+]Cc2cnc(C3CC3)s2)C2CC2)c1 ZINC000552020406 568256612 /nfs/dbraw/zinc/25/66/12/568256612.db2.gz VPDXMALJANMYBR-INIZCTEOSA-N 1 0 368.424 5.160 20 0 FKADRO FC(F)(F)Oc1cccc([C@H]([NH2+]Cc2cnc(C3CC3)s2)C2CC2)c1 ZINC000552020407 568256616 /nfs/dbraw/zinc/25/66/16/568256616.db2.gz VPDXMALJANMYBR-MRXNPFEDSA-N 1 0 368.424 5.160 20 0 FKADRO CC[C@@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1cccc(C)c1 ZINC000552038084 568256647 /nfs/dbraw/zinc/25/66/47/568256647.db2.gz LWHKWPUFURWHQI-JOCHJYFZSA-N 1 0 350.506 5.365 20 0 FKADRO CC[C@H]([NH2+]Cc1cccc(NC(=O)C2CCCC2)c1)c1cccc(C)c1 ZINC000552038085 568256654 /nfs/dbraw/zinc/25/66/54/568256654.db2.gz LWHKWPUFURWHQI-QFIPXVFZSA-N 1 0 350.506 5.365 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)c1 ZINC000552040861 568256625 /nfs/dbraw/zinc/25/66/25/568256625.db2.gz BPIJQGGAQJINMP-IBGZPJMESA-N 1 0 368.484 5.094 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)c1 ZINC000552040862 568256657 /nfs/dbraw/zinc/25/66/57/568256657.db2.gz BPIJQGGAQJINMP-LJQANCHMSA-N 1 0 368.484 5.094 20 0 FKADRO CC[C@H](C)[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043528 568256680 /nfs/dbraw/zinc/25/66/80/568256680.db2.gz QLEIWDNWQLVCPG-DGCWBMGLSA-N 1 0 372.896 5.109 20 0 FKADRO CC[C@H](C)[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043529 568256645 /nfs/dbraw/zinc/25/66/45/568256645.db2.gz QLEIWDNWQLVCPG-PXIJXODZSA-N 1 0 372.896 5.109 20 0 FKADRO CC[C@H](C)[C@H]([NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043530 568256671 /nfs/dbraw/zinc/25/66/71/568256671.db2.gz QLEIWDNWQLVCPG-QTCYRWPVSA-N 1 0 372.896 5.109 20 0 FKADRO CC[C@H](C)[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043531 568256649 /nfs/dbraw/zinc/25/66/49/568256649.db2.gz QLEIWDNWQLVCPG-RXSFTSLZSA-N 1 0 372.896 5.109 20 0 FKADRO CC(C)C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043572 568256677 /nfs/dbraw/zinc/25/66/77/568256677.db2.gz SOGOAZPSRPXCSR-AUUYWEPGSA-N 1 0 372.896 5.109 20 0 FKADRO CC(C)C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043573 568256659 /nfs/dbraw/zinc/25/66/59/568256659.db2.gz SOGOAZPSRPXCSR-IFXJQAMLSA-N 1 0 372.896 5.109 20 0 FKADRO CC(C)C[C@H]([NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043574 568256683 /nfs/dbraw/zinc/25/66/83/568256683.db2.gz SOGOAZPSRPXCSR-KUHUBIRLSA-N 1 0 372.896 5.109 20 0 FKADRO CC(C)C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(Cl)cc1 ZINC000552043575 568256621 /nfs/dbraw/zinc/25/66/21/568256621.db2.gz SOGOAZPSRPXCSR-LIRRHRJNSA-N 1 0 372.896 5.109 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000552047270 568254348 /nfs/dbraw/zinc/25/43/48/568254348.db2.gz GGDGDLFMSRADAK-CABCVRRESA-N 1 0 366.486 5.009 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000552047271 568254367 /nfs/dbraw/zinc/25/43/67/568254367.db2.gz GGDGDLFMSRADAK-GJZGRUSLSA-N 1 0 366.486 5.009 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000552047272 568254332 /nfs/dbraw/zinc/25/43/32/568254332.db2.gz GGDGDLFMSRADAK-HUUCEWRRSA-N 1 0 366.486 5.009 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000552047273 568254373 /nfs/dbraw/zinc/25/43/73/568254373.db2.gz GGDGDLFMSRADAK-LSDHHAIUSA-N 1 0 366.486 5.009 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+]Cc2ccc(OC(C)C)cc2C(F)(F)F)c1 ZINC000552049225 568254603 /nfs/dbraw/zinc/25/46/03/568254603.db2.gz QPMKEDQDNJCGGO-AWEZNQCLSA-N 1 0 352.400 5.047 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(OC(C)C)cc2C(F)(F)F)c1 ZINC000552049226 568254647 /nfs/dbraw/zinc/25/46/47/568254647.db2.gz QPMKEDQDNJCGGO-CQSZACIVSA-N 1 0 352.400 5.047 20 0 FKADRO CC(C)(C)OCc1cccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000552049622 568254682 /nfs/dbraw/zinc/25/46/82/568254682.db2.gz ZUTHBTXNTHKXFP-FQEVSTJZSA-N 1 0 355.526 5.136 20 0 FKADRO CC(C)(C)OCc1cccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000552049623 568254678 /nfs/dbraw/zinc/25/46/78/568254678.db2.gz ZUTHBTXNTHKXFP-HXUWFJFHSA-N 1 0 355.526 5.136 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1cc(C)ccn1)c1ccc(Cl)c(Cl)c1 ZINC000552055050 568255096 /nfs/dbraw/zinc/25/50/96/568255096.db2.gz YVVUVBMNOFZFII-CXAGYDPISA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1cc(C)ccn1)c1ccc(Cl)c(Cl)c1 ZINC000552055051 568255114 /nfs/dbraw/zinc/25/51/14/568255114.db2.gz YVVUVBMNOFZFII-DYVFJYSZSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1cc(C)ccn1)c1ccc(Cl)c(Cl)c1 ZINC000552055052 568255133 /nfs/dbraw/zinc/25/51/33/568255133.db2.gz YVVUVBMNOFZFII-GUYCJALGSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1cc(C)ccn1)c1ccc(Cl)c(Cl)c1 ZINC000552055053 568255137 /nfs/dbraw/zinc/25/51/37/568255137.db2.gz YVVUVBMNOFZFII-SUMWQHHRSA-N 1 0 353.293 5.125 20 0 FKADRO CCOc1c(Cl)cc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)cc1OC ZINC000552060182 568255203 /nfs/dbraw/zinc/25/52/03/568255203.db2.gz JWRHDQWYBDCZMF-GFCCVEGCSA-N 1 0 368.930 5.014 20 0 FKADRO CCOc1c(Cl)cc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)cc1OC ZINC000552060185 568255193 /nfs/dbraw/zinc/25/51/93/568255193.db2.gz JWRHDQWYBDCZMF-LBPRGKRZSA-N 1 0 368.930 5.014 20 0 FKADRO CC[C@H](NCc1nc(C2CC2)cs1)c1ccc(OC(F)(F)F)cc1 ZINC000552062213 568255197 /nfs/dbraw/zinc/25/51/97/568255197.db2.gz PYSACVRNYHEVCA-AWEZNQCLSA-N 1 0 356.413 5.160 20 0 FKADRO CC[C@@H](NCc1nc(C2CC2)cs1)c1ccc(OC(F)(F)F)cc1 ZINC000552062214 568255166 /nfs/dbraw/zinc/25/51/66/568255166.db2.gz PYSACVRNYHEVCA-CQSZACIVSA-N 1 0 356.413 5.160 20 0 FKADRO CCc1cnccc1[C@@H](C)[NH2+][C@H](CC)c1ccc(OC(F)(F)F)cc1 ZINC000552063111 568255232 /nfs/dbraw/zinc/25/52/32/568255232.db2.gz PHBHRFBNTJPNCD-FZKQIMNGSA-N 1 0 352.400 5.345 20 0 FKADRO CCc1cnccc1[C@H](C)[NH2+][C@H](CC)c1ccc(OC(F)(F)F)cc1 ZINC000552063112 568255223 /nfs/dbraw/zinc/25/52/23/568255223.db2.gz PHBHRFBNTJPNCD-SCLBCKFNSA-N 1 0 352.400 5.345 20 0 FKADRO CCc1cnccc1[C@H](C)[NH2+][C@@H](CC)c1ccc(OC(F)(F)F)cc1 ZINC000552063113 568255266 /nfs/dbraw/zinc/25/52/66/568255266.db2.gz PHBHRFBNTJPNCD-UGSOOPFHSA-N 1 0 352.400 5.345 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)c(C)c1OC ZINC000552063568 568255268 /nfs/dbraw/zinc/25/52/68/568255268.db2.gz CXYWTYUXQUPWJF-RDTXWAMCSA-N 1 0 373.468 5.104 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c(C)c1OC ZINC000552066806 568255285 /nfs/dbraw/zinc/25/52/85/568255285.db2.gz SFGSKRVOLDJUBB-PBHICJAKSA-N 1 0 367.411 5.009 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]C[C@H](c2ccccc2)C(F)(F)F)c(C)c1OC ZINC000552066810 568255351 /nfs/dbraw/zinc/25/53/51/568255351.db2.gz SFGSKRVOLDJUBB-RHSMWYFYSA-N 1 0 367.411 5.009 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@H](c2ccccc2)C(F)(F)F)c(C)c1OC ZINC000552066811 568255329 /nfs/dbraw/zinc/25/53/29/568255329.db2.gz SFGSKRVOLDJUBB-WMLDXEAASA-N 1 0 367.411 5.009 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c(C)c1OC ZINC000552066812 568255321 /nfs/dbraw/zinc/25/53/21/568255321.db2.gz SFGSKRVOLDJUBB-YOEHRIQHSA-N 1 0 367.411 5.009 20 0 FKADRO c1c[nH]c([C@H]([NH2+]CC2(CCOCc3ccccc3)CC2)C2CCCCC2)n1 ZINC000552067300 568255334 /nfs/dbraw/zinc/25/53/34/568255334.db2.gz GBFDCYCONISPNR-OAQYLSRUSA-N 1 0 367.537 5.008 20 0 FKADRO COC(=O)c1csc([C@H](C)NC2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000552070260 568255345 /nfs/dbraw/zinc/25/53/45/568255345.db2.gz GFIXZMYKBGRHAR-JTQLQIEISA-N 1 0 370.301 5.181 20 0 FKADRO COC(=O)c1csc([C@@H](C)NC2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000552070261 568255303 /nfs/dbraw/zinc/25/53/03/568255303.db2.gz GFIXZMYKBGRHAR-SNVBAGLBSA-N 1 0 370.301 5.181 20 0 FKADRO CC(=O)N(c1nc(CN2CC(C)(C)[C@@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072013 568255331 /nfs/dbraw/zinc/25/53/31/568255331.db2.gz OUFJPVIHGJMNCP-IBGZPJMESA-N 1 0 371.550 5.003 20 0 FKADRO CC(=O)N(c1nc(CN2CC(C)(C)[C@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072014 568255337 /nfs/dbraw/zinc/25/53/37/568255337.db2.gz OUFJPVIHGJMNCP-LJQANCHMSA-N 1 0 371.550 5.003 20 0 FKADRO CCOc1cc(C[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc(Cl)c1O ZINC000552073464 568255360 /nfs/dbraw/zinc/25/53/60/568255360.db2.gz DKJGNOFNWFLTJW-LLVKDONJSA-N 1 0 373.802 5.314 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc(Cl)c1O ZINC000552073465 568255383 /nfs/dbraw/zinc/25/53/83/568255383.db2.gz DKJGNOFNWFLTJW-NSHDSACASA-N 1 0 373.802 5.314 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)c3ccc(Br)cc3F)ccc2[nH]1 ZINC000552073580 568255412 /nfs/dbraw/zinc/25/54/12/568255412.db2.gz JGYPITMPFFESCF-GFCCVEGCSA-N 1 0 361.258 5.229 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)c3ccc(Br)cc3F)ccc2[nH]1 ZINC000552073581 568255409 /nfs/dbraw/zinc/25/54/09/568255409.db2.gz JGYPITMPFFESCF-LBPRGKRZSA-N 1 0 361.258 5.229 20 0 FKADRO COc1ccc([C@H]([NH2+]Cc2ccc3[nH]c(C)cc3c2)c2ccccc2)cc1 ZINC000552074227 568255672 /nfs/dbraw/zinc/25/56/72/568255672.db2.gz GLNHEMKVMMAWIE-XMMPIXPASA-N 1 0 356.469 5.364 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3[nH]c(C)cc3c1)CCCS2 ZINC000552074739 568255679 /nfs/dbraw/zinc/25/56/79/568255679.db2.gz ZDQZNOKVWSANOF-FQEVSTJZSA-N 1 0 352.503 5.202 20 0 FKADRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3[nH]c(C)cc3c1)CCCS2 ZINC000552074740 568255693 /nfs/dbraw/zinc/25/56/93/568255693.db2.gz ZDQZNOKVWSANOF-HXUWFJFHSA-N 1 0 352.503 5.202 20 0 FKADRO CC[C@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000552085749 568255760 /nfs/dbraw/zinc/25/57/60/568255760.db2.gz LPDNMSHBXNSEFF-OALUTQOASA-N 1 0 367.489 5.191 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000552085750 568255764 /nfs/dbraw/zinc/25/57/64/568255764.db2.gz LPDNMSHBXNSEFF-RBUKOAKNSA-N 1 0 367.489 5.191 20 0 FKADRO CC[C@@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000552085751 568255838 /nfs/dbraw/zinc/25/58/38/568255838.db2.gz LPDNMSHBXNSEFF-RTBURBONSA-N 1 0 367.489 5.191 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@H](CC)c2ccc(OC)c(OC)c2)cc1 ZINC000552086122 568255858 /nfs/dbraw/zinc/25/58/58/568255858.db2.gz YKECFAPXLNOBCP-OXQOHEQNSA-N 1 0 357.494 5.295 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@@H](CC)c2ccc(OC)c(OC)c2)cc1 ZINC000552086123 568255848 /nfs/dbraw/zinc/25/58/48/568255848.db2.gz YKECFAPXLNOBCP-UZLBHIALSA-N 1 0 357.494 5.295 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1cccc(-c2ccccc2)c1 ZINC000552086159 568255854 /nfs/dbraw/zinc/25/58/54/568255854.db2.gz ZOFHDGHOSVIADM-DWXRJYCRSA-N 1 0 363.526 5.083 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1cccc(-c2ccccc2)c1 ZINC000552086160 568255902 /nfs/dbraw/zinc/25/59/02/568255902.db2.gz ZOFHDGHOSVIADM-HFJWLAOPSA-N 1 0 363.526 5.083 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1cccc(-c2ccccc2)c1 ZINC000552086161 568255877 /nfs/dbraw/zinc/25/58/77/568255877.db2.gz ZOFHDGHOSVIADM-QYBDOPJKSA-N 1 0 363.526 5.083 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1cccc(-c2ccccc2)c1 ZINC000552086162 568255872 /nfs/dbraw/zinc/25/58/72/568255872.db2.gz ZOFHDGHOSVIADM-WXTAPIANSA-N 1 0 363.526 5.083 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)cc1 ZINC000552086363 568255831 /nfs/dbraw/zinc/25/58/31/568255831.db2.gz FFNHUDPABVZWKI-KRWDZBQOSA-N 1 0 353.462 5.007 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](C)c2oc3ccccc3c2C)cc1 ZINC000552086364 568255868 /nfs/dbraw/zinc/25/58/68/568255868.db2.gz FFNHUDPABVZWKI-QGZVFWFLSA-N 1 0 353.462 5.007 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1)c1ccc(OC)c(OC)c1 ZINC000552086581 568255860 /nfs/dbraw/zinc/25/58/60/568255860.db2.gz KPDBAHRCMKHRGZ-AABGKKOBSA-N 1 0 368.521 5.174 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1)c1ccc(OC)c(OC)c1 ZINC000552086582 568255866 /nfs/dbraw/zinc/25/58/66/568255866.db2.gz KPDBAHRCMKHRGZ-AQNXPRMDSA-N 1 0 368.521 5.174 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCC[C@H](c2ncccc2C)C1)c1ccc(OC)c(OC)c1 ZINC000552086583 568255846 /nfs/dbraw/zinc/25/58/46/568255846.db2.gz KPDBAHRCMKHRGZ-UFYCRDLUSA-N 1 0 368.521 5.174 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1)c1ccc(OC)c(OC)c1 ZINC000552086584 568255906 /nfs/dbraw/zinc/25/59/06/568255906.db2.gz KPDBAHRCMKHRGZ-ZCNNSNEGSA-N 1 0 368.521 5.174 20 0 FKADRO COCCC[C@@H](C[NH2+]C1CCC(C(F)F)CC1)c1ccc(Cl)cc1 ZINC000552086670 568255835 /nfs/dbraw/zinc/25/58/35/568255835.db2.gz MVCKCSDSABGETG-PQUAAJSLSA-N 1 0 359.888 5.264 20 0 FKADRO COCCC[C@H](C[NH2+]C1CCC(C(F)F)CC1)c1ccc(Cl)cc1 ZINC000552086671 568255841 /nfs/dbraw/zinc/25/58/41/568255841.db2.gz MVCKCSDSABGETG-UPTPFMHGSA-N 1 0 359.888 5.264 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H]3CCc4ccc(Br)cc43)ccc2[nH]1 ZINC000552086729 568255904 /nfs/dbraw/zinc/25/59/04/568255904.db2.gz OPYILLIPVNQLPQ-IBGZPJMESA-N 1 0 355.279 5.016 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H]3CCc4ccc(Br)cc43)ccc2[nH]1 ZINC000552086730 568255886 /nfs/dbraw/zinc/25/58/86/568255886.db2.gz OPYILLIPVNQLPQ-LJQANCHMSA-N 1 0 355.279 5.016 20 0 FKADRO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccc(Oc2ccccc2)c(F)c1 ZINC000552086794 568255875 /nfs/dbraw/zinc/25/58/75/568255875.db2.gz QJCHNYUIFKWIJS-INIZCTEOSA-N 1 0 361.420 5.117 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000552086877 568255856 /nfs/dbraw/zinc/25/58/56/568255856.db2.gz SWCSRDWLJJYEQA-BFUOFWGJSA-N 1 0 371.937 5.604 20 0 FKADRO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000552086878 568255954 /nfs/dbraw/zinc/25/59/54/568255954.db2.gz SWCSRDWLJJYEQA-DJJJIMSYSA-N 1 0 371.937 5.604 20 0 FKADRO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000552086879 568255963 /nfs/dbraw/zinc/25/59/63/568255963.db2.gz SWCSRDWLJJYEQA-ORAYPTAESA-N 1 0 371.937 5.604 20 0 FKADRO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000552086880 568255928 /nfs/dbraw/zinc/25/59/28/568255928.db2.gz SWCSRDWLJJYEQA-YJYMSZOUSA-N 1 0 371.937 5.604 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H]3CCCc4ncc(C(F)(F)F)cc43)ccc2[nH]1 ZINC000552087535 568255974 /nfs/dbraw/zinc/25/59/74/568255974.db2.gz KOXOYFZKGRCDIE-GOSISDBHSA-N 1 0 359.395 5.057 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H]3CCCc4ncc(C(F)(F)F)cc43)ccc2[nH]1 ZINC000552087536 568255931 /nfs/dbraw/zinc/25/59/31/568255931.db2.gz KOXOYFZKGRCDIE-SFHVURJKSA-N 1 0 359.395 5.057 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000552087557 568255970 /nfs/dbraw/zinc/25/59/70/568255970.db2.gz LALMUOBSNQAGLE-BFUOFWGJSA-N 1 0 355.482 5.090 20 0 FKADRO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000552087558 568255972 /nfs/dbraw/zinc/25/59/72/568255972.db2.gz LALMUOBSNQAGLE-DJJJIMSYSA-N 1 0 355.482 5.090 20 0 FKADRO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000552087559 568255950 /nfs/dbraw/zinc/25/59/50/568255950.db2.gz LALMUOBSNQAGLE-ORAYPTAESA-N 1 0 355.482 5.090 20 0 FKADRO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000552087560 568255959 /nfs/dbraw/zinc/25/59/59/568255959.db2.gz LALMUOBSNQAGLE-YJYMSZOUSA-N 1 0 355.482 5.090 20 0 FKADRO Cc1ccc([C@@H]([NH2+]Cc2ccc(C[S@](C)=O)cc2)C2CCCCC2)cc1 ZINC000552087915 568255956 /nfs/dbraw/zinc/25/59/56/568255956.db2.gz WRMXHVUGNFKGNG-OZXSUGGESA-N 1 0 369.574 5.285 20 0 FKADRO Cc1ccc([C@H]([NH2+]Cc2ccc(C[S@@](C)=O)cc2)C2CCCCC2)cc1 ZINC000552087916 568255961 /nfs/dbraw/zinc/25/59/61/568255961.db2.gz WRMXHVUGNFKGNG-ZEQKJWHPSA-N 1 0 369.574 5.285 20 0 FKADRO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccc(SC2CCCC2)cc1 ZINC000552088159 568255909 /nfs/dbraw/zinc/25/59/09/568255909.db2.gz BKHHNWCEDJBMRD-INIZCTEOSA-N 1 0 351.519 5.220 20 0 FKADRO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccc(SC2CCCC2)cc1 ZINC000552088160 568255943 /nfs/dbraw/zinc/25/59/43/568255943.db2.gz BKHHNWCEDJBMRD-MRXNPFEDSA-N 1 0 351.519 5.220 20 0 FKADRO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccc(-c2ccccc2F)s1 ZINC000552088736 568256048 /nfs/dbraw/zinc/25/60/48/568256048.db2.gz QWTRELAUOHABDX-AWEZNQCLSA-N 1 0 351.450 5.053 20 0 FKADRO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccc(-c2ccccc2F)s1 ZINC000552088737 568255988 /nfs/dbraw/zinc/25/59/88/568255988.db2.gz QWTRELAUOHABDX-CQSZACIVSA-N 1 0 351.450 5.053 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1cnc2ccsc2c1)c1ccc(OC)c(OC)c1 ZINC000552088845 568255994 /nfs/dbraw/zinc/25/59/94/568255994.db2.gz UFRSUSVATUYWNX-BBRMVZONSA-N 1 0 356.491 5.115 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cnc2ccsc2c1)c1ccc(OC)c(OC)c1 ZINC000552088846 568256032 /nfs/dbraw/zinc/25/60/32/568256032.db2.gz UFRSUSVATUYWNX-CJNGLKHVSA-N 1 0 356.491 5.115 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1cnc2ccsc2c1)c1ccc(OC)c(OC)c1 ZINC000552088847 568256053 /nfs/dbraw/zinc/25/60/53/568256053.db2.gz UFRSUSVATUYWNX-CZUORRHYSA-N 1 0 356.491 5.115 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cnc2ccsc2c1)c1ccc(OC)c(OC)c1 ZINC000552088848 568256039 /nfs/dbraw/zinc/25/60/39/568256039.db2.gz UFRSUSVATUYWNX-XJKSGUPXSA-N 1 0 356.491 5.115 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000552088977 568256020 /nfs/dbraw/zinc/25/60/20/568256020.db2.gz YDMUNYXFOLZGIK-GFCCVEGCSA-N 1 0 373.415 5.340 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000552088978 568255998 /nfs/dbraw/zinc/25/59/98/568255998.db2.gz YDMUNYXFOLZGIK-LBPRGKRZSA-N 1 0 373.415 5.340 20 0 FKADRO CC[C@H]([NH2+]C[C@@H](CCCOC)c1ccc(Cl)cc1)c1ccc(F)cn1 ZINC000552089166 568256088 /nfs/dbraw/zinc/25/60/88/568256088.db2.gz BYDRMOUKMONDGK-APWZRJJASA-N 1 0 364.892 5.125 20 0 FKADRO CC[C@H]([NH2+]C[C@H](CCCOC)c1ccc(Cl)cc1)c1ccc(F)cn1 ZINC000552089167 568256068 /nfs/dbraw/zinc/25/60/68/568256068.db2.gz BYDRMOUKMONDGK-LPHOPBHVSA-N 1 0 364.892 5.125 20 0 FKADRO CC[C@@H]([NH2+]C[C@H](CCCOC)c1ccc(Cl)cc1)c1ccc(F)cn1 ZINC000552089168 568256104 /nfs/dbraw/zinc/25/61/04/568256104.db2.gz BYDRMOUKMONDGK-QFBILLFUSA-N 1 0 364.892 5.125 20 0 FKADRO CC[C@@H]([NH2+]C[C@@H](CCCOC)c1ccc(Cl)cc1)c1ccc(F)cn1 ZINC000552089169 568256055 /nfs/dbraw/zinc/25/60/55/568256055.db2.gz BYDRMOUKMONDGK-VQIMIIECSA-N 1 0 364.892 5.125 20 0 FKADRO Cc1c([C@@H](C)Nc2ccc([NH+]3CCCCCC3)cc2C)cnn1C(C)C ZINC000552089509 568256635 /nfs/dbraw/zinc/25/66/35/568256635.db2.gz LZQHOOZGLXJGMD-GOSISDBHSA-N 1 0 354.542 5.634 20 0 FKADRO Cc1c([C@H](C)Nc2ccc([NH+]3CCCCCC3)cc2C)cnn1C(C)C ZINC000552089510 568256663 /nfs/dbraw/zinc/25/66/63/568256663.db2.gz LZQHOOZGLXJGMD-SFHVURJKSA-N 1 0 354.542 5.634 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)cc1 ZINC000552089861 568255125 /nfs/dbraw/zinc/25/51/25/568255125.db2.gz XOILUHLRXBSRRH-QGZVFWFLSA-N 1 0 353.462 5.007 20 0 FKADRO CCOc1ccc([C@H](CC)[NH2+]C2(c3cccc(OC)c3)CC2)cc1OCC ZINC000552090086 568255168 /nfs/dbraw/zinc/25/51/68/568255168.db2.gz AAIDFMWSGQJRRE-FQEVSTJZSA-N 1 0 369.505 5.223 20 0 FKADRO CCOc1ccc([C@@H](CC)[NH2+]C2(c3cccc(OC)c3)CC2)cc1OCC ZINC000552090087 568255201 /nfs/dbraw/zinc/25/52/01/568255201.db2.gz AAIDFMWSGQJRRE-HXUWFJFHSA-N 1 0 369.505 5.223 20 0 FKADRO CC[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(Cl)cc1Cl ZINC000552090141 568255209 /nfs/dbraw/zinc/25/52/09/568255209.db2.gz BULYYTCHIYKZNA-FDDCHVKYSA-N 1 0 370.345 5.113 20 0 FKADRO CC[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(Cl)cc1Cl ZINC000552090142 568255164 /nfs/dbraw/zinc/25/51/64/568255164.db2.gz BULYYTCHIYKZNA-JPYJTQIMSA-N 1 0 370.345 5.113 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(Oc2ccc3ccccc3c2)c1)c1ccnn1C ZINC000552090179 568255282 /nfs/dbraw/zinc/25/52/82/568255282.db2.gz CSSCNVQSOPGXMD-KRWDZBQOSA-N 1 0 357.457 5.216 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Oc2ccc3ccccc3c2)c1)c1ccnn1C ZINC000552090180 568255252 /nfs/dbraw/zinc/25/52/52/568255252.db2.gz CSSCNVQSOPGXMD-QGZVFWFLSA-N 1 0 357.457 5.216 20 0 FKADRO CCC[C@H]([NH2+]Cc1ccncc1OCc1ccccc1)c1ccsc1 ZINC000552090220 568255263 /nfs/dbraw/zinc/25/52/63/568255263.db2.gz DYRQVTCMKBJYID-FQEVSTJZSA-N 1 0 352.503 5.353 20 0 FKADRO CCC[C@@H]([NH2+]Cc1ccncc1OCc1ccccc1)c1ccsc1 ZINC000552090221 568255229 /nfs/dbraw/zinc/25/52/29/568255229.db2.gz DYRQVTCMKBJYID-HXUWFJFHSA-N 1 0 352.503 5.353 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(Cl)cn1 ZINC000552090232 568255238 /nfs/dbraw/zinc/25/52/38/568255238.db2.gz FEIUMICQEOHYKJ-APPDUMDISA-N 1 0 370.802 5.436 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(Cl)cn1 ZINC000552090233 568255270 /nfs/dbraw/zinc/25/52/70/568255270.db2.gz FEIUMICQEOHYKJ-DIFFPNOSSA-N 1 0 370.802 5.436 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(Cl)cn1 ZINC000552090234 568255273 /nfs/dbraw/zinc/25/52/73/568255273.db2.gz FEIUMICQEOHYKJ-GTNSWQLSSA-N 1 0 370.802 5.436 20 0 FKADRO C[C@H]([NH2+]Cc1ccncc1OCc1ccccc1)c1cc2c(s1)CCC2 ZINC000552090337 568255452 /nfs/dbraw/zinc/25/54/52/568255452.db2.gz HFLGOULTIQGEFU-INIZCTEOSA-N 1 0 364.514 5.062 20 0 FKADRO C[C@@H]([NH2+]Cc1ccncc1OCc1ccccc1)c1cc2c(s1)CCC2 ZINC000552090338 568255625 /nfs/dbraw/zinc/25/56/25/568255625.db2.gz HFLGOULTIQGEFU-MRXNPFEDSA-N 1 0 364.514 5.062 20 0 FKADRO CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@H](C)c1cnn(C2CCCC2)c1 ZINC000552090786 568257452 /nfs/dbraw/zinc/25/74/52/568257452.db2.gz UPKIELOQAXJQRH-NNYHOXTNSA-N 1 0 367.537 5.000 20 0 FKADRO CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1[NH2+][C@H](C)c1cnn(C2CCCC2)c1 ZINC000552090787 568257487 /nfs/dbraw/zinc/25/74/87/568257487.db2.gz UPKIELOQAXJQRH-VASINYHSSA-N 1 0 367.537 5.000 20 0 FKADRO CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@@H](C)c1cnn(C2CCCC2)c1 ZINC000552090788 568257579 /nfs/dbraw/zinc/25/75/79/568257579.db2.gz UPKIELOQAXJQRH-WTYSZDEDSA-N 1 0 367.537 5.000 20 0 FKADRO Cc1ccncc1[C@@H](C)[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552090912 568257654 /nfs/dbraw/zinc/25/76/54/568257654.db2.gz XHLXASFOMYFOCD-ACJLOTCBSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552090913 568257667 /nfs/dbraw/zinc/25/76/67/568257667.db2.gz XHLXASFOMYFOCD-FZKQIMNGSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccncc1[C@H](C)[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552090914 568257700 /nfs/dbraw/zinc/25/77/00/568257700.db2.gz XHLXASFOMYFOCD-SCLBCKFNSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccncc1[C@H](C)[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552090915 568257706 /nfs/dbraw/zinc/25/77/06/568257706.db2.gz XHLXASFOMYFOCD-UGSOOPFHSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000552091195 568257712 /nfs/dbraw/zinc/25/77/12/568257712.db2.gz DVUCVPGFMCXBAQ-KRWDZBQOSA-N 1 0 365.546 5.029 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000552091196 568257697 /nfs/dbraw/zinc/25/76/97/568257697.db2.gz DVUCVPGFMCXBAQ-QGZVFWFLSA-N 1 0 365.546 5.029 20 0 FKADRO CC[C@H]([NH2+]Cc1c(F)cccc1N1CCCC1)c1ccc(Cl)s1 ZINC000552091276 568257764 /nfs/dbraw/zinc/25/77/64/568257764.db2.gz HFWWGMUMASZUCK-HNNXBMFYSA-N 1 0 352.906 5.382 20 0 FKADRO CC[C@@H]([NH2+]Cc1c(F)cccc1N1CCCC1)c1ccc(Cl)s1 ZINC000552091277 568257748 /nfs/dbraw/zinc/25/77/48/568257748.db2.gz HFWWGMUMASZUCK-OAHLLOKOSA-N 1 0 352.906 5.382 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)c3sc(-c4ccccc4)nc3C)ccc2[nH]1 ZINC000552091365 568257731 /nfs/dbraw/zinc/25/77/31/568257731.db2.gz KHMSZICPTIQWBT-HNNXBMFYSA-N 1 0 361.514 5.759 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)c3sc(-c4ccccc4)nc3C)ccc2[nH]1 ZINC000552091366 568257720 /nfs/dbraw/zinc/25/77/20/568257720.db2.gz KHMSZICPTIQWBT-OAHLLOKOSA-N 1 0 361.514 5.759 20 0 FKADRO COCCC[C@H](C[NH2+][C@H](C)Cc1ccsc1)c1ccc(Cl)cc1 ZINC000552091607 568257718 /nfs/dbraw/zinc/25/77/18/568257718.db2.gz TVWZWOVTPKKACE-CRAIPNDOSA-N 1 0 351.943 5.133 20 0 FKADRO COCCC[C@H](C[NH2+][C@@H](C)Cc1ccsc1)c1ccc(Cl)cc1 ZINC000552091608 568257792 /nfs/dbraw/zinc/25/77/92/568257792.db2.gz TVWZWOVTPKKACE-MAUKXSAKSA-N 1 0 351.943 5.133 20 0 FKADRO COCCC[C@@H](C[NH2+][C@H](C)Cc1ccsc1)c1ccc(Cl)cc1 ZINC000552091609 568257793 /nfs/dbraw/zinc/25/77/93/568257793.db2.gz TVWZWOVTPKKACE-QAPCUYQASA-N 1 0 351.943 5.133 20 0 FKADRO COCCC[C@@H](C[NH2+][C@@H](C)Cc1ccsc1)c1ccc(Cl)cc1 ZINC000552091610 568257737 /nfs/dbraw/zinc/25/77/37/568257737.db2.gz TVWZWOVTPKKACE-YJBOKZPZSA-N 1 0 351.943 5.133 20 0 FKADRO CC(=O)Nc1ccc([C@H](C)Nc2ccc([NH+]3CCCCCC3)cc2C)cc1 ZINC000552091824 568257722 /nfs/dbraw/zinc/25/77/22/568257722.db2.gz ZZYVCBXVIFZOIS-SFHVURJKSA-N 1 0 365.521 5.507 20 0 FKADRO C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000552091933 568257740 /nfs/dbraw/zinc/25/77/40/568257740.db2.gz BQIUYBZCXXNOSA-NEPJUHHUSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1)c1c(F)cncc1F ZINC000552091934 568257771 /nfs/dbraw/zinc/25/77/71/568257771.db2.gz BQIUYBZCXXNOSA-NWDGAFQWSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000552091935 568257754 /nfs/dbraw/zinc/25/77/54/568257754.db2.gz BQIUYBZCXXNOSA-RYUDHWBXSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H](C)c1c(F)cncc1F ZINC000552091936 568257738 /nfs/dbraw/zinc/25/77/38/568257738.db2.gz BQIUYBZCXXNOSA-VXGBXAGGSA-N 1 0 358.354 5.051 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC1(C(F)(F)F)CC1 ZINC000552096110 568257854 /nfs/dbraw/zinc/25/78/54/568257854.db2.gz QNZFESZFLZEZOO-GFCCVEGCSA-N 1 0 354.441 5.035 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC1(C(F)(F)F)CC1 ZINC000552096111 568257860 /nfs/dbraw/zinc/25/78/60/568257860.db2.gz QNZFESZFLZEZOO-LBPRGKRZSA-N 1 0 354.441 5.035 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1cccc(OCc2ccccc2)c1 ZINC000552096876 568257822 /nfs/dbraw/zinc/25/78/22/568257822.db2.gz MJPVPWLFIDHMIA-MSOLQXFVSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cccc(OCc2ccccc2)c1)c1ccc2n[nH]cc2c1 ZINC000552096877 568257877 /nfs/dbraw/zinc/25/78/77/568257877.db2.gz MJPVPWLFIDHMIA-QZTJIDSGSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccc2n[nH]cc2c1 ZINC000552096878 568257815 /nfs/dbraw/zinc/25/78/15/568257815.db2.gz MJPVPWLFIDHMIA-ROUUACIJSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccc2n[nH]cc2c1 ZINC000552096879 568257881 /nfs/dbraw/zinc/25/78/81/568257881.db2.gz MJPVPWLFIDHMIA-ZWKOTPCHSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCCc2cc(Br)ccc21)c1ccc2n[nH]cc2c1 ZINC000552097003 568257809 /nfs/dbraw/zinc/25/78/09/568257809.db2.gz PSYCRZKCPULZKX-BLVKFPJESA-N 1 0 370.294 5.054 20 0 FKADRO C[C@H]([NH2+][C@H]1CCCc2cc(Br)ccc21)c1ccc2n[nH]cc2c1 ZINC000552097004 568257813 /nfs/dbraw/zinc/25/78/13/568257813.db2.gz PSYCRZKCPULZKX-BUXKBTBVSA-N 1 0 370.294 5.054 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCCc2cc(Br)ccc21)c1ccc2n[nH]cc2c1 ZINC000552097005 568257803 /nfs/dbraw/zinc/25/78/03/568257803.db2.gz PSYCRZKCPULZKX-CWTRNNRKSA-N 1 0 370.294 5.054 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCCc2cc(Br)ccc21)c1ccc2n[nH]cc2c1 ZINC000552097006 568257805 /nfs/dbraw/zinc/25/78/05/568257805.db2.gz PSYCRZKCPULZKX-HXPMCKFVSA-N 1 0 370.294 5.054 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(OCc2ccccc2)cc1 ZINC000552097199 568257863 /nfs/dbraw/zinc/25/78/63/568257863.db2.gz WHWVIASHMXBQHB-MSOLQXFVSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc2n[nH]cc2c1)c1ccc(OCc2ccccc2)cc1 ZINC000552097200 568257825 /nfs/dbraw/zinc/25/78/25/568257825.db2.gz WHWVIASHMXBQHB-QZTJIDSGSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(OCc2ccccc2)cc1 ZINC000552097201 568257874 /nfs/dbraw/zinc/25/78/74/568257874.db2.gz WHWVIASHMXBQHB-ROUUACIJSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1)c1ccc2n[nH]cc2c1 ZINC000552097202 568257865 /nfs/dbraw/zinc/25/78/65/568257865.db2.gz WHWVIASHMXBQHB-ZWKOTPCHSA-N 1 0 371.484 5.554 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc2n[nH]cc2c1)c1ccc(SCC(F)F)cc1 ZINC000552097238 568257819 /nfs/dbraw/zinc/25/78/19/568257819.db2.gz XOKJKWCNHZDIBR-CHWSQXEVSA-N 1 0 361.461 5.332 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(SCC(F)F)cc1 ZINC000552097239 568257811 /nfs/dbraw/zinc/25/78/11/568257811.db2.gz XOKJKWCNHZDIBR-OLZOCXBDSA-N 1 0 361.461 5.332 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)F)cc1)c1ccc2n[nH]cc2c1 ZINC000552097240 568257841 /nfs/dbraw/zinc/25/78/41/568257841.db2.gz XOKJKWCNHZDIBR-QWHCGFSZSA-N 1 0 361.461 5.332 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(SCC(F)F)cc1 ZINC000552097241 568257834 /nfs/dbraw/zinc/25/78/34/568257834.db2.gz XOKJKWCNHZDIBR-STQMWFEESA-N 1 0 361.461 5.332 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc2n[nH]cc2c1 ZINC000552097466 568257856 /nfs/dbraw/zinc/25/78/56/568257856.db2.gz CNDPKRIAAIXEOT-NXEZZACHSA-N 1 0 352.240 5.421 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc2n[nH]cc2c1 ZINC000552097467 568257879 /nfs/dbraw/zinc/25/78/79/568257879.db2.gz CNDPKRIAAIXEOT-UWVGGRQHSA-N 1 0 352.240 5.421 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1cc(F)c(Cl)cc1Cl ZINC000552097468 568257832 /nfs/dbraw/zinc/25/78/32/568257832.db2.gz CNDPKRIAAIXEOT-VHSXEESVSA-N 1 0 352.240 5.421 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc2n[nH]cc2c1 ZINC000552097469 568257852 /nfs/dbraw/zinc/25/78/52/568257852.db2.gz CNDPKRIAAIXEOT-ZJUUUORDSA-N 1 0 352.240 5.421 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1Cl ZINC000552098441 568257858 /nfs/dbraw/zinc/25/78/58/568257858.db2.gz CUIDWZDXLXAQQD-KBPBESRZSA-N 1 0 357.885 5.415 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1Cl ZINC000552098442 568257838 /nfs/dbraw/zinc/25/78/38/568257838.db2.gz CUIDWZDXLXAQQD-KGLIPLIRSA-N 1 0 357.885 5.415 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1Cl ZINC000552098443 568257867 /nfs/dbraw/zinc/25/78/67/568257867.db2.gz CUIDWZDXLXAQQD-UONOGXRCSA-N 1 0 357.885 5.415 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1Cl ZINC000552098444 568257827 /nfs/dbraw/zinc/25/78/27/568257827.db2.gz CUIDWZDXLXAQQD-ZIAGYGMSSA-N 1 0 357.885 5.415 20 0 FKADRO CSCc1ccc(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000552098722 568257888 /nfs/dbraw/zinc/25/78/88/568257888.db2.gz MQLRZPDIMAZXGK-KRWDZBQOSA-N 1 0 366.452 5.131 20 0 FKADRO CSCc1ccc(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000552098723 568257886 /nfs/dbraw/zinc/25/78/86/568257886.db2.gz MQLRZPDIMAZXGK-QGZVFWFLSA-N 1 0 366.452 5.131 20 0 FKADRO COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccc(CSC)cc2)cc1Cl ZINC000552099416 568257947 /nfs/dbraw/zinc/25/79/47/568257947.db2.gz HZWGSSHWASMDHC-CYBMUJFWSA-N 1 0 365.926 5.071 20 0 FKADRO COc1cc(OC)c([C@H](C)[NH2+]Cc2ccc(CSC)cc2)cc1Cl ZINC000552099417 568257945 /nfs/dbraw/zinc/25/79/45/568257945.db2.gz HZWGSSHWASMDHC-ZDUSSCGKSA-N 1 0 365.926 5.071 20 0 FKADRO FC(F)(F)C1(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000552099864 568257935 /nfs/dbraw/zinc/25/79/35/568257935.db2.gz VUAOUALTZBUBJT-CYBMUJFWSA-N 1 0 352.425 5.120 20 0 FKADRO FC(F)(F)C1(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000552099865 568257899 /nfs/dbraw/zinc/25/78/99/568257899.db2.gz VUAOUALTZBUBJT-ZDUSSCGKSA-N 1 0 352.425 5.120 20 0 FKADRO OCC[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000552100306 568257891 /nfs/dbraw/zinc/25/78/91/568257891.db2.gz FJASABUADGMPPE-DLBZAZTESA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000552100307 568257925 /nfs/dbraw/zinc/25/79/25/568257925.db2.gz FJASABUADGMPPE-IAGOWNOFSA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000552100308 568257959 /nfs/dbraw/zinc/25/79/59/568257959.db2.gz FJASABUADGMPPE-IRXDYDNUSA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000552100309 568257896 /nfs/dbraw/zinc/25/78/96/568257896.db2.gz FJASABUADGMPPE-SJORKVTESA-N 1 0 368.329 5.244 20 0 FKADRO CSCc1ccc(C[NH2+][C@@H](C)CC(=O)Nc2ccccc2C(C)C)cc1 ZINC000552100314 568257905 /nfs/dbraw/zinc/25/79/05/568257905.db2.gz FSEWBIZWSWPMOL-KRWDZBQOSA-N 1 0 370.562 5.180 20 0 FKADRO CSCc1ccc(C[NH2+][C@H](C)CC(=O)Nc2ccccc2C(C)C)cc1 ZINC000552100315 568257893 /nfs/dbraw/zinc/25/78/93/568257893.db2.gz FSEWBIZWSWPMOL-QGZVFWFLSA-N 1 0 370.562 5.180 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1cc2ccccc2o1 ZINC000552102173 568258023 /nfs/dbraw/zinc/25/80/23/568258023.db2.gz RGDZXIPZCOCBES-PXAZEXFGSA-N 1 0 364.272 5.514 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1cc2ccccc2o1 ZINC000552102174 568258014 /nfs/dbraw/zinc/25/80/14/568258014.db2.gz RGDZXIPZCOCBES-SJCJKPOMSA-N 1 0 364.272 5.514 20 0 FKADRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1cc2ccccc2o1 ZINC000552102175 568258007 /nfs/dbraw/zinc/25/80/07/568258007.db2.gz RGDZXIPZCOCBES-SJKOYZFVSA-N 1 0 364.272 5.514 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1cc2ccccc2o1 ZINC000552102176 568258004 /nfs/dbraw/zinc/25/80/04/568258004.db2.gz RGDZXIPZCOCBES-YVEFUNNKSA-N 1 0 364.272 5.514 20 0 FKADRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552102182 568257969 /nfs/dbraw/zinc/25/79/69/568257969.db2.gz RMLQMUQKHIGCGB-ACJLOTCBSA-N 1 0 368.304 5.085 20 0 FKADRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552102183 568257981 /nfs/dbraw/zinc/25/79/81/568257981.db2.gz RMLQMUQKHIGCGB-FZKQIMNGSA-N 1 0 368.304 5.085 20 0 FKADRO CC[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(OC)c1 ZINC000552102308 568257985 /nfs/dbraw/zinc/25/79/85/568257985.db2.gz XGTMOYMNQVUSGB-MOPGFXCFSA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(OC)c1 ZINC000552102309 568257963 /nfs/dbraw/zinc/25/79/63/568257963.db2.gz XGTMOYMNQVUSGB-OALUTQOASA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(OC)c1 ZINC000552102310 568257971 /nfs/dbraw/zinc/25/79/71/568257971.db2.gz XGTMOYMNQVUSGB-RBUKOAKNSA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(OC)c1 ZINC000552102311 568257988 /nfs/dbraw/zinc/25/79/88/568257988.db2.gz XGTMOYMNQVUSGB-RTBURBONSA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(OC)cc1 ZINC000552102332 568257965 /nfs/dbraw/zinc/25/79/65/568257965.db2.gz XZNYZFZCTUEUKO-MOPGFXCFSA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(OC)cc1 ZINC000552102333 568258027 /nfs/dbraw/zinc/25/80/27/568258027.db2.gz XZNYZFZCTUEUKO-OALUTQOASA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(OC)cc1 ZINC000552102334 568258002 /nfs/dbraw/zinc/25/80/02/568258002.db2.gz XZNYZFZCTUEUKO-RBUKOAKNSA-N 1 0 368.304 5.166 20 0 FKADRO CC[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(OC)cc1 ZINC000552102335 568258030 /nfs/dbraw/zinc/25/80/30/568258030.db2.gz XZNYZFZCTUEUKO-RTBURBONSA-N 1 0 368.304 5.166 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1)c1csc(Cl)c1 ZINC000552102380 568257975 /nfs/dbraw/zinc/25/79/75/568257975.db2.gz ZKRIMZRQJSTHOQ-LKFCYVNXSA-N 1 0 364.725 5.483 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1csc(Cl)c1 ZINC000552102381 568257973 /nfs/dbraw/zinc/25/79/73/568257973.db2.gz ZKRIMZRQJSTHOQ-OTYXRUKQSA-N 1 0 364.725 5.483 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1csc(Cl)c1 ZINC000552102382 568258032 /nfs/dbraw/zinc/25/80/32/568258032.db2.gz ZKRIMZRQJSTHOQ-XPTSAGLGSA-N 1 0 364.725 5.483 20 0 FKADRO CC(C)[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)[C@H](C)c1ccccc1 ZINC000552172776 568261474 /nfs/dbraw/zinc/26/14/74/568261474.db2.gz RGJOWBNARFDOTI-OAHLLOKOSA-N 1 0 364.411 5.116 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)c1 ZINC000552225334 568265389 /nfs/dbraw/zinc/26/53/89/568265389.db2.gz DYDCCCNIBIYBKU-IBGZPJMESA-N 1 0 351.538 5.005 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)c1 ZINC000552225335 568265385 /nfs/dbraw/zinc/26/53/85/568265385.db2.gz DYDCCCNIBIYBKU-LJQANCHMSA-N 1 0 351.538 5.005 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)c1 ZINC000552234880 568265518 /nfs/dbraw/zinc/26/55/18/568265518.db2.gz WDGPHVCUKCHYGR-DLBZAZTESA-N 1 0 350.437 5.733 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2ccc(Oc3ccccc3)c(F)c2)c1 ZINC000552234881 568265507 /nfs/dbraw/zinc/26/55/07/568265507.db2.gz WDGPHVCUKCHYGR-IAGOWNOFSA-N 1 0 350.437 5.733 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)c1 ZINC000552234882 568265495 /nfs/dbraw/zinc/26/54/95/568265495.db2.gz WDGPHVCUKCHYGR-IRXDYDNUSA-N 1 0 350.437 5.733 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C2c3ccccc3-c3ccccc32)c(C)c1OC ZINC000552238831 568266174 /nfs/dbraw/zinc/26/61/74/568266174.db2.gz JFIFGBJMZNYWNP-INIZCTEOSA-N 1 0 359.469 5.433 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]C2c3ccccc3-c3ccccc32)c(C)c1OC ZINC000552238832 568266225 /nfs/dbraw/zinc/26/62/25/568266225.db2.gz JFIFGBJMZNYWNP-MRXNPFEDSA-N 1 0 359.469 5.433 20 0 FKADRO Cc1[nH]c2c(cc(C)cc2C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1C ZINC000552247262 568263946 /nfs/dbraw/zinc/26/39/46/568263946.db2.gz IIAHKUKBWSRFOM-NRFANRHFSA-N 1 0 350.510 5.227 20 0 FKADRO Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1C ZINC000552247263 568263932 /nfs/dbraw/zinc/26/39/32/568263932.db2.gz IIAHKUKBWSRFOM-OAQYLSRUSA-N 1 0 350.510 5.227 20 0 FKADRO C[C@@H](CCc1ccc(F)cc1F)[NH2+][C@@H](c1ccccc1)c1cccnc1 ZINC000552248881 568263934 /nfs/dbraw/zinc/26/39/34/568263934.db2.gz WHPFGBXHNJKTLB-AOMKIAJQSA-N 1 0 352.428 5.060 20 0 FKADRO C[C@@H](CCc1ccc(F)cc1F)[NH2+][C@H](c1ccccc1)c1cccnc1 ZINC000552248882 568263961 /nfs/dbraw/zinc/26/39/61/568263961.db2.gz WHPFGBXHNJKTLB-KSFYIVLOSA-N 1 0 352.428 5.060 20 0 FKADRO C[C@H](CCc1ccc(F)cc1F)[NH2+][C@H](c1ccccc1)c1cccnc1 ZINC000552248883 568263994 /nfs/dbraw/zinc/26/39/94/568263994.db2.gz WHPFGBXHNJKTLB-OPAMFIHVSA-N 1 0 352.428 5.060 20 0 FKADRO C[C@H](CCc1ccc(F)cc1F)[NH2+][C@@H](c1ccccc1)c1cccnc1 ZINC000552248884 568264015 /nfs/dbraw/zinc/26/40/15/568264015.db2.gz WHPFGBXHNJKTLB-ZHRRBRCNSA-N 1 0 352.428 5.060 20 0 FKADRO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(OC(F)(F)F)cc1 ZINC000552251153 568264484 /nfs/dbraw/zinc/26/44/84/568264484.db2.gz LPZGMECDTVPACG-HNNXBMFYSA-N 1 0 363.383 5.011 20 0 FKADRO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(OC(F)(F)F)cc1 ZINC000552251154 568264464 /nfs/dbraw/zinc/26/44/64/568264464.db2.gz LPZGMECDTVPACG-OAHLLOKOSA-N 1 0 363.383 5.011 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2cccc(COC(C)(C)C)c2)c(C)c1OC ZINC000552252078 568264512 /nfs/dbraw/zinc/26/45/12/568264512.db2.gz ANMNLUXKPIYTIT-KRWDZBQOSA-N 1 0 371.521 5.178 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(COC(C)(C)C)c2)c(C)c1OC ZINC000552252079 568264480 /nfs/dbraw/zinc/26/44/80/568264480.db2.gz ANMNLUXKPIYTIT-QGZVFWFLSA-N 1 0 371.521 5.178 20 0 FKADRO CCOc1ccccc1[C@@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C ZINC000552252429 568264492 /nfs/dbraw/zinc/26/44/92/568264492.db2.gz NBAPRFZFVNTVHR-QFBILLFUSA-N 1 0 357.494 5.213 20 0 FKADRO CCOc1ccccc1[C@@H](CC)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C ZINC000552252430 568264470 /nfs/dbraw/zinc/26/44/70/568264470.db2.gz NBAPRFZFVNTVHR-VQIMIIECSA-N 1 0 357.494 5.213 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(Cl)c2Cl)c(C)c1OC ZINC000552252557 568264495 /nfs/dbraw/zinc/26/44/95/568264495.db2.gz QIULOKCBTMEVNB-GFCCVEGCSA-N 1 0 354.277 5.170 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2cccc(Cl)c2Cl)c(C)c1OC ZINC000552252558 568264568 /nfs/dbraw/zinc/26/45/68/568264568.db2.gz QIULOKCBTMEVNB-LBPRGKRZSA-N 1 0 354.277 5.170 20 0 FKADRO CCCCOc1ccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1OC ZINC000552253828 568264536 /nfs/dbraw/zinc/26/45/36/568264536.db2.gz WHXNHNCOAUVBQN-NRFANRHFSA-N 1 0 371.525 5.008 20 0 FKADRO CCCCOc1ccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1OC ZINC000552253829 568264529 /nfs/dbraw/zinc/26/45/29/568264529.db2.gz WHXNHNCOAUVBQN-OAQYLSRUSA-N 1 0 371.525 5.008 20 0 FKADRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Oc2ccccc2)c(F)c1 ZINC000552258290 568263963 /nfs/dbraw/zinc/26/39/63/568263963.db2.gz BYBZCIMTGYFNAT-UHFFFAOYSA-N 1 0 354.425 5.248 20 0 FKADRO CC[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccc(C)c1 ZINC000552262020 568268702 /nfs/dbraw/zinc/26/87/02/568268702.db2.gz AYSJAMXWGGBPQA-MOPGFXCFSA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1cccc(C)c1 ZINC000552262021 568268694 /nfs/dbraw/zinc/26/86/94/568268694.db2.gz AYSJAMXWGGBPQA-OALUTQOASA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccc(C)c1 ZINC000552262022 568268720 /nfs/dbraw/zinc/26/87/20/568268720.db2.gz AYSJAMXWGGBPQA-RBUKOAKNSA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1cccc(C)c1 ZINC000552262023 568268713 /nfs/dbraw/zinc/26/87/13/568268713.db2.gz AYSJAMXWGGBPQA-RTBURBONSA-N 1 0 359.311 5.345 20 0 FKADRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)s1 ZINC000552272581 568266389 /nfs/dbraw/zinc/26/63/89/568266389.db2.gz VXBSQCIYRVTERR-INIZCTEOSA-N 1 0 367.518 5.449 20 0 FKADRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)s1 ZINC000552272582 568266375 /nfs/dbraw/zinc/26/63/75/568266375.db2.gz VXBSQCIYRVTERR-MRXNPFEDSA-N 1 0 367.518 5.449 20 0 FKADRO c1nc(-c2ccncc2)sc1C[NH2+]Cc1ccc(C2CCCCC2)cc1 ZINC000552273420 568266424 /nfs/dbraw/zinc/26/64/24/568266424.db2.gz JLSJMOPDYHAYCP-UHFFFAOYSA-N 1 0 363.530 5.543 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 ZINC000552275327 568266610 /nfs/dbraw/zinc/26/66/10/568266610.db2.gz RQWDEZLIZYCDDP-KPZWWZAWSA-N 1 0 368.830 5.864 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 ZINC000552275328 568266599 /nfs/dbraw/zinc/26/65/99/568266599.db2.gz RQWDEZLIZYCDDP-KZULUSFZSA-N 1 0 368.830 5.864 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 ZINC000552275329 568266585 /nfs/dbraw/zinc/26/65/85/568266585.db2.gz RQWDEZLIZYCDDP-SGTLLEGYSA-N 1 0 368.830 5.864 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 ZINC000552275330 568266579 /nfs/dbraw/zinc/26/65/79/568266579.db2.gz RQWDEZLIZYCDDP-XIKOKIGWSA-N 1 0 368.830 5.864 20 0 FKADRO CC(C)CC[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccoc1 ZINC000552276628 568266641 /nfs/dbraw/zinc/26/66/41/568266641.db2.gz FBEQXAGRKYOUFT-CTWPCTMYSA-N 1 0 372.475 5.152 20 0 FKADRO O=C(CCCN(Cc1ccco1)Cc1cccs1)c1ccc(F)cc1 ZINC000552281474 568267276 /nfs/dbraw/zinc/26/72/76/568267276.db2.gz XVNWLPGFEGVVOO-UHFFFAOYSA-N 1 0 357.450 5.146 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)c(C)c1OC ZINC000552283844 568267377 /nfs/dbraw/zinc/26/73/77/568267377.db2.gz LDMBTZNPKLMTFZ-KGLIPLIRSA-N 1 0 357.425 5.309 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)c(C)c1OC ZINC000552283845 568267347 /nfs/dbraw/zinc/26/73/47/568267347.db2.gz LDMBTZNPKLMTFZ-UONOGXRCSA-N 1 0 357.425 5.309 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)c(C)c1OC ZINC000552283847 568267337 /nfs/dbraw/zinc/26/73/37/568267337.db2.gz LDMBTZNPKLMTFZ-ZIAGYGMSSA-N 1 0 357.425 5.309 20 0 FKADRO CC(=O)N(c1nc(C[NH2+]C(C)(C)C(C)(C)C)cs1)c1ccc(C)cc1 ZINC000552293094 568267789 /nfs/dbraw/zinc/26/77/89/568267789.db2.gz OOJMEPFUVCTDFZ-UHFFFAOYSA-N 1 0 359.539 5.050 20 0 FKADRO c1cc(C[N@@H+](Cc2cnc(-c3ccncc3)s2)C2CCCCC2)co1 ZINC000552294203 568268080 /nfs/dbraw/zinc/26/80/80/568268080.db2.gz HQJUTWVKXYWOOS-UHFFFAOYSA-N 1 0 353.491 5.133 20 0 FKADRO CCCc1ccc([C@@H]([NH2+]Cc2ccc(C[S@](C)=O)cc2)C(C)C)cc1 ZINC000552297594 568268202 /nfs/dbraw/zinc/26/82/02/568268202.db2.gz BJPZXKBCCYCBPV-DHLKQENFSA-N 1 0 357.563 5.005 20 0 FKADRO CCCc1ccc([C@H]([NH2+]Cc2ccc(C[S@@](C)=O)cc2)C(C)C)cc1 ZINC000552297595 568268231 /nfs/dbraw/zinc/26/82/31/568268231.db2.gz BJPZXKBCCYCBPV-RCZVLFRGSA-N 1 0 357.563 5.005 20 0 FKADRO CCCc1ccc([C@H]([NH2+]Cc2ccc(C[S@](C)=O)cc2)C(C)C)cc1 ZINC000552297596 568268207 /nfs/dbraw/zinc/26/82/07/568268207.db2.gz BJPZXKBCCYCBPV-RDGATRHJSA-N 1 0 357.563 5.005 20 0 FKADRO CCCc1ccc([C@@H]([NH2+]Cc2ccc(C[S@@](C)=O)cc2)C(C)C)cc1 ZINC000552297597 568268186 /nfs/dbraw/zinc/26/81/86/568268186.db2.gz BJPZXKBCCYCBPV-WIOPSUGQSA-N 1 0 357.563 5.005 20 0 FKADRO CCO[C@H](C)c1nc(C[N@H+](C)[C@H]2CCCC[C@@H]2c2ccccc2)cs1 ZINC000552300579 568268359 /nfs/dbraw/zinc/26/83/59/568268359.db2.gz QXQFVDCXCMAAFT-AHRSYUTCSA-N 1 0 358.551 5.399 20 0 FKADRO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H]2CCCC[C@H]2c2ccccc2)cs1 ZINC000552300580 568268419 /nfs/dbraw/zinc/26/84/19/568268419.db2.gz QXQFVDCXCMAAFT-LSTHTHJFSA-N 1 0 358.551 5.399 20 0 FKADRO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H]2CCCC[C@@H]2c2ccccc2)cs1 ZINC000552300581 568268405 /nfs/dbraw/zinc/26/84/05/568268405.db2.gz QXQFVDCXCMAAFT-NSISKUIASA-N 1 0 358.551 5.399 20 0 FKADRO CCO[C@H](C)c1nc(C[N@H+](C)[C@H]2CCCC[C@H]2c2ccccc2)cs1 ZINC000552300582 568268454 /nfs/dbraw/zinc/26/84/54/568268454.db2.gz QXQFVDCXCMAAFT-UXPWSPDFSA-N 1 0 358.551 5.399 20 0 FKADRO COCCc1ccnc(N[C@H](C)c2ccc(OCc3ccccc3)cc2)c1 ZINC000552317588 568273321 /nfs/dbraw/zinc/27/33/21/568273321.db2.gz DJNGQEZBASMRLU-GOSISDBHSA-N 1 0 362.473 5.023 20 0 FKADRO COCCc1ccnc(N[C@@H](C)c2ccc(OCc3ccccc3)cc2)c1 ZINC000552317590 568273300 /nfs/dbraw/zinc/27/33/00/568273300.db2.gz DJNGQEZBASMRLU-SFHVURJKSA-N 1 0 362.473 5.023 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)c3cc(Br)ccc3F)ccc2[nH]1 ZINC000552318029 568273460 /nfs/dbraw/zinc/27/34/60/568273460.db2.gz NZGMKCCUABVEJQ-GFCCVEGCSA-N 1 0 361.258 5.229 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)c3cc(Br)ccc3F)ccc2[nH]1 ZINC000552318030 568273513 /nfs/dbraw/zinc/27/35/13/568273513.db2.gz NZGMKCCUABVEJQ-LBPRGKRZSA-N 1 0 361.258 5.229 20 0 FKADRO CSc1ccc([C@H](C)[NH2+]Cc2ccncc2OCc2ccccc2)cc1 ZINC000552318098 568273446 /nfs/dbraw/zinc/27/34/46/568273446.db2.gz PIQRXSOJKBRUND-KRWDZBQOSA-N 1 0 364.514 5.233 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+]Cc2ccncc2OCc2ccccc2)cc1 ZINC000552318099 568273437 /nfs/dbraw/zinc/27/34/37/568273437.db2.gz PIQRXSOJKBRUND-QGZVFWFLSA-N 1 0 364.514 5.233 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000552318283 568273787 /nfs/dbraw/zinc/27/37/87/568273787.db2.gz VXFAGEULNJUYDR-CEXWTWQISA-N 1 0 355.444 5.136 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000552318284 568273844 /nfs/dbraw/zinc/27/38/44/568273844.db2.gz VXFAGEULNJUYDR-FHWLQOOXSA-N 1 0 355.444 5.136 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000552318285 568273804 /nfs/dbraw/zinc/27/38/04/568273804.db2.gz VXFAGEULNJUYDR-GBESFXJTSA-N 1 0 355.444 5.136 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000552318286 568273881 /nfs/dbraw/zinc/27/38/81/568273881.db2.gz VXFAGEULNJUYDR-QYZOEREBSA-N 1 0 355.444 5.136 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000552318424 568273813 /nfs/dbraw/zinc/27/38/13/568273813.db2.gz ZXDWSJDOJKLVRY-HNNXBMFYSA-N 1 0 352.478 5.460 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000552318425 568273826 /nfs/dbraw/zinc/27/38/26/568273826.db2.gz ZXDWSJDOJKLVRY-OAHLLOKOSA-N 1 0 352.478 5.460 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+]C3(c4cccc(OC)c4)CC3)c(C)c2c1 ZINC000552320745 568273912 /nfs/dbraw/zinc/27/39/12/568273912.db2.gz DXOVYLHVEAALBU-HNNXBMFYSA-N 1 0 351.446 5.098 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+]C3(c4cccc(OC)c4)CC3)c(C)c2c1 ZINC000552320746 568273984 /nfs/dbraw/zinc/27/39/84/568273984.db2.gz DXOVYLHVEAALBU-OAHLLOKOSA-N 1 0 351.446 5.098 20 0 FKADRO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccc(-c2ccc(F)cc2)s1 ZINC000552321002 568273987 /nfs/dbraw/zinc/27/39/87/568273987.db2.gz JBQLZMGZIACZGI-AWEZNQCLSA-N 1 0 351.450 5.053 20 0 FKADRO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccc(-c2ccc(F)cc2)s1 ZINC000552321003 568273951 /nfs/dbraw/zinc/27/39/51/568273951.db2.gz JBQLZMGZIACZGI-CQSZACIVSA-N 1 0 351.450 5.053 20 0 FKADRO CC(C)CCC[C@@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccccc1 ZINC000552321489 568274199 /nfs/dbraw/zinc/27/41/99/568274199.db2.gz SVRKYOOUSTWVFK-RCZVLFRGSA-N 1 0 357.563 5.222 20 0 FKADRO CC(C)CCC[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccccc1 ZINC000552321490 568274215 /nfs/dbraw/zinc/27/42/15/568274215.db2.gz SVRKYOOUSTWVFK-RDGATRHJSA-N 1 0 357.563 5.222 20 0 FKADRO CC(C)CCC[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccccc1 ZINC000552321491 568274236 /nfs/dbraw/zinc/27/42/36/568274236.db2.gz SVRKYOOUSTWVFK-WIOPSUGQSA-N 1 0 357.563 5.222 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)cc1Br ZINC000552321533 568274210 /nfs/dbraw/zinc/27/42/10/568274210.db2.gz VRKAHQXBBNPAPD-CYBMUJFWSA-N 1 0 373.294 5.098 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)cc1Br ZINC000552321534 568274254 /nfs/dbraw/zinc/27/42/54/568274254.db2.gz VRKAHQXBBNPAPD-ZDUSSCGKSA-N 1 0 373.294 5.098 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)CC(=O)Nc3ccccc3C(C)C)ccc2[nH]1 ZINC000552321611 568274188 /nfs/dbraw/zinc/27/41/88/568274188.db2.gz YCFABLGRGAGWGA-INIZCTEOSA-N 1 0 363.505 5.107 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)CC(=O)Nc3ccccc3C(C)C)ccc2[nH]1 ZINC000552321612 568274252 /nfs/dbraw/zinc/27/42/52/568274252.db2.gz YCFABLGRGAGWGA-MRXNPFEDSA-N 1 0 363.505 5.107 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000552321667 568274197 /nfs/dbraw/zinc/27/41/97/568274197.db2.gz ZXEDAUOIZPSKTJ-PXAZEXFGSA-N 1 0 351.849 5.298 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000552321668 568274247 /nfs/dbraw/zinc/27/42/47/568274247.db2.gz ZXEDAUOIZPSKTJ-SJCJKPOMSA-N 1 0 351.849 5.298 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000552321669 568274315 /nfs/dbraw/zinc/27/43/15/568274315.db2.gz ZXEDAUOIZPSKTJ-SJKOYZFVSA-N 1 0 351.849 5.298 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000552321670 568274381 /nfs/dbraw/zinc/27/43/81/568274381.db2.gz ZXEDAUOIZPSKTJ-YVEFUNNKSA-N 1 0 351.849 5.298 20 0 FKADRO COCCC[C@H](C[NH2+][C@@H](c1cccnc1)C1CCC1)c1ccc(Cl)cc1 ZINC000552322108 568274360 /nfs/dbraw/zinc/27/43/60/568274360.db2.gz CWKZLVBTHGPFAF-DENIHFKCSA-N 1 0 372.940 5.376 20 0 FKADRO COCCC[C@H](C[NH2+][C@H](c1cccnc1)C1CCC1)c1ccc(Cl)cc1 ZINC000552322109 568274384 /nfs/dbraw/zinc/27/43/84/568274384.db2.gz CWKZLVBTHGPFAF-KNQAVFIVSA-N 1 0 372.940 5.376 20 0 FKADRO COCCC[C@@H](C[NH2+][C@@H](c1cccnc1)C1CCC1)c1ccc(Cl)cc1 ZINC000552322110 568274359 /nfs/dbraw/zinc/27/43/59/568274359.db2.gz CWKZLVBTHGPFAF-SIKLNZKXSA-N 1 0 372.940 5.376 20 0 FKADRO COCCC[C@@H](C[NH2+][C@H](c1cccnc1)C1CCC1)c1ccc(Cl)cc1 ZINC000552322111 568274353 /nfs/dbraw/zinc/27/43/53/568274353.db2.gz CWKZLVBTHGPFAF-UGKGYDQZSA-N 1 0 372.940 5.376 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2n1)c1ccc(OC)c(OC)c1 ZINC000552322592 568274463 /nfs/dbraw/zinc/27/44/63/568274463.db2.gz SKIGQERIFXHETB-CRAIPNDOSA-N 1 0 350.462 5.054 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1ccc(OC)c(OC)c1 ZINC000552322593 568274491 /nfs/dbraw/zinc/27/44/91/568274491.db2.gz SKIGQERIFXHETB-MAUKXSAKSA-N 1 0 350.462 5.054 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc2ccccc2n1)c1ccc(OC)c(OC)c1 ZINC000552322594 568274479 /nfs/dbraw/zinc/27/44/79/568274479.db2.gz SKIGQERIFXHETB-QAPCUYQASA-N 1 0 350.462 5.054 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1ccc(OC)c(OC)c1 ZINC000552322595 568274456 /nfs/dbraw/zinc/27/44/56/568274456.db2.gz SKIGQERIFXHETB-YJBOKZPZSA-N 1 0 350.462 5.054 20 0 FKADRO COCCC[C@H](C[NH2+][C@H](C)c1sc(C)nc1C)c1ccc(Cl)cc1 ZINC000552323297 568274426 /nfs/dbraw/zinc/27/44/26/568274426.db2.gz DDNWEFWHIZYUQT-CXAGYDPISA-N 1 0 366.958 5.274 20 0 FKADRO COCCC[C@@H](C[NH2+][C@H](C)c1sc(C)nc1C)c1ccc(Cl)cc1 ZINC000552323298 568274523 /nfs/dbraw/zinc/27/45/23/568274523.db2.gz DDNWEFWHIZYUQT-DYVFJYSZSA-N 1 0 366.958 5.274 20 0 FKADRO COCCC[C@@H](C[NH2+][C@@H](C)c1sc(C)nc1C)c1ccc(Cl)cc1 ZINC000552323299 568274506 /nfs/dbraw/zinc/27/45/06/568274506.db2.gz DDNWEFWHIZYUQT-GUYCJALGSA-N 1 0 366.958 5.274 20 0 FKADRO COCCC[C@H](C[NH2+][C@@H](C)c1sc(C)nc1C)c1ccc(Cl)cc1 ZINC000552323300 568274504 /nfs/dbraw/zinc/27/45/04/568274504.db2.gz DDNWEFWHIZYUQT-SUMWQHHRSA-N 1 0 366.958 5.274 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000552323532 568274650 /nfs/dbraw/zinc/27/46/50/568274650.db2.gz KYCSWVUCKJWPIW-INIZCTEOSA-N 1 0 351.519 5.105 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000552323533 568274582 /nfs/dbraw/zinc/27/45/82/568274582.db2.gz KYCSWVUCKJWPIW-MRXNPFEDSA-N 1 0 351.519 5.105 20 0 FKADRO Cc1cncc([C@@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000552323624 568274638 /nfs/dbraw/zinc/27/46/38/568274638.db2.gz NKCDVSAFUQQIFC-ACJLOTCBSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1cncc([C@@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000552323625 568274626 /nfs/dbraw/zinc/27/46/26/568274626.db2.gz NKCDVSAFUQQIFC-FZKQIMNGSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1cncc([C@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000552323626 568274596 /nfs/dbraw/zinc/27/45/96/568274596.db2.gz NKCDVSAFUQQIFC-SCLBCKFNSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1cncc([C@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000552323627 568274667 /nfs/dbraw/zinc/27/46/67/568274667.db2.gz NKCDVSAFUQQIFC-UGSOOPFHSA-N 1 0 350.384 5.091 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(O)c1 ZINC000552323858 568274588 /nfs/dbraw/zinc/27/45/88/568274588.db2.gz UCOGAJVPOVGYEQ-KPZWWZAWSA-N 1 0 351.368 5.093 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(O)c1 ZINC000552323859 568274580 /nfs/dbraw/zinc/27/45/80/568274580.db2.gz UCOGAJVPOVGYEQ-KZULUSFZSA-N 1 0 351.368 5.093 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(O)c1 ZINC000552323860 568274672 /nfs/dbraw/zinc/27/46/72/568274672.db2.gz UCOGAJVPOVGYEQ-SGTLLEGYSA-N 1 0 351.368 5.093 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(O)c1 ZINC000552323861 568274556 /nfs/dbraw/zinc/27/45/56/568274556.db2.gz UCOGAJVPOVGYEQ-XIKOKIGWSA-N 1 0 351.368 5.093 20 0 FKADRO Fc1cncc([C@H]([NH2+]C[C@H](OCC2CC2)c2ccc(Cl)cc2)C2CC2)c1 ZINC000552323927 568274778 /nfs/dbraw/zinc/27/47/78/568274778.db2.gz WFJSLTIWPGYLJC-LEWJYISDSA-N 1 0 374.887 5.083 20 0 FKADRO Fc1cncc([C@H]([NH2+]C[C@@H](OCC2CC2)c2ccc(Cl)cc2)C2CC2)c1 ZINC000552323928 568274836 /nfs/dbraw/zinc/27/48/36/568274836.db2.gz WFJSLTIWPGYLJC-NHCUHLMSSA-N 1 0 374.887 5.083 20 0 FKADRO Fc1cncc([C@@H]([NH2+]C[C@@H](OCC2CC2)c2ccc(Cl)cc2)C2CC2)c1 ZINC000552323929 568274774 /nfs/dbraw/zinc/27/47/74/568274774.db2.gz WFJSLTIWPGYLJC-RTWAWAEBSA-N 1 0 374.887 5.083 20 0 FKADRO Fc1cncc([C@@H]([NH2+]C[C@H](OCC2CC2)c2ccc(Cl)cc2)C2CC2)c1 ZINC000552323930 568274768 /nfs/dbraw/zinc/27/47/68/568274768.db2.gz WFJSLTIWPGYLJC-SFTDATJTSA-N 1 0 374.887 5.083 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1sc(C(C)C)nc1C)c1ccc(OC)c(OC)c1 ZINC000552324495 568274741 /nfs/dbraw/zinc/27/47/41/568274741.db2.gz AERXLZOFHZDADJ-BBRMVZONSA-N 1 0 362.539 5.394 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1sc(C(C)C)nc1C)c1ccc(OC)c(OC)c1 ZINC000552324496 568274824 /nfs/dbraw/zinc/27/48/24/568274824.db2.gz AERXLZOFHZDADJ-CJNGLKHVSA-N 1 0 362.539 5.394 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1sc(C(C)C)nc1C)c1ccc(OC)c(OC)c1 ZINC000552324497 568274698 /nfs/dbraw/zinc/27/46/98/568274698.db2.gz AERXLZOFHZDADJ-CZUORRHYSA-N 1 0 362.539 5.394 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1sc(C(C)C)nc1C)c1ccc(OC)c(OC)c1 ZINC000552324498 568274745 /nfs/dbraw/zinc/27/47/45/568274745.db2.gz AERXLZOFHZDADJ-XJKSGUPXSA-N 1 0 362.539 5.394 20 0 FKADRO COc1cccc(C2([NH2+][C@@H](C)c3sc(-c4ccccc4)nc3C)CC2)c1 ZINC000552325385 568274748 /nfs/dbraw/zinc/27/47/48/568274748.db2.gz URWLSVBVXHSAGH-INIZCTEOSA-N 1 0 364.514 5.467 20 0 FKADRO COc1cccc(C2([NH2+][C@H](C)c3sc(-c4ccccc4)nc3C)CC2)c1 ZINC000552325386 568274789 /nfs/dbraw/zinc/27/47/89/568274789.db2.gz URWLSVBVXHSAGH-MRXNPFEDSA-N 1 0 364.514 5.467 20 0 FKADRO C[C@H]([NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)c1c(F)cncc1F ZINC000552328242 568274884 /nfs/dbraw/zinc/27/48/84/568274884.db2.gz QCQGVLGTWFOXTB-WHOFXGATSA-N 1 0 370.365 5.366 20 0 FKADRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cnn1-c1cc(C)ccc1C ZINC000552333327 568274931 /nfs/dbraw/zinc/27/49/31/568274931.db2.gz BIBAPHRDQJRJFO-SJORKVTESA-N 1 0 373.504 5.086 20 0 FKADRO Cc1cc(CC[NH2+][C@H](c2sccc2C)c2ccc(Cl)cc2F)on1 ZINC000552335216 568275014 /nfs/dbraw/zinc/27/50/14/568275014.db2.gz MBILHGIADGJPSU-KRWDZBQOSA-N 1 0 364.873 5.067 20 0 FKADRO Cc1cc(CC[NH2+][C@@H](c2sccc2C)c2ccc(Cl)cc2F)on1 ZINC000552335217 568275040 /nfs/dbraw/zinc/27/50/40/568275040.db2.gz MBILHGIADGJPSU-QGZVFWFLSA-N 1 0 364.873 5.067 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1OC ZINC000552337168 568275024 /nfs/dbraw/zinc/27/50/24/568275024.db2.gz OIONJKLPVSNUHV-CVEARBPZSA-N 1 0 367.493 5.162 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1OC ZINC000552337169 568275036 /nfs/dbraw/zinc/27/50/36/568275036.db2.gz OIONJKLPVSNUHV-HOTGVXAUSA-N 1 0 367.493 5.162 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1OC ZINC000552337170 568275042 /nfs/dbraw/zinc/27/50/42/568275042.db2.gz OIONJKLPVSNUHV-HZPDHXFCSA-N 1 0 367.493 5.162 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1OC ZINC000552337171 568275104 /nfs/dbraw/zinc/27/51/04/568275104.db2.gz OIONJKLPVSNUHV-JKSUJKDBSA-N 1 0 367.493 5.162 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000552337365 568275050 /nfs/dbraw/zinc/27/50/50/568275050.db2.gz RRZGXVXYJRMKCY-INIZCTEOSA-N 1 0 363.530 5.286 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000552337366 568275027 /nfs/dbraw/zinc/27/50/27/568275027.db2.gz RRZGXVXYJRMKCY-MRXNPFEDSA-N 1 0 363.530 5.286 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1cccc2Br)c1ccc2n[nH]cc2c1 ZINC000552338865 568275082 /nfs/dbraw/zinc/27/50/82/568275082.db2.gz RLJNBHVHQXJABH-FMTVUPSXSA-N 1 0 370.294 5.225 20 0 FKADRO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1cccc2Br)c1ccc2n[nH]cc2c1 ZINC000552338866 568275020 /nfs/dbraw/zinc/27/50/20/568275020.db2.gz RLJNBHVHQXJABH-FTLABTOESA-N 1 0 370.294 5.225 20 0 FKADRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1cccc2Br)c1ccc2n[nH]cc2c1 ZINC000552338867 568275047 /nfs/dbraw/zinc/27/50/47/568275047.db2.gz RLJNBHVHQXJABH-SEDUGSJDSA-N 1 0 370.294 5.225 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1cccc2Br)c1ccc2n[nH]cc2c1 ZINC000552338868 568275010 /nfs/dbraw/zinc/27/50/10/568275010.db2.gz RLJNBHVHQXJABH-SOZUMNATSA-N 1 0 370.294 5.225 20 0 FKADRO COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3(C(F)(F)F)CC3)s2)cc1 ZINC000552339677 568275127 /nfs/dbraw/zinc/27/51/27/568275127.db2.gz DATLTJBIIRNKFT-LLVKDONJSA-N 1 0 370.440 5.120 20 0 FKADRO COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3(C(F)(F)F)CC3)s2)cc1 ZINC000552339678 568275173 /nfs/dbraw/zinc/27/51/73/568275173.db2.gz DATLTJBIIRNKFT-NSHDSACASA-N 1 0 370.440 5.120 20 0 FKADRO CSC[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 ZINC000552340103 568275137 /nfs/dbraw/zinc/27/51/37/568275137.db2.gz KQSIQTRBKNQUOB-GFCCVEGCSA-N 1 0 357.363 5.042 20 0 FKADRO CSC[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 ZINC000552340104 568275147 /nfs/dbraw/zinc/27/51/47/568275147.db2.gz KQSIQTRBKNQUOB-LBPRGKRZSA-N 1 0 357.363 5.042 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]CC3(c4ccccn4)CCC3)cs2)cs1 ZINC000552340174 568275201 /nfs/dbraw/zinc/27/52/01/568275201.db2.gz MJBKICRGOQDXLA-AWEZNQCLSA-N 1 0 369.559 5.348 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+]CC3(c4ccccn4)CCC3)cs2)cs1 ZINC000552340175 568275117 /nfs/dbraw/zinc/27/51/17/568275117.db2.gz MJBKICRGOQDXLA-CQSZACIVSA-N 1 0 369.559 5.348 20 0 FKADRO CSCc1ccc(C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000552340353 568275365 /nfs/dbraw/zinc/27/53/65/568275365.db2.gz SGWRNZXRFJULCM-AWEZNQCLSA-N 1 0 369.452 5.342 20 0 FKADRO CSCc1ccc(C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000552340354 568275274 /nfs/dbraw/zinc/27/52/74/568275274.db2.gz SGWRNZXRFJULCM-CQSZACIVSA-N 1 0 369.452 5.342 20 0 FKADRO CCOc1ccccc1[C@@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342430 568275519 /nfs/dbraw/zinc/27/55/19/568275519.db2.gz MLBZQWZHJIXQOU-ACJLOTCBSA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccccc1[C@@H](C)[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342432 568275485 /nfs/dbraw/zinc/27/54/85/568275485.db2.gz MLBZQWZHJIXQOU-FZKQIMNGSA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccccc1[C@H](C)[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342433 568275523 /nfs/dbraw/zinc/27/55/23/568275523.db2.gz MLBZQWZHJIXQOU-SCLBCKFNSA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccccc1[C@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342435 568275456 /nfs/dbraw/zinc/27/54/56/568275456.db2.gz MLBZQWZHJIXQOU-UGSOOPFHSA-N 1 0 368.304 5.166 20 0 FKADRO CCc1nc(C)c([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)s1 ZINC000552342658 568275505 /nfs/dbraw/zinc/27/55/05/568275505.db2.gz QUHNKIPZQQEJMR-BONVTDFDSA-N 1 0 373.349 5.095 20 0 FKADRO CCc1nc(C)c([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)s1 ZINC000552342659 568275570 /nfs/dbraw/zinc/27/55/70/568275570.db2.gz QUHNKIPZQQEJMR-MEBBXXQBSA-N 1 0 373.349 5.095 20 0 FKADRO CCc1nc(C)c([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)s1 ZINC000552342660 568275647 /nfs/dbraw/zinc/27/56/47/568275647.db2.gz QUHNKIPZQQEJMR-ZUZCIYMTSA-N 1 0 373.349 5.095 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552343105 568275654 /nfs/dbraw/zinc/27/56/54/568275654.db2.gz ZZZHEUAINRBCNP-BFUOFWGJSA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552343106 568275577 /nfs/dbraw/zinc/27/55/77/568275577.db2.gz ZZZHEUAINRBCNP-DJJJIMSYSA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552343107 568275641 /nfs/dbraw/zinc/27/56/41/568275641.db2.gz ZZZHEUAINRBCNP-ORAYPTAESA-N 1 0 368.304 5.166 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552343108 568275564 /nfs/dbraw/zinc/27/55/64/568275564.db2.gz ZZZHEUAINRBCNP-YJYMSZOUSA-N 1 0 368.304 5.166 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H](c1cccnc1)C(C)(C)CO ZINC000552344943 568275698 /nfs/dbraw/zinc/27/56/98/568275698.db2.gz JDXFZJYYDIKUFJ-IBGZPJMESA-N 1 0 374.937 5.108 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H](c1cccnc1)C(C)(C)CO ZINC000552344944 568275813 /nfs/dbraw/zinc/27/58/13/568275813.db2.gz JDXFZJYYDIKUFJ-LJQANCHMSA-N 1 0 374.937 5.108 20 0 FKADRO c1cc2c(o1)CCC[C@@H]2NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000552371112 568270596 /nfs/dbraw/zinc/27/05/96/568270596.db2.gz QOCSFFHDBUWLPX-AEFFLSMTSA-N 1 0 364.514 5.176 20 0 FKADRO c1cc2c(o1)CCC[C@H]2NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000552371113 568270603 /nfs/dbraw/zinc/27/06/03/568270603.db2.gz QOCSFFHDBUWLPX-FUHWJXTLSA-N 1 0 364.514 5.176 20 0 FKADRO c1cc2c(o1)CCC[C@H]2NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000552371114 568270614 /nfs/dbraw/zinc/27/06/14/568270614.db2.gz QOCSFFHDBUWLPX-SJLPKXTDSA-N 1 0 364.514 5.176 20 0 FKADRO c1cc2c(o1)CCC[C@@H]2NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000552371115 568270580 /nfs/dbraw/zinc/27/05/80/568270580.db2.gz QOCSFFHDBUWLPX-WMZOPIPTSA-N 1 0 364.514 5.176 20 0 FKADRO COc1cc(F)c([C@@H](C)NCc2cc(Cl)sc2Cl)cc1OC ZINC000552384708 568276462 /nfs/dbraw/zinc/27/64/62/568276462.db2.gz MXVWGCNEPXJYOY-MRVPVSSYSA-N 1 0 364.269 5.062 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+]CCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000552391946 568278362 /nfs/dbraw/zinc/27/83/62/568278362.db2.gz DRAKJMIMQNXZQM-SNVBAGLBSA-N 1 0 371.230 5.033 20 0 FKADRO c1coc(-c2cc(CN[C@H](CCCc3ccccc3)c3ccccc3)no2)c1 ZINC000552479133 568292819 /nfs/dbraw/zinc/29/28/19/568292819.db2.gz IZUXBBJSXTYMFE-JOCHJYFZSA-N 1 0 372.468 5.788 20 0 FKADRO c1coc(-c2cc(CN[C@@H](CCCc3ccccc3)c3ccccc3)no2)c1 ZINC000552479134 568292835 /nfs/dbraw/zinc/29/28/35/568292835.db2.gz IZUXBBJSXTYMFE-QFIPXVFZSA-N 1 0 372.468 5.788 20 0 FKADRO CC1CCC([N@H+](C)CCC(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000552500136 568290505 /nfs/dbraw/zinc/29/05/05/568290505.db2.gz BBHCBKJLJITGOI-UHFFFAOYSA-N 1 0 350.506 5.193 20 0 FKADRO C[C@@H]1CCC[C@H]([N@H+](C)CCC(=O)Nc2ccccc2-c2ccccc2)C1 ZINC000552500402 568290514 /nfs/dbraw/zinc/29/05/14/568290514.db2.gz KMWGGFLKRIBGOM-QUCCMNQESA-N 1 0 350.506 5.193 20 0 FKADRO C[C@@H]1CCC[C@@H]([N@H+](C)CCC(=O)Nc2ccccc2-c2ccccc2)C1 ZINC000552500403 568290498 /nfs/dbraw/zinc/29/04/98/568290498.db2.gz KMWGGFLKRIBGOM-UYAOXDASSA-N 1 0 350.506 5.193 20 0 FKADRO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000552513214 568291131 /nfs/dbraw/zinc/29/11/31/568291131.db2.gz KHCCHMFJFXDKRW-BBRMVZONSA-N 1 0 371.843 5.080 20 0 FKADRO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000552513215 568291146 /nfs/dbraw/zinc/29/11/46/568291146.db2.gz KHCCHMFJFXDKRW-CJNGLKHVSA-N 1 0 371.843 5.080 20 0 FKADRO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000552513216 568291114 /nfs/dbraw/zinc/29/11/14/568291114.db2.gz KHCCHMFJFXDKRW-CZUORRHYSA-N 1 0 371.843 5.080 20 0 FKADRO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000552513217 568291111 /nfs/dbraw/zinc/29/11/11/568291111.db2.gz KHCCHMFJFXDKRW-XJKSGUPXSA-N 1 0 371.843 5.080 20 0 FKADRO FC(F)(F)COc1ccc(C[NH2+][C@H](c2cccs2)C2CCCC2)cn1 ZINC000552522166 568291243 /nfs/dbraw/zinc/29/12/43/568291243.db2.gz KEZZPYLZFBSUGW-KRWDZBQOSA-N 1 0 370.440 5.105 20 0 FKADRO FC(F)(F)COc1ccc(C[NH2+][C@@H](c2cccs2)C2CCCC2)cn1 ZINC000552522167 568291292 /nfs/dbraw/zinc/29/12/92/568291292.db2.gz KEZZPYLZFBSUGW-QGZVFWFLSA-N 1 0 370.440 5.105 20 0 FKADRO c1csc([C@@H]([NH2+]Cc2ccccc2Cn2ccnc2)C2CCCC2)c1 ZINC000552522392 568291289 /nfs/dbraw/zinc/29/12/89/568291289.db2.gz QSYIGAJEMWRIAG-NRFANRHFSA-N 1 0 351.519 5.014 20 0 FKADRO c1csc([C@H]([NH2+]Cc2ccccc2Cn2ccnc2)C2CCCC2)c1 ZINC000552522393 568291264 /nfs/dbraw/zinc/29/12/64/568291264.db2.gz QSYIGAJEMWRIAG-OAQYLSRUSA-N 1 0 351.519 5.014 20 0 FKADRO C[C@@H]([NH2+]C[C@H]1CCOC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000552536442 568270735 /nfs/dbraw/zinc/27/07/35/568270735.db2.gz FMFFUTRJABIIGL-CHWSQXEVSA-N 1 0 355.425 5.121 20 0 FKADRO C[C@@H]([NH2+]C[C@@H]1CCOC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000552536443 568270647 /nfs/dbraw/zinc/27/06/47/568270647.db2.gz FMFFUTRJABIIGL-OLZOCXBDSA-N 1 0 355.425 5.121 20 0 FKADRO C[C@H]([NH2+]C[C@H]1CCOC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000552536444 568270713 /nfs/dbraw/zinc/27/07/13/568270713.db2.gz FMFFUTRJABIIGL-QWHCGFSZSA-N 1 0 355.425 5.121 20 0 FKADRO C[C@H]([NH2+]C[C@@H]1CCOC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000552536445 568270739 /nfs/dbraw/zinc/27/07/39/568270739.db2.gz FMFFUTRJABIIGL-STQMWFEESA-N 1 0 355.425 5.121 20 0 FKADRO Cc1cccc([C@H](C)[NH2+]Cc2cccc(C(=O)Nc3ccccc3)c2)c1C ZINC000552536493 568270664 /nfs/dbraw/zinc/27/06/64/568270664.db2.gz HKXXIKCYBCJOEW-IBGZPJMESA-N 1 0 358.485 5.407 20 0 FKADRO Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C(=O)Nc3ccccc3)c2)c1C ZINC000552536494 568270751 /nfs/dbraw/zinc/27/07/51/568270751.db2.gz HKXXIKCYBCJOEW-LJQANCHMSA-N 1 0 358.485 5.407 20 0 FKADRO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)cs1 ZINC000552536517 568270728 /nfs/dbraw/zinc/27/07/28/568270728.db2.gz IDVIRNHTNFXJQF-APPDUMDISA-N 1 0 365.340 5.406 20 0 FKADRO Cc1nc([C@@H](C)[NH2+][C@H](c2ccc(Br)cc2)C2CCC2)cs1 ZINC000552536518 568270651 /nfs/dbraw/zinc/27/06/51/568270651.db2.gz IDVIRNHTNFXJQF-DIFFPNOSSA-N 1 0 365.340 5.406 20 0 FKADRO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(Br)cc2)C2CCC2)cs1 ZINC000552536519 568270742 /nfs/dbraw/zinc/27/07/42/568270742.db2.gz IDVIRNHTNFXJQF-GTNSWQLSSA-N 1 0 365.340 5.406 20 0 FKADRO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)cs1 ZINC000552536520 568270690 /nfs/dbraw/zinc/27/06/90/568270690.db2.gz IDVIRNHTNFXJQF-PIGZYNQJSA-N 1 0 365.340 5.406 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)COC3)ccc1OCC(C)C ZINC000552536658 568270693 /nfs/dbraw/zinc/27/06/93/568270693.db2.gz OJFDWYWCFKFYAG-DLBZAZTESA-N 1 0 369.505 5.172 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)COC3)ccc1OCC(C)C ZINC000552536659 568270719 /nfs/dbraw/zinc/27/07/19/568270719.db2.gz OJFDWYWCFKFYAG-IAGOWNOFSA-N 1 0 369.505 5.172 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)COC3)ccc1OCC(C)C ZINC000552536660 568270736 /nfs/dbraw/zinc/27/07/36/568270736.db2.gz OJFDWYWCFKFYAG-IRXDYDNUSA-N 1 0 369.505 5.172 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)COC3)ccc1OCC(C)C ZINC000552536661 568270746 /nfs/dbraw/zinc/27/07/46/568270746.db2.gz OJFDWYWCFKFYAG-SJORKVTESA-N 1 0 369.505 5.172 20 0 FKADRO CC(C)OCc1ccccc1C[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000552536773 568270704 /nfs/dbraw/zinc/27/07/04/568270704.db2.gz SZNUCWHTXDXWGV-OAHLLOKOSA-N 1 0 351.412 5.481 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](C)c2ccc(-c3csc(C)n3)cc2)ccc1O ZINC000552550007 568271637 /nfs/dbraw/zinc/27/16/37/568271637.db2.gz GLBAXCUZRJYJTE-AWEZNQCLSA-N 1 0 368.502 5.074 20 0 FKADRO CCOc1cc(C[NH2+][C@H](C)c2ccc(-c3csc(C)n3)cc2)ccc1O ZINC000552550008 568271644 /nfs/dbraw/zinc/27/16/44/568271644.db2.gz GLBAXCUZRJYJTE-CQSZACIVSA-N 1 0 368.502 5.074 20 0 FKADRO Cc1nc([C@@H](C)[NH2+]C[C@@H](C)Sc2ccc(Br)cc2)cs1 ZINC000552561785 568272248 /nfs/dbraw/zinc/27/22/48/568272248.db2.gz CMLCISQRWZDSLL-GHMZBOCLSA-N 1 0 371.369 5.045 20 0 FKADRO Cc1nc([C@H](C)[NH2+]C[C@@H](C)Sc2ccc(Br)cc2)cs1 ZINC000552561786 568272299 /nfs/dbraw/zinc/27/22/99/568272299.db2.gz CMLCISQRWZDSLL-MNOVXSKESA-N 1 0 371.369 5.045 20 0 FKADRO Cc1nc([C@H](C)[NH2+]C[C@H](C)Sc2ccc(Br)cc2)cs1 ZINC000552561787 568272215 /nfs/dbraw/zinc/27/22/15/568272215.db2.gz CMLCISQRWZDSLL-QWRGUYRKSA-N 1 0 371.369 5.045 20 0 FKADRO Cc1nc([C@@H](C)[NH2+]C[C@H](C)Sc2ccc(Br)cc2)cs1 ZINC000552561788 568272281 /nfs/dbraw/zinc/27/22/81/568272281.db2.gz CMLCISQRWZDSLL-WDEREUQCSA-N 1 0 371.369 5.045 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](Cc2ccccc2)c2sccc2C)ccc1O ZINC000552562141 568272291 /nfs/dbraw/zinc/27/22/91/568272291.db2.gz RLQISECPHFAIAZ-IBGZPJMESA-N 1 0 367.514 5.234 20 0 FKADRO CCOc1cc(C[NH2+][C@H](Cc2ccccc2)c2sccc2C)ccc1O ZINC000552562142 568272465 /nfs/dbraw/zinc/27/24/65/568272465.db2.gz RLQISECPHFAIAZ-LJQANCHMSA-N 1 0 367.514 5.234 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2Br)c1cnc2ccsc2c1 ZINC000552563934 568272417 /nfs/dbraw/zinc/27/24/17/568272417.db2.gz HSKAXLVQHWXKIL-BDJLRTHQSA-N 1 0 373.319 5.397 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2Br)c1cnc2ccsc2c1 ZINC000552563935 568272437 /nfs/dbraw/zinc/27/24/37/568272437.db2.gz HSKAXLVQHWXKIL-BZNIZROVSA-N 1 0 373.319 5.397 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2Br)c1cnc2ccsc2c1 ZINC000552563936 568272400 /nfs/dbraw/zinc/27/24/00/568272400.db2.gz HSKAXLVQHWXKIL-MEDUHNTESA-N 1 0 373.319 5.397 20 0 FKADRO C[C@H]([NH2+][C@H]1CCc2c1cccc2Br)c1cnc2ccsc2c1 ZINC000552563937 568272354 /nfs/dbraw/zinc/27/23/54/568272354.db2.gz HSKAXLVQHWXKIL-ZBEGNZNMSA-N 1 0 373.319 5.397 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)ccc1O ZINC000552564218 568272444 /nfs/dbraw/zinc/27/24/44/568272444.db2.gz XPSKVFNYMZOQEI-AWEZNQCLSA-N 1 0 368.502 5.074 20 0 FKADRO CCOc1cc(C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)ccc1O ZINC000552564219 568272454 /nfs/dbraw/zinc/27/24/54/568272454.db2.gz XPSKVFNYMZOQEI-CQSZACIVSA-N 1 0 368.502 5.074 20 0 FKADRO C[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000552570106 568272703 /nfs/dbraw/zinc/27/27/03/568272703.db2.gz VQJIVCSPFALXFA-BTYIYWSLSA-N 1 0 369.411 5.141 20 0 FKADRO C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000552570107 568272638 /nfs/dbraw/zinc/27/26/38/568272638.db2.gz VQJIVCSPFALXFA-QVKFZJNVSA-N 1 0 369.411 5.141 20 0 FKADRO C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000552570108 568272695 /nfs/dbraw/zinc/27/26/95/568272695.db2.gz VQJIVCSPFALXFA-VFNWGFHPSA-N 1 0 369.411 5.141 20 0 FKADRO C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000552570109 568272655 /nfs/dbraw/zinc/27/26/55/568272655.db2.gz VQJIVCSPFALXFA-YCRPNKLZSA-N 1 0 369.411 5.141 20 0 FKADRO Clc1ccc2c(c1)CC[C@H]2[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000552572699 568273073 /nfs/dbraw/zinc/27/30/73/568273073.db2.gz DCKKXIZDWNNEIY-GOSISDBHSA-N 1 0 369.921 5.068 20 0 FKADRO Clc1ccc2c(c1)CC[C@@H]2[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000552572700 568273182 /nfs/dbraw/zinc/27/31/82/568273182.db2.gz DCKKXIZDWNNEIY-SFHVURJKSA-N 1 0 369.921 5.068 20 0 FKADRO CC1(C)C[C@H]([NH2+]CCCc2nc(-c3ccncc3)cs2)c2ccccc21 ZINC000552573559 568273227 /nfs/dbraw/zinc/27/32/27/568273227.db2.gz OSJBTNRGHULFHV-IBGZPJMESA-N 1 0 363.530 5.150 20 0 FKADRO CC1(C)C[C@@H]([NH2+]CCCc2nc(-c3ccncc3)cs2)c2ccccc21 ZINC000552573560 568273184 /nfs/dbraw/zinc/27/31/84/568273184.db2.gz OSJBTNRGHULFHV-LJQANCHMSA-N 1 0 363.530 5.150 20 0 FKADRO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc([S@](C)=O)cc1)CCCO2 ZINC000552576122 568273510 /nfs/dbraw/zinc/27/35/10/568273510.db2.gz ORWGDCDTCLJOSF-JEIUEKOBSA-N 1 0 371.546 5.112 20 0 FKADRO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc([S@@](C)=O)cc1)CCCO2 ZINC000552576123 568273447 /nfs/dbraw/zinc/27/34/47/568273447.db2.gz ORWGDCDTCLJOSF-LNHOJHAFSA-N 1 0 371.546 5.112 20 0 FKADRO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)CCCO2 ZINC000552576124 568273401 /nfs/dbraw/zinc/27/34/01/568273401.db2.gz ORWGDCDTCLJOSF-ORPQDFNRSA-N 1 0 371.546 5.112 20 0 FKADRO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)CCCO2 ZINC000552576125 568273520 /nfs/dbraw/zinc/27/35/20/568273520.db2.gz ORWGDCDTCLJOSF-YGNPSHASSA-N 1 0 371.546 5.112 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cnn(Cc2ccccc2)c1)c1ccc(Cl)s1 ZINC000552577668 568273544 /nfs/dbraw/zinc/27/35/44/568273544.db2.gz BMLPRICFZSWKMN-PBHICJAKSA-N 1 0 359.926 5.448 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1cnn(Cc2ccccc2)c1)c1ccc(Cl)s1 ZINC000552577669 568273657 /nfs/dbraw/zinc/27/36/57/568273657.db2.gz BMLPRICFZSWKMN-RHSMWYFYSA-N 1 0 359.926 5.448 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccc(Cl)s1 ZINC000552577670 568273666 /nfs/dbraw/zinc/27/36/66/568273666.db2.gz BMLPRICFZSWKMN-WMLDXEAASA-N 1 0 359.926 5.448 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccc(Cl)s1 ZINC000552577671 568273635 /nfs/dbraw/zinc/27/36/35/568273635.db2.gz BMLPRICFZSWKMN-YOEHRIQHSA-N 1 0 359.926 5.448 20 0 FKADRO Cc1cncc(C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)c1 ZINC000552579589 568273624 /nfs/dbraw/zinc/27/36/24/568273624.db2.gz FXWRTFXXOIMPRC-NRFANRHFSA-N 1 0 354.856 5.256 20 0 FKADRO Cc1cncc(C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2Cl)c1 ZINC000552579590 568273536 /nfs/dbraw/zinc/27/35/36/568273536.db2.gz FXWRTFXXOIMPRC-OAQYLSRUSA-N 1 0 354.856 5.256 20 0 FKADRO Cc1nc([C@@H](C)[NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)cs1 ZINC000552581218 568273779 /nfs/dbraw/zinc/27/37/79/568273779.db2.gz MPMJVZJXXLTURS-LLVKDONJSA-N 1 0 363.939 5.122 20 0 FKADRO Cc1nc([C@H](C)[NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)cs1 ZINC000552581219 568273771 /nfs/dbraw/zinc/27/37/71/568273771.db2.gz MPMJVZJXXLTURS-NSHDSACASA-N 1 0 363.939 5.122 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(-c2ccccc2F)s1 ZINC000552581313 568273768 /nfs/dbraw/zinc/27/37/68/568273768.db2.gz QVAAZKVWGZEPEF-LHSJRXKWSA-N 1 0 352.478 5.751 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(-c2ccccc2F)s1 ZINC000552581314 568273730 /nfs/dbraw/zinc/27/37/30/568273730.db2.gz QVAAZKVWGZEPEF-QKKBWIMNSA-N 1 0 352.478 5.751 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(-c2ccccc2F)s1 ZINC000552581315 568273735 /nfs/dbraw/zinc/27/37/35/568273735.db2.gz QVAAZKVWGZEPEF-SPLOXXLWSA-N 1 0 352.478 5.751 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(-c2ccccc2F)s1 ZINC000552581316 568273723 /nfs/dbraw/zinc/27/37/23/568273723.db2.gz QVAAZKVWGZEPEF-SZNDQCEHSA-N 1 0 352.478 5.751 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000552581349 568273784 /nfs/dbraw/zinc/27/37/84/568273784.db2.gz SANXBSXLXXAYEM-DJJJIMSYSA-N 1 0 367.493 5.455 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000552581350 568273683 /nfs/dbraw/zinc/27/36/83/568273683.db2.gz SANXBSXLXXAYEM-ORAYPTAESA-N 1 0 367.493 5.455 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000552581351 568273679 /nfs/dbraw/zinc/27/36/79/568273679.db2.gz SANXBSXLXXAYEM-YJYMSZOUSA-N 1 0 367.493 5.455 20 0 FKADRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000552586214 568268505 /nfs/dbraw/zinc/26/85/05/568268505.db2.gz CTDHXZKYOIAEMT-SONRMIBWSA-N 1 0 351.512 5.178 20 0 FKADRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000552586215 568268513 /nfs/dbraw/zinc/26/85/13/568268513.db2.gz CTDHXZKYOIAEMT-SYWGBEHUSA-N 1 0 351.512 5.178 20 0 FKADRO CCCOc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)cc1OCCC ZINC000552588289 568268689 /nfs/dbraw/zinc/26/86/89/568268689.db2.gz VAOYRASCZCBQLB-HKUYNNGSSA-N 1 0 361.526 5.017 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)cc1OCCC ZINC000552588290 568268643 /nfs/dbraw/zinc/26/86/43/568268643.db2.gz VAOYRASCZCBQLB-IEBWSBKVSA-N 1 0 361.526 5.017 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)cc1OCCC ZINC000552588291 568268716 /nfs/dbraw/zinc/26/87/16/568268716.db2.gz VAOYRASCZCBQLB-MJGOQNOKSA-N 1 0 361.526 5.017 20 0 FKADRO CCCOc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)cc1OCCC ZINC000552588292 568268640 /nfs/dbraw/zinc/26/86/40/568268640.db2.gz VAOYRASCZCBQLB-PKOBYXMFSA-N 1 0 361.526 5.017 20 0 FKADRO COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H]3CCCC(F)(F)C3)s2)cc1 ZINC000552588365 568268730 /nfs/dbraw/zinc/26/87/30/568268730.db2.gz WXFWGINQUJJYJI-WFASDCNBSA-N 1 0 366.477 5.356 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cc(Cl)sc1Cl ZINC000552588451 568268707 /nfs/dbraw/zinc/26/87/07/568268707.db2.gz ZEYNWAJHHSGJFO-GHMZBOCLSA-N 1 0 366.379 5.150 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cc(Cl)sc1Cl ZINC000552588452 568268668 /nfs/dbraw/zinc/26/86/68/568268668.db2.gz ZEYNWAJHHSGJFO-MNOVXSKESA-N 1 0 366.379 5.150 20 0 FKADRO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cc(Cl)sc1Cl ZINC000552588453 568268661 /nfs/dbraw/zinc/26/86/61/568268661.db2.gz ZEYNWAJHHSGJFO-QWRGUYRKSA-N 1 0 366.379 5.150 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cc(Cl)sc1Cl ZINC000552588454 568268727 /nfs/dbraw/zinc/26/87/27/568268727.db2.gz ZEYNWAJHHSGJFO-WDEREUQCSA-N 1 0 366.379 5.150 20 0 FKADRO Cc1cc(C[NH2+]C[C@@H](c2c[nH]c3ccccc32)c2ccccc2Cl)no1 ZINC000552630705 568280615 /nfs/dbraw/zinc/28/06/15/568280615.db2.gz IJLSZMGOTQAPQR-GOSISDBHSA-N 1 0 365.864 5.039 20 0 FKADRO Cc1cc(C[NH2+]C[C@H](c2c[nH]c3ccccc32)c2ccccc2Cl)no1 ZINC000552630706 568280564 /nfs/dbraw/zinc/28/05/64/568280564.db2.gz IJLSZMGOTQAPQR-SFHVURJKSA-N 1 0 365.864 5.039 20 0 FKADRO Cc1ccc2nc(C[NH2+][C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2c1 ZINC000552753559 568282876 /nfs/dbraw/zinc/28/28/76/568282876.db2.gz IVUUQDBTAWWJBQ-IBGZPJMESA-N 1 0 360.288 5.190 20 0 FKADRO Cc1ccc2nc(C[NH2+][C@@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2c1 ZINC000552753560 568282847 /nfs/dbraw/zinc/28/28/47/568282847.db2.gz IVUUQDBTAWWJBQ-LJQANCHMSA-N 1 0 360.288 5.190 20 0 FKADRO Cc1ccccc1[C@@H]([NH2+][C@H](C)c1nc2ccccc2n1C(F)F)C1CC1 ZINC000552753726 568282857 /nfs/dbraw/zinc/28/28/57/568282857.db2.gz QGLODTHCGLQELE-KUHUBIRLSA-N 1 0 355.432 5.542 20 0 FKADRO Cc1ccccc1[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)C1CC1 ZINC000552753727 568282905 /nfs/dbraw/zinc/28/29/05/568282905.db2.gz QGLODTHCGLQELE-LIRRHRJNSA-N 1 0 355.432 5.542 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC000552760091 568282972 /nfs/dbraw/zinc/28/29/72/568282972.db2.gz NRCMCXWWSHMSTD-GFCCVEGCSA-N 1 0 360.885 5.762 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC000552760092 568282976 /nfs/dbraw/zinc/28/29/76/568282976.db2.gz NRCMCXWWSHMSTD-LBPRGKRZSA-N 1 0 360.885 5.762 20 0 FKADRO Fc1cc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)ccc1-n1ccnc1 ZINC000552761079 568283002 /nfs/dbraw/zinc/28/30/02/568283002.db2.gz GNQOEPAXMHJFKN-NRFANRHFSA-N 1 0 369.871 5.296 20 0 FKADRO Fc1cc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)ccc1-n1ccnc1 ZINC000552761080 568283147 /nfs/dbraw/zinc/28/31/47/568283147.db2.gz GNQOEPAXMHJFKN-OAQYLSRUSA-N 1 0 369.871 5.296 20 0 FKADRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2cnc(-c3ccccc3)s2)c1C ZINC000552761464 568283160 /nfs/dbraw/zinc/28/31/60/568283160.db2.gz TYCYYNGRINKMQE-UHFFFAOYSA-N 1 0 361.514 5.506 20 0 FKADRO CC(C)Cc1ccc([C@H](NCc2nc(-c3ccoc3)no2)C(C)C)cc1 ZINC000552800854 568288238 /nfs/dbraw/zinc/28/82/38/568288238.db2.gz LVDVOVKBWFAYNC-HXUWFJFHSA-N 1 0 353.466 5.015 20 0 FKADRO O=C(CCC[N@@H+]1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 ZINC000552823709 568291635 /nfs/dbraw/zinc/29/16/35/568291635.db2.gz FHUTWVUKRJTPHX-NRFANRHFSA-N 1 0 367.539 5.420 20 0 FKADRO O=C(CCC[N@@H+]1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 ZINC000552823710 568291706 /nfs/dbraw/zinc/29/17/06/568291706.db2.gz FHUTWVUKRJTPHX-OAQYLSRUSA-N 1 0 367.539 5.420 20 0 FKADRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1 ZINC000552828108 568292258 /nfs/dbraw/zinc/29/22/58/568292258.db2.gz IWRLSAXSSVTNRW-PBHICJAKSA-N 1 0 367.518 5.074 20 0 FKADRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1 ZINC000552828110 568292228 /nfs/dbraw/zinc/29/22/28/568292228.db2.gz IWRLSAXSSVTNRW-RHSMWYFYSA-N 1 0 367.518 5.074 20 0 FKADRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1 ZINC000552828112 568292305 /nfs/dbraw/zinc/29/23/05/568292305.db2.gz IWRLSAXSSVTNRW-WMLDXEAASA-N 1 0 367.518 5.074 20 0 FKADRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1 ZINC000552828114 568292285 /nfs/dbraw/zinc/29/22/85/568292285.db2.gz IWRLSAXSSVTNRW-YOEHRIQHSA-N 1 0 367.518 5.074 20 0 FKADRO O=C(CC[N@@H+]1CCC[C@@H]1C1CCCC1)Nc1ccccc1-c1ccccc1 ZINC000552836829 568292682 /nfs/dbraw/zinc/29/26/82/568292682.db2.gz WMFUSZBVJLPEMC-HSZRJFAPSA-N 1 0 362.517 5.337 20 0 FKADRO Cc1cc(C)c(NC(=O)Cc2cccc(OCc3ccccc3C)c2)c(C)n1 ZINC000552847304 568293580 /nfs/dbraw/zinc/29/35/80/568293580.db2.gz SCUNQADXEUKQOM-UHFFFAOYSA-N 1 0 374.484 5.075 20 0 FKADRO FC(F)(F)COc1ccc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)cc1 ZINC000552880309 568299675 /nfs/dbraw/zinc/29/96/75/568299675.db2.gz ZQVGOBPXXABQJP-CYBMUJFWSA-N 1 0 361.816 5.120 20 0 FKADRO FC(F)(F)COc1ccc(C[NH2+][C@H]2CCc3sc(Cl)cc32)cc1 ZINC000552880310 568299643 /nfs/dbraw/zinc/29/96/43/568299643.db2.gz ZQVGOBPXXABQJP-ZDUSSCGKSA-N 1 0 361.816 5.120 20 0 FKADRO CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(-c3ccncc3)c(C)c2)cc1 ZINC000552880582 568299710 /nfs/dbraw/zinc/29/97/10/568299710.db2.gz MGIPSGDJACAKSH-UHFFFAOYSA-N 1 0 373.500 5.151 20 0 FKADRO CC[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1)c1c(C)nn(C)c1C ZINC000552892823 568301063 /nfs/dbraw/zinc/30/10/63/568301063.db2.gz BACHDYXMSWZYJH-IFMALSPDSA-N 1 0 367.924 5.521 20 0 FKADRO CC[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1)c1c(C)nn(C)c1C ZINC000552892824 568301119 /nfs/dbraw/zinc/30/11/19/568301119.db2.gz BACHDYXMSWZYJH-IRLDBZIGSA-N 1 0 367.924 5.521 20 0 FKADRO CC[C@H]([NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1)c1c(C)nn(C)c1C ZINC000552892825 568301111 /nfs/dbraw/zinc/30/11/11/568301111.db2.gz BACHDYXMSWZYJH-RBBKRZOGSA-N 1 0 367.924 5.521 20 0 FKADRO CC[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1)c1c(C)nn(C)c1C ZINC000552892826 568301114 /nfs/dbraw/zinc/30/11/14/568301114.db2.gz BACHDYXMSWZYJH-UNMCSNQZSA-N 1 0 367.924 5.521 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)ccc1SC ZINC000552893036 568301117 /nfs/dbraw/zinc/30/11/17/568301117.db2.gz JRDLHKNHKDURGI-CXAGYDPISA-N 1 0 361.482 5.121 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)ccc1SC ZINC000552893037 568301076 /nfs/dbraw/zinc/30/10/76/568301076.db2.gz JRDLHKNHKDURGI-DYVFJYSZSA-N 1 0 361.482 5.121 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)ccc1SC ZINC000552893038 568301092 /nfs/dbraw/zinc/30/10/92/568301092.db2.gz JRDLHKNHKDURGI-GUYCJALGSA-N 1 0 361.482 5.121 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)ccc1SC ZINC000552893039 568301108 /nfs/dbraw/zinc/30/11/08/568301108.db2.gz JRDLHKNHKDURGI-SUMWQHHRSA-N 1 0 361.482 5.121 20 0 FKADRO C[C@H]([NH2+]CCCc1nccs1)c1cccc(OCc2ccccc2)c1 ZINC000552894086 568301210 /nfs/dbraw/zinc/30/12/10/568301210.db2.gz GEYPWEXNGOMRFV-KRWDZBQOSA-N 1 0 352.503 5.006 20 0 FKADRO C[C@@H]([NH2+]CCCc1nccs1)c1cccc(OCc2ccccc2)c1 ZINC000552894087 568301196 /nfs/dbraw/zinc/30/11/96/568301196.db2.gz GEYPWEXNGOMRFV-QGZVFWFLSA-N 1 0 352.503 5.006 20 0 FKADRO Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCc2nccs2)CCC3)cc1 ZINC000552894225 568301179 /nfs/dbraw/zinc/30/11/79/568301179.db2.gz LFRLHCSYEASAKS-INIZCTEOSA-N 1 0 369.559 5.175 20 0 FKADRO Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCc2nccs2)CCC3)cc1 ZINC000552894226 568301231 /nfs/dbraw/zinc/30/12/31/568301231.db2.gz LFRLHCSYEASAKS-MRXNPFEDSA-N 1 0 369.559 5.175 20 0 FKADRO Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCc2nccs2)CCC3)cc1 ZINC000552899127 568301214 /nfs/dbraw/zinc/30/12/14/568301214.db2.gz MKDJKMRIRKYNSG-HNNXBMFYSA-N 1 0 373.522 5.006 20 0 FKADRO Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCc2nccs2)CCC3)cc1 ZINC000552899128 568301230 /nfs/dbraw/zinc/30/12/30/568301230.db2.gz MKDJKMRIRKYNSG-OAHLLOKOSA-N 1 0 373.522 5.006 20 0 FKADRO Clc1cccc2c1SCC[C@H]2[NH2+]Cc1sccc1Br ZINC000552899724 568301224 /nfs/dbraw/zinc/30/12/24/568301224.db2.gz UTVHKGCDOIGDHZ-GFCCVEGCSA-N 1 0 374.756 5.491 20 0 FKADRO Clc1cccc2c1SCC[C@@H]2[NH2+]Cc1sccc1Br ZINC000552899725 568301212 /nfs/dbraw/zinc/30/12/12/568301212.db2.gz UTVHKGCDOIGDHZ-LBPRGKRZSA-N 1 0 374.756 5.491 20 0 FKADRO CC[C@H]([NH2+]CCc1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 ZINC000552899823 568301177 /nfs/dbraw/zinc/30/11/77/568301177.db2.gz WCJQKXJAJNLARU-KRWDZBQOSA-N 1 0 357.910 5.142 20 0 FKADRO CC[C@@H]([NH2+]CCc1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 ZINC000552899826 568301193 /nfs/dbraw/zinc/30/11/93/568301193.db2.gz WCJQKXJAJNLARU-QGZVFWFLSA-N 1 0 357.910 5.142 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCCc1cccc(Cl)c1 ZINC000552903248 568301180 /nfs/dbraw/zinc/30/11/80/568301180.db2.gz MVDKWVLAQDOVCF-AWEZNQCLSA-N 1 0 371.937 5.450 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCCc1cccc(Cl)c1 ZINC000552903249 568301211 /nfs/dbraw/zinc/30/12/11/568301211.db2.gz MVDKWVLAQDOVCF-CQSZACIVSA-N 1 0 371.937 5.450 20 0 FKADRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C ZINC000552907884 568301265 /nfs/dbraw/zinc/30/12/65/568301265.db2.gz XGMNHJOLPPOHKY-CXAGYDPISA-N 1 0 358.551 5.486 20 0 FKADRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C ZINC000552907885 568301300 /nfs/dbraw/zinc/30/13/00/568301300.db2.gz XGMNHJOLPPOHKY-DYVFJYSZSA-N 1 0 358.551 5.486 20 0 FKADRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C ZINC000552907886 568301263 /nfs/dbraw/zinc/30/12/63/568301263.db2.gz XGMNHJOLPPOHKY-GUYCJALGSA-N 1 0 358.551 5.486 20 0 FKADRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C ZINC000552907887 568301267 /nfs/dbraw/zinc/30/12/67/568301267.db2.gz XGMNHJOLPPOHKY-SUMWQHHRSA-N 1 0 358.551 5.486 20 0 FKADRO Cc1n[nH]cc1C[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000552911481 568298131 /nfs/dbraw/zinc/29/81/31/568298131.db2.gz BYLRHBPANSALLX-FQEVSTJZSA-N 1 0 373.472 5.010 20 0 FKADRO Cc1n[nH]cc1C[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000552911482 568298099 /nfs/dbraw/zinc/29/80/99/568298099.db2.gz BYLRHBPANSALLX-HXUWFJFHSA-N 1 0 373.472 5.010 20 0 FKADRO C[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccc(SC2CCCC2)cc1 ZINC000552911858 568298262 /nfs/dbraw/zinc/29/82/62/568298262.db2.gz RKVHCBCGTQLDHV-BTYIYWSLSA-N 1 0 359.510 5.245 20 0 FKADRO C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(SC2CCCC2)cc1 ZINC000552911859 568298209 /nfs/dbraw/zinc/29/82/09/568298209.db2.gz RKVHCBCGTQLDHV-QVKFZJNVSA-N 1 0 359.510 5.245 20 0 FKADRO C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccc(SC2CCCC2)cc1 ZINC000552911860 568298264 /nfs/dbraw/zinc/29/82/64/568298264.db2.gz RKVHCBCGTQLDHV-VFNWGFHPSA-N 1 0 359.510 5.245 20 0 FKADRO C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(SC2CCCC2)cc1 ZINC000552911861 568298203 /nfs/dbraw/zinc/29/82/03/568298203.db2.gz RKVHCBCGTQLDHV-YCRPNKLZSA-N 1 0 359.510 5.245 20 0 FKADRO CCCc1ccc([C@H]([NH2+][C@H](C)c2ccc([S@](C)=O)cc2)C(C)C)cc1 ZINC000552919344 568298271 /nfs/dbraw/zinc/29/82/71/568298271.db2.gz AHIOLAYXMRYTMZ-SEIFXHLTSA-N 1 0 357.563 5.424 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)cc2)ccc1SC ZINC000552919896 568298255 /nfs/dbraw/zinc/29/82/55/568298255.db2.gz OTPYCKVOFTVFQG-CVEARBPZSA-N 1 0 359.535 5.616 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)ccc1SC ZINC000552919901 568298234 /nfs/dbraw/zinc/29/82/34/568298234.db2.gz OTPYCKVOFTVFQG-HOTGVXAUSA-N 1 0 359.535 5.616 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)cc2)ccc1SC ZINC000552919902 568298232 /nfs/dbraw/zinc/29/82/32/568298232.db2.gz OTPYCKVOFTVFQG-HZPDHXFCSA-N 1 0 359.535 5.616 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)ccc1SC ZINC000552919903 568298268 /nfs/dbraw/zinc/29/82/68/568298268.db2.gz OTPYCKVOFTVFQG-JKSUJKDBSA-N 1 0 359.535 5.616 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H](C)c1c(C)noc1C ZINC000552930096 568299455 /nfs/dbraw/zinc/29/94/55/568299455.db2.gz NUDVGTVEYURCKR-JSGCOSHPSA-N 1 0 355.507 5.178 20 0 FKADRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000552930097 568299423 /nfs/dbraw/zinc/29/94/23/568299423.db2.gz NUDVGTVEYURCKR-OCCSQVGLSA-N 1 0 355.507 5.178 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@@H](C)c1c(C)noc1C ZINC000552930098 568299459 /nfs/dbraw/zinc/29/94/59/568299459.db2.gz NUDVGTVEYURCKR-TZMCWYRMSA-N 1 0 355.507 5.178 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000552931085 568299496 /nfs/dbraw/zinc/29/94/96/568299496.db2.gz CEAUXIWENSLLFT-CEXWTWQISA-N 1 0 367.455 5.423 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000552931086 568299477 /nfs/dbraw/zinc/29/94/77/568299477.db2.gz CEAUXIWENSLLFT-FHWLQOOXSA-N 1 0 367.455 5.423 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000552931087 568299467 /nfs/dbraw/zinc/29/94/67/568299467.db2.gz CEAUXIWENSLLFT-GBESFXJTSA-N 1 0 367.455 5.423 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000552931088 568299494 /nfs/dbraw/zinc/29/94/94/568299494.db2.gz CEAUXIWENSLLFT-QYZOEREBSA-N 1 0 367.455 5.423 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000552931247 568299500 /nfs/dbraw/zinc/29/95/00/568299500.db2.gz HTTIAFXQUUZOIO-GDBMZVCRSA-N 1 0 357.416 5.118 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000552931248 568299481 /nfs/dbraw/zinc/29/94/81/568299481.db2.gz HTTIAFXQUUZOIO-GOEBONIOSA-N 1 0 357.416 5.118 20 0 FKADRO C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000552931249 568299470 /nfs/dbraw/zinc/29/94/70/568299470.db2.gz HTTIAFXQUUZOIO-HOCLYGCPSA-N 1 0 357.416 5.118 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000552931250 568299513 /nfs/dbraw/zinc/29/95/13/568299513.db2.gz HTTIAFXQUUZOIO-ZBFHGGJFSA-N 1 0 357.416 5.118 20 0 FKADRO CC1(C)CC[C@@H](C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)c2ccccc21 ZINC000552931444 568299480 /nfs/dbraw/zinc/29/94/80/568299480.db2.gz NVJXZABCCJDWRD-CYFREDJKSA-N 1 0 371.528 5.205 20 0 FKADRO CC1(C)CC[C@@H](C[NH2+][C@H](Cc2ccccn2)c2cccnc2)c2ccccc21 ZINC000552931447 568299476 /nfs/dbraw/zinc/29/94/76/568299476.db2.gz NVJXZABCCJDWRD-YADARESESA-N 1 0 371.528 5.205 20 0 FKADRO CCC[C@@H](NCc1nc([C@H](C)OCC)no1)c1ccc(Cl)c(Cl)c1 ZINC000552946919 568298374 /nfs/dbraw/zinc/29/83/74/568298374.db2.gz BGFAEICGOMTOJN-XHDPSFHLSA-N 1 0 372.296 5.105 20 0 FKADRO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](c1ccccc1)C1CCCC1 ZINC000552947555 568299517 /nfs/dbraw/zinc/29/95/17/568299517.db2.gz VJCYZAPNOVKCJQ-FQEVSTJZSA-N 1 0 352.503 5.733 20 0 FKADRO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](c1ccccc1)C1CCCC1 ZINC000552947556 568299554 /nfs/dbraw/zinc/29/95/54/568299554.db2.gz VJCYZAPNOVKCJQ-HXUWFJFHSA-N 1 0 352.503 5.733 20 0 FKADRO Clc1ccc(C2([NH2+]Cc3ccc(OCc4cccnc4)cc3)CC2)cc1 ZINC000553002639 568307318 /nfs/dbraw/zinc/30/73/18/568307318.db2.gz BPKDBTHPAKLECZ-UHFFFAOYSA-N 1 0 364.876 5.093 20 0 FKADRO CCOc1cc(CN[C@H](c2cc3ccccc3o2)c2ccccc2)ccc1O ZINC000553012367 568305069 /nfs/dbraw/zinc/30/50/69/568305069.db2.gz KZXNUEBBCDIKFC-DEOSSOPVSA-N 1 0 373.452 5.416 20 0 FKADRO CCOc1cc(CN[C@@H](c2cc3ccccc3o2)c2ccccc2)ccc1O ZINC000553012371 568305077 /nfs/dbraw/zinc/30/50/77/568305077.db2.gz KZXNUEBBCDIKFC-XMMPIXPASA-N 1 0 373.452 5.416 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)cc1 ZINC000553091656 568312007 /nfs/dbraw/zinc/31/20/07/568312007.db2.gz DCEZGOJYEKASHW-CABCVRRESA-N 1 0 373.447 5.630 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)cc1 ZINC000553091657 568312002 /nfs/dbraw/zinc/31/20/02/568312002.db2.gz DCEZGOJYEKASHW-GJZGRUSLSA-N 1 0 373.447 5.630 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)cc1 ZINC000553091658 568311997 /nfs/dbraw/zinc/31/19/97/568311997.db2.gz DCEZGOJYEKASHW-HUUCEWRRSA-N 1 0 373.447 5.630 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)cc1 ZINC000553091659 568311985 /nfs/dbraw/zinc/31/19/85/568311985.db2.gz DCEZGOJYEKASHW-LSDHHAIUSA-N 1 0 373.447 5.630 20 0 FKADRO O=C(Nc1cccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1)c1cccc(F)c1 ZINC000553093509 568312111 /nfs/dbraw/zinc/31/21/11/568312111.db2.gz HMRBRHCMPAVVEK-HSZRJFAPSA-N 1 0 374.459 5.319 20 0 FKADRO O=C(Nc1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1)c1cccc(F)c1 ZINC000553093510 568312098 /nfs/dbraw/zinc/31/20/98/568312098.db2.gz HMRBRHCMPAVVEK-QHCPKHFHSA-N 1 0 374.459 5.319 20 0 FKADRO c1cn(Cc2ccccc2C[NH2+][C@H](c2ccccc2)C2CCCCC2)cn1 ZINC000553095125 568312266 /nfs/dbraw/zinc/31/22/66/568312266.db2.gz HFSQBIMTRRWAAU-XMMPIXPASA-N 1 0 359.517 5.343 20 0 FKADRO CCOc1c(OC)cc(C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)cc1OC ZINC000553095134 568312300 /nfs/dbraw/zinc/31/23/00/568312300.db2.gz HMGVRNMLKJXLPD-NRFANRHFSA-N 1 0 373.493 5.025 20 0 FKADRO CCOc1c(OC)cc(C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)cc1OC ZINC000553095135 568312248 /nfs/dbraw/zinc/31/22/48/568312248.db2.gz HMGVRNMLKJXLPD-OAQYLSRUSA-N 1 0 373.493 5.025 20 0 FKADRO Cc1cn2c(n1)[C@@H](C[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C)CCC2 ZINC000553098308 568313117 /nfs/dbraw/zinc/31/31/17/568313117.db2.gz QVDJLLJEZJOVOV-AEFFLSMTSA-N 1 0 365.443 5.075 20 0 FKADRO Cc1cn2c(n1)[C@H](C[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C)CCC2 ZINC000553098312 568313138 /nfs/dbraw/zinc/31/31/38/568313138.db2.gz QVDJLLJEZJOVOV-FUHWJXTLSA-N 1 0 365.443 5.075 20 0 FKADRO Cc1cn2c(n1)[C@@H](C[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C)CCC2 ZINC000553098313 568313173 /nfs/dbraw/zinc/31/31/73/568313173.db2.gz QVDJLLJEZJOVOV-SJLPKXTDSA-N 1 0 365.443 5.075 20 0 FKADRO Cc1cn2c(n1)[C@H](C[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C)CCC2 ZINC000553098315 568313208 /nfs/dbraw/zinc/31/32/08/568313208.db2.gz QVDJLLJEZJOVOV-WMZOPIPTSA-N 1 0 365.443 5.075 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)c1nc2ccccc2n1C(F)F ZINC000553100896 568313625 /nfs/dbraw/zinc/31/36/25/568313625.db2.gz DVJBJBHLUPWHQU-BFUOFWGJSA-N 1 0 373.422 5.763 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)c1nc2ccccc2n1C(F)F ZINC000553100897 568313579 /nfs/dbraw/zinc/31/35/79/568313579.db2.gz DVJBJBHLUPWHQU-DJJJIMSYSA-N 1 0 373.422 5.763 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)c1nc2ccccc2n1C(F)F ZINC000553100898 568313649 /nfs/dbraw/zinc/31/36/49/568313649.db2.gz DVJBJBHLUPWHQU-ORAYPTAESA-N 1 0 373.422 5.763 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)c1nc2ccccc2n1C(F)F ZINC000553100899 568313651 /nfs/dbraw/zinc/31/36/51/568313651.db2.gz DVJBJBHLUPWHQU-YJYMSZOUSA-N 1 0 373.422 5.763 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 ZINC000553101040 568313784 /nfs/dbraw/zinc/31/37/84/568313784.db2.gz MNCXBILHRIBJIQ-MNOVXSKESA-N 1 0 369.868 5.948 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 ZINC000553101041 568313854 /nfs/dbraw/zinc/31/38/54/568313854.db2.gz MNCXBILHRIBJIQ-QWRGUYRKSA-N 1 0 369.868 5.948 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 ZINC000553101042 568313850 /nfs/dbraw/zinc/31/38/50/568313850.db2.gz MNCXBILHRIBJIQ-WDEREUQCSA-N 1 0 369.868 5.948 20 0 FKADRO CCCCn1cc(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)c(C)n1 ZINC000553102785 568312158 /nfs/dbraw/zinc/31/21/58/568312158.db2.gz GIQGCDKOADEDGP-NRFANRHFSA-N 1 0 367.537 5.308 20 0 FKADRO CCCCn1cc(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)c(C)n1 ZINC000553102786 568312137 /nfs/dbraw/zinc/31/21/37/568312137.db2.gz GIQGCDKOADEDGP-OAQYLSRUSA-N 1 0 367.537 5.308 20 0 FKADRO CCOc1cc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)ccc1O ZINC000553103057 568317382 /nfs/dbraw/zinc/31/73/82/568317382.db2.gz YBJKXMBPLIVMTB-IBGZPJMESA-N 1 0 367.411 5.297 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)ccc1O ZINC000553103058 568317400 /nfs/dbraw/zinc/31/74/00/568317400.db2.gz YBJKXMBPLIVMTB-LJQANCHMSA-N 1 0 367.411 5.297 20 0 FKADRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1sc(-c2ccccc2F)nc1C ZINC000553103082 568317432 /nfs/dbraw/zinc/31/74/32/568317432.db2.gz ZSJCLSKELHWNTK-KGLIPLIRSA-N 1 0 369.509 5.627 20 0 FKADRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1sc(-c2ccccc2F)nc1C ZINC000553103083 568317429 /nfs/dbraw/zinc/31/74/29/568317429.db2.gz ZSJCLSKELHWNTK-UONOGXRCSA-N 1 0 369.509 5.627 20 0 FKADRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1sc(-c2ccccc2F)nc1C ZINC000553103084 568317394 /nfs/dbraw/zinc/31/73/94/568317394.db2.gz ZSJCLSKELHWNTK-ZIAGYGMSSA-N 1 0 369.509 5.627 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000553103885 568317440 /nfs/dbraw/zinc/31/74/40/568317440.db2.gz BIOZHUYCBHMQTF-SSHHRWTQSA-N 1 0 371.431 5.035 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)[C@@H]1Oc2ccccc2[C@H]1C ZINC000553103886 568317483 /nfs/dbraw/zinc/31/74/83/568317483.db2.gz BIOZHUYCBHMQTF-VYGYDYRJSA-N 1 0 371.431 5.035 20 0 FKADRO C[C@@H]([NH2+]CCSc1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000553104403 568317456 /nfs/dbraw/zinc/31/74/56/568317456.db2.gz YTMFYUHRBZYWHE-GFCCVEGCSA-N 1 0 365.424 5.013 20 0 FKADRO C[C@H]([NH2+]CCSc1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000553104404 568317461 /nfs/dbraw/zinc/31/74/61/568317461.db2.gz YTMFYUHRBZYWHE-LBPRGKRZSA-N 1 0 365.424 5.013 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3cccc(-c4cccnc4)c3)CC2)c1 ZINC000553214630 568320107 /nfs/dbraw/zinc/32/01/07/568320107.db2.gz WVZCTGFQVGABNG-UHFFFAOYSA-N 1 0 368.402 5.546 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(OCc2cccnc2)cc1 ZINC000553220049 568320230 /nfs/dbraw/zinc/32/02/30/568320230.db2.gz ZMPSLKGNKXEFGC-MRXNPFEDSA-N 1 0 352.865 5.165 20 0 FKADRO COc1ccc2cc([C@@H](C)[NH2+][C@@H](C)c3ccccc3-n3cccn3)ccc2c1 ZINC000553261851 568317887 /nfs/dbraw/zinc/31/78/87/568317887.db2.gz WDIADRDDWWZMPS-MSOLQXFVSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc2cc([C@@H](C)[NH2+][C@H](C)c3ccccc3-n3cccn3)ccc2c1 ZINC000553261852 568317866 /nfs/dbraw/zinc/31/78/66/568317866.db2.gz WDIADRDDWWZMPS-QZTJIDSGSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3ccccc3-n3cccn3)ccc2c1 ZINC000553261853 568317916 /nfs/dbraw/zinc/31/79/16/568317916.db2.gz WDIADRDDWWZMPS-ROUUACIJSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc2cc([C@H](C)[NH2+][C@H](C)c3ccccc3-n3cccn3)ccc2c1 ZINC000553261854 568317927 /nfs/dbraw/zinc/31/79/27/568317927.db2.gz WDIADRDDWWZMPS-ZWKOTPCHSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000553284657 568324799 /nfs/dbraw/zinc/32/47/99/568324799.db2.gz ASTVTAJEKVGRPD-CYBMUJFWSA-N 1 0 356.466 5.117 20 0 FKADRO Clc1ccc(-c2cnc(CNC3(c4ccc(Cl)cc4)CC3)o2)cc1 ZINC000553337938 568335547 /nfs/dbraw/zinc/33/55/47/568335547.db2.gz BQUUOZRPGRLFIH-UHFFFAOYSA-N 1 0 359.256 5.427 20 0 FKADRO C[C@H](NCc1nc(C(C)(C)C)cs1)c1cccc(OC(F)(F)F)c1 ZINC000553409244 568354352 /nfs/dbraw/zinc/35/43/52/568354352.db2.gz QLZDDBICIJNYEJ-NSHDSACASA-N 1 0 358.429 5.190 20 0 FKADRO Clc1ccc2c(c1Cl)OCCC[C@H]2[NH2+]Cc1ccc2ccccc2n1 ZINC000553422037 568368639 /nfs/dbraw/zinc/36/86/39/568368639.db2.gz RPHQYCYRDUGMGW-GOSISDBHSA-N 1 0 373.283 5.545 20 0 FKADRO Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+]Cc1ccc2ccccc2n1 ZINC000553422038 568368614 /nfs/dbraw/zinc/36/86/14/568368614.db2.gz RPHQYCYRDUGMGW-SFHVURJKSA-N 1 0 373.283 5.545 20 0 FKADRO Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1 ZINC000553433976 568371076 /nfs/dbraw/zinc/37/10/76/568371076.db2.gz AZYASFFKRCYEGR-UHFFFAOYSA-N 1 0 367.459 5.299 20 0 FKADRO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2F)ccc1Oc1cccnc1 ZINC000553496464 568394842 /nfs/dbraw/zinc/39/48/42/568394842.db2.gz OLERUBZWZWTSNO-HNNXBMFYSA-N 1 0 354.400 5.311 20 0 FKADRO FC(F)(F)CCC[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000553508433 568394928 /nfs/dbraw/zinc/39/49/28/568394928.db2.gz YUAPESCKZAJLHJ-UHFFFAOYSA-N 1 0 373.422 5.031 20 0 FKADRO CC(C)([NH2+]Cc1ccc(-c2ccncc2)cc1F)c1ccc(F)c(F)c1 ZINC000553537220 568395354 /nfs/dbraw/zinc/39/53/54/568395354.db2.gz GHNYVNDNWREEHD-UHFFFAOYSA-N 1 0 356.391 5.191 20 0 FKADRO Cc1ccc(CN[C@@H](c2ccccc2)c2ccccn2)cc1Br ZINC000553548328 568395506 /nfs/dbraw/zinc/39/55/06/568395506.db2.gz LQFQLFZWWAJSOB-FQEVSTJZSA-N 1 0 367.290 5.032 20 0 FKADRO Cc1ccc(CN[C@H](c2ccccc2)c2ccccn2)cc1Br ZINC000553548329 568395551 /nfs/dbraw/zinc/39/55/51/568395551.db2.gz LQFQLFZWWAJSOB-HXUWFJFHSA-N 1 0 367.290 5.032 20 0 FKADRO CCn1ccnc1[C@@H]1CCCCN1C(=O)c1coc2ccc(C(C)C)cc12 ZINC000553548956 568395555 /nfs/dbraw/zinc/39/55/55/568395555.db2.gz MCXRHRMNJGKMHC-IBGZPJMESA-N 1 0 365.477 5.140 20 0 FKADRO CCn1ccnc1[C@H]1CCCCN1C(=O)c1coc2ccc(C(C)C)cc12 ZINC000553548957 568395557 /nfs/dbraw/zinc/39/55/57/568395557.db2.gz MCXRHRMNJGKMHC-LJQANCHMSA-N 1 0 365.477 5.140 20 0 FKADRO Clc1cccc(C2([NH2+]Cc3cnc(-c4ccncc4)s3)CCCC2)c1 ZINC000553579977 568395757 /nfs/dbraw/zinc/39/57/57/568395757.db2.gz BYJIOJZTOSHEPR-UHFFFAOYSA-N 1 0 369.921 5.418 20 0 FKADRO Cc1cc2ncc([C@H](C)[NH2+][C@@H]3C[C@@H]4CCC(C)(C)c5cccc3c54)c(C)n2n1 ZINC000553623590 568395997 /nfs/dbraw/zinc/39/59/97/568395997.db2.gz BMERGKORXJPLSV-HZUJVAHNSA-N 1 0 374.532 5.297 20 0 FKADRO Cc1cc2ncc([C@H](C)[NH2+][C@@H]3C[C@H]4CCC(C)(C)c5cccc3c54)c(C)n2n1 ZINC000553623591 568396016 /nfs/dbraw/zinc/39/60/16/568396016.db2.gz BMERGKORXJPLSV-LUQKVYGDSA-N 1 0 374.532 5.297 20 0 FKADRO Cc1cc2ncc([C@H](C)[NH2+][C@H]3C[C@@H]4CCC(C)(C)c5cccc3c54)c(C)n2n1 ZINC000553623592 568396013 /nfs/dbraw/zinc/39/60/13/568396013.db2.gz BMERGKORXJPLSV-WJPUGNRLSA-N 1 0 374.532 5.297 20 0 FKADRO Cc1cc2ncc([C@H](C)[NH2+][C@H]3C[C@H]4CCC(C)(C)c5cccc3c54)c(C)n2n1 ZINC000553623593 568395991 /nfs/dbraw/zinc/39/59/91/568395991.db2.gz BMERGKORXJPLSV-XPIZARPCSA-N 1 0 374.532 5.297 20 0 FKADRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(Cl)c(Br)c1)C(C)C ZINC000553651678 568396228 /nfs/dbraw/zinc/39/62/28/568396228.db2.gz GMWAIJGYCIPHGR-INIZCTEOSA-N 1 0 367.718 5.293 20 0 FKADRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(Cl)c(Br)c1)C(C)C ZINC000553651679 568396214 /nfs/dbraw/zinc/39/62/14/568396214.db2.gz GMWAIJGYCIPHGR-MRXNPFEDSA-N 1 0 367.718 5.293 20 0 FKADRO Cc1nc(C[N@@H+](C)[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)oc1C ZINC000553724739 568396836 /nfs/dbraw/zinc/39/68/36/568396836.db2.gz BCMPBCBQGXVHQZ-DLBZAZTESA-N 1 0 352.400 5.078 20 0 FKADRO Cc1nc(C[N@@H+](C)[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)oc1C ZINC000553724744 568396832 /nfs/dbraw/zinc/39/68/32/568396832.db2.gz BCMPBCBQGXVHQZ-IAGOWNOFSA-N 1 0 352.400 5.078 20 0 FKADRO Cc1nc(C[N@@H+](C)[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)oc1C ZINC000553724746 568396870 /nfs/dbraw/zinc/39/68/70/568396870.db2.gz BCMPBCBQGXVHQZ-SJORKVTESA-N 1 0 352.400 5.078 20 0 FKADRO C[N@H+](Cc1ncc(C2CC2)o1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000553726860 568399926 /nfs/dbraw/zinc/39/99/26/568399926.db2.gz OBRHPYXUMIZKRL-SJORKVTESA-N 1 0 364.411 5.339 20 0 FKADRO COc1cc(C)c(C[NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000553772037 568400295 /nfs/dbraw/zinc/40/02/95/568400295.db2.gz YZGTVVUCNOYRPS-UHFFFAOYSA-N 1 0 367.411 5.056 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)ccc1OCCC(C)C ZINC000553777390 568400386 /nfs/dbraw/zinc/40/03/86/568400386.db2.gz SDPRNJGEZVQTBD-HNNXBMFYSA-N 1 0 362.901 5.019 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)ccc1OCCC(C)C ZINC000553777391 568400397 /nfs/dbraw/zinc/40/03/97/568400397.db2.gz SDPRNJGEZVQTBD-OAHLLOKOSA-N 1 0 362.901 5.019 20 0 FKADRO O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1c[nH]cc1-c1ccccc1 ZINC000553818695 568400855 /nfs/dbraw/zinc/40/08/55/568400855.db2.gz AQKVQGWFQKWIGL-UHFFFAOYSA-N 1 0 373.500 5.310 20 0 FKADRO CCCC[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000553836179 568400982 /nfs/dbraw/zinc/40/09/82/568400982.db2.gz IPXNREXNMWMPHP-UHFFFAOYSA-N 1 0 357.325 5.367 20 0 FKADRO CC(C)C[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1 ZINC000553849048 568401065 /nfs/dbraw/zinc/40/10/65/568401065.db2.gz AZNCVFWSMLPAPC-UHFFFAOYSA-N 1 0 365.304 5.090 20 0 FKADRO Fc1cccc([C@@H]([NH2+]Cc2cnc(-c3ccncc3)s2)C2CCCC2)c1 ZINC000553853167 568401194 /nfs/dbraw/zinc/40/11/94/568401194.db2.gz PODGCGDCJIJOCE-FQEVSTJZSA-N 1 0 367.493 5.365 20 0 FKADRO Fc1cccc([C@H]([NH2+]Cc2cnc(-c3ccncc3)s2)C2CCCC2)c1 ZINC000553853169 568401191 /nfs/dbraw/zinc/40/11/91/568401191.db2.gz PODGCGDCJIJOCE-HXUWFJFHSA-N 1 0 367.493 5.365 20 0 FKADRO C[C@@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(-c2ccccc2)o1 ZINC000553858270 568401225 /nfs/dbraw/zinc/40/12/25/568401225.db2.gz ACWQFZDIGAJMQX-GOSISDBHSA-N 1 0 357.457 5.042 20 0 FKADRO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc(-c2ccccc2)o1 ZINC000553858271 568401232 /nfs/dbraw/zinc/40/12/32/568401232.db2.gz ACWQFZDIGAJMQX-SFHVURJKSA-N 1 0 357.457 5.042 20 0 FKADRO CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000553875932 568401369 /nfs/dbraw/zinc/40/13/69/568401369.db2.gz HBJJPUVYECNHMW-FQEVSTJZSA-N 1 0 350.506 5.036 20 0 FKADRO CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000553875936 568401328 /nfs/dbraw/zinc/40/13/28/568401328.db2.gz HBJJPUVYECNHMW-HXUWFJFHSA-N 1 0 350.506 5.036 20 0 FKADRO c1ccc(C(OCC[N@@H+]2CCC[C@H]2c2cccnc2)c2ccccc2)cc1 ZINC000553888417 568401463 /nfs/dbraw/zinc/40/14/63/568401463.db2.gz FYMCAZJEUPQRHL-QHCPKHFHSA-N 1 0 358.485 5.025 20 0 FKADRO FC(F)(F)c1ccccc1OCCCC[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000553889136 568401493 /nfs/dbraw/zinc/40/14/93/568401493.db2.gz JODFQDRITIWCND-GOSISDBHSA-N 1 0 364.411 5.097 20 0 FKADRO FC(F)(F)c1ccccc1OCCCC[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000553889137 568401507 /nfs/dbraw/zinc/40/15/07/568401507.db2.gz JODFQDRITIWCND-SFHVURJKSA-N 1 0 364.411 5.097 20 0 FKADRO CC(C)c1oc([C@@H]2CCC[N@@H+]2CCOC2CCC2)nc1-c1ccccc1 ZINC000553889216 568401654 /nfs/dbraw/zinc/40/16/54/568401654.db2.gz QRVNRJOXGXZXJP-IBGZPJMESA-N 1 0 354.494 5.171 20 0 FKADRO CC(C)c1oc([C@H]2CCC[N@@H+]2CCOC2CCC2)nc1-c1ccccc1 ZINC000553889217 568401649 /nfs/dbraw/zinc/40/16/49/568401649.db2.gz QRVNRJOXGXZXJP-LJQANCHMSA-N 1 0 354.494 5.171 20 0 FKADRO COc1ccncc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000553889900 568401672 /nfs/dbraw/zinc/40/16/72/568401672.db2.gz XNJNCOUJNUNGCA-UHFFFAOYSA-N 1 0 364.411 5.058 20 0 FKADRO CC(C)C[C@](C)([NH2+]Cc1cncc(F)c1)c1cccc(Br)c1 ZINC000553897759 568401776 /nfs/dbraw/zinc/40/17/76/568401776.db2.gz UHTCZBWUDOEYPF-SFHVURJKSA-N 1 0 365.290 5.034 20 0 FKADRO Fc1ccccc1[C@@H]([NH2+]Cc1cnc(-c2ccncc2)s1)C1CCCC1 ZINC000553900527 568401834 /nfs/dbraw/zinc/40/18/34/568401834.db2.gz KCYULNFWDGTBFF-FQEVSTJZSA-N 1 0 367.493 5.365 20 0 FKADRO Fc1ccccc1[C@H]([NH2+]Cc1cnc(-c2ccncc2)s1)C1CCCC1 ZINC000553900528 568401882 /nfs/dbraw/zinc/40/18/82/568401882.db2.gz KCYULNFWDGTBFF-HXUWFJFHSA-N 1 0 367.493 5.365 20 0 FKADRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000553907010 568401919 /nfs/dbraw/zinc/40/19/19/568401919.db2.gz INTPTWFFEOMSQP-FOIQADDNSA-N 1 0 358.913 5.216 20 0 FKADRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000553907011 568401900 /nfs/dbraw/zinc/40/19/00/568401900.db2.gz INTPTWFFEOMSQP-MGPUTAFESA-N 1 0 358.913 5.216 20 0 FKADRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000553907012 568401932 /nfs/dbraw/zinc/40/19/32/568401932.db2.gz INTPTWFFEOMSQP-QRWLVFNGSA-N 1 0 358.913 5.216 20 0 FKADRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000553907014 568401902 /nfs/dbraw/zinc/40/19/02/568401902.db2.gz INTPTWFFEOMSQP-YWZLYKJASA-N 1 0 358.913 5.216 20 0 FKADRO Cc1ccsc1[C@@H](CO)[NH2+]Cc1cccc(SCc2ccccc2)c1 ZINC000553909996 568401938 /nfs/dbraw/zinc/40/19/38/568401938.db2.gz BRGXDEYXCIOWQH-HXUWFJFHSA-N 1 0 369.555 5.172 20 0 FKADRO COc1cc([C@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)ccc1SC ZINC000553910214 568401921 /nfs/dbraw/zinc/40/19/21/568401921.db2.gz IBLBKNQOKCBVNQ-ZDUSSCGKSA-N 1 0 363.473 5.425 20 0 FKADRO Cc1ncc([C@@H](C)[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c(C)n1 ZINC000553920920 568401971 /nfs/dbraw/zinc/40/19/71/568401971.db2.gz RSYMDCSDUXVTEL-ACJLOTCBSA-N 1 0 365.443 5.550 20 0 FKADRO Cc1ncc([C@@H](C)[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c(C)n1 ZINC000553920921 568401984 /nfs/dbraw/zinc/40/19/84/568401984.db2.gz RSYMDCSDUXVTEL-FZKQIMNGSA-N 1 0 365.443 5.550 20 0 FKADRO Cc1ncc([C@H](C)[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c(C)n1 ZINC000553920922 568401973 /nfs/dbraw/zinc/40/19/73/568401973.db2.gz RSYMDCSDUXVTEL-SCLBCKFNSA-N 1 0 365.443 5.550 20 0 FKADRO Cc1ncc([C@H](C)[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c(C)n1 ZINC000553920923 568402004 /nfs/dbraw/zinc/40/20/04/568402004.db2.gz RSYMDCSDUXVTEL-UGSOOPFHSA-N 1 0 365.443 5.550 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OC)c(OC)c2C)cc1Cl ZINC000553958814 568402199 /nfs/dbraw/zinc/40/21/99/568402199.db2.gz RMVXZHXSACCECD-KBPBESRZSA-N 1 0 363.885 5.086 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)c(OC)c2C)cc1Cl ZINC000553958823 568402197 /nfs/dbraw/zinc/40/21/97/568402197.db2.gz RMVXZHXSACCECD-KGLIPLIRSA-N 1 0 363.885 5.086 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OC)c(OC)c2C)cc1Cl ZINC000553958825 568402230 /nfs/dbraw/zinc/40/22/30/568402230.db2.gz RMVXZHXSACCECD-UONOGXRCSA-N 1 0 363.885 5.086 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OC)c(OC)c2C)cc1Cl ZINC000553958826 568402225 /nfs/dbraw/zinc/40/22/25/568402225.db2.gz RMVXZHXSACCECD-ZIAGYGMSSA-N 1 0 363.885 5.086 20 0 FKADRO C[N@H+](Cc1cc(Br)cc2cccnc21)C1CCC(F)(F)CC1 ZINC000553986746 568402503 /nfs/dbraw/zinc/40/25/03/568402503.db2.gz DZQUUYJHNKQFRA-UHFFFAOYSA-N 1 0 369.253 5.007 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c3ccccc3)cc12 ZINC000554048693 568398572 /nfs/dbraw/zinc/39/85/72/568398572.db2.gz AEZGWTJYZITMIA-DOMZBBRYSA-N 1 0 367.440 5.288 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@H](CC(F)(F)F)c3ccccc3)cc12 ZINC000554048697 568398576 /nfs/dbraw/zinc/39/85/76/568398576.db2.gz AEZGWTJYZITMIA-IUODEOHRSA-N 1 0 367.440 5.288 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@H](CC(F)(F)F)c3ccccc3)cc12 ZINC000554048700 568398610 /nfs/dbraw/zinc/39/86/10/568398610.db2.gz AEZGWTJYZITMIA-SWLSCSKDSA-N 1 0 367.440 5.288 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@@H](CC(F)(F)F)c3ccccc3)cc12 ZINC000554048702 568398606 /nfs/dbraw/zinc/39/86/06/568398606.db2.gz AEZGWTJYZITMIA-WFASDCNBSA-N 1 0 367.440 5.288 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)c(F)cn1 ZINC000554051610 568398654 /nfs/dbraw/zinc/39/86/54/568398654.db2.gz ZYYYSUXKMQPSTQ-QWHCGFSZSA-N 1 0 371.481 5.073 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)c(F)cn1 ZINC000554051611 568398660 /nfs/dbraw/zinc/39/86/60/568398660.db2.gz ZYYYSUXKMQPSTQ-STQMWFEESA-N 1 0 371.481 5.073 20 0 FKADRO CCCN(CC[NH+]1CCCC1)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000554062506 568398876 /nfs/dbraw/zinc/39/88/76/568398876.db2.gz XWYRTXLGMYHSTE-UHFFFAOYSA-N 1 0 359.558 5.273 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCCSC1 ZINC000554066195 568398904 /nfs/dbraw/zinc/39/89/04/568398904.db2.gz ALVBZLQQUOGZRC-GXTWGEPZSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCCSC1 ZINC000554066196 568398864 /nfs/dbraw/zinc/39/88/64/568398864.db2.gz ALVBZLQQUOGZRC-JSGCOSHPSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCCSC1 ZINC000554066197 568398863 /nfs/dbraw/zinc/39/88/63/568398863.db2.gz ALVBZLQQUOGZRC-OCCSQVGLSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCCSC1 ZINC000554066198 568398856 /nfs/dbraw/zinc/39/88/56/568398856.db2.gz ALVBZLQQUOGZRC-TZMCWYRMSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@@H](C)c3nc(C(C)(C)C)cs3)cc12 ZINC000554070960 568399020 /nfs/dbraw/zinc/39/90/20/568399020.db2.gz CODHQWWQJPFTDE-NEPJUHHUSA-N 1 0 362.568 5.109 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@H](C)c3nc(C(C)(C)C)cs3)cc12 ZINC000554070961 568398991 /nfs/dbraw/zinc/39/89/91/568398991.db2.gz CODHQWWQJPFTDE-NWDGAFQWSA-N 1 0 362.568 5.109 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@@H](C)c3nc(C(C)(C)C)cs3)cc12 ZINC000554070962 568399030 /nfs/dbraw/zinc/39/90/30/568399030.db2.gz CODHQWWQJPFTDE-RYUDHWBXSA-N 1 0 362.568 5.109 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@H](C)c3nc(C(C)(C)C)cs3)cc12 ZINC000554070963 568398997 /nfs/dbraw/zinc/39/89/97/568398997.db2.gz CODHQWWQJPFTDE-VXGBXAGGSA-N 1 0 362.568 5.109 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+]CCCCCOC3CCCCC3)cc12 ZINC000554071091 568398972 /nfs/dbraw/zinc/39/89/72/568398972.db2.gz GIIJUQGUCWHTRA-INIZCTEOSA-N 1 0 363.571 5.113 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+]CCCCCOC3CCCCC3)cc12 ZINC000554071095 568398990 /nfs/dbraw/zinc/39/89/90/568398990.db2.gz GIIJUQGUCWHTRA-MRXNPFEDSA-N 1 0 363.571 5.113 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)C(C)C ZINC000554071376 568398999 /nfs/dbraw/zinc/39/89/99/568398999.db2.gz JEOLUHSFBQPNRS-IAOVAPTHSA-N 1 0 355.400 5.138 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1)C(C)C ZINC000554071377 568399008 /nfs/dbraw/zinc/39/90/08/568399008.db2.gz JEOLUHSFBQPNRS-KBRIMQKVSA-N 1 0 355.400 5.138 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)C(C)C ZINC000554071378 568398985 /nfs/dbraw/zinc/39/89/85/568398985.db2.gz JEOLUHSFBQPNRS-RRQGHBQHSA-N 1 0 355.400 5.138 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)C(C)C ZINC000554071379 568398996 /nfs/dbraw/zinc/39/89/96/568398996.db2.gz JEOLUHSFBQPNRS-XOKHGSTOSA-N 1 0 355.400 5.138 20 0 FKADRO Fc1ccc([C@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)c2cccnc2)cc1 ZINC000554073498 568399025 /nfs/dbraw/zinc/39/90/25/568399025.db2.gz OEWFHEJWUXIJPK-LZQZEXGQSA-N 1 0 366.402 5.268 20 0 FKADRO CC(C)[C@@H]([NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000554074436 568399006 /nfs/dbraw/zinc/39/90/06/568399006.db2.gz WSUSIJFELYOCQX-CKEIUWERSA-N 1 0 370.415 5.189 20 0 FKADRO CC(C)[C@H]([NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000554074437 568399003 /nfs/dbraw/zinc/39/90/03/568399003.db2.gz WSUSIJFELYOCQX-CPUCHLNUSA-N 1 0 370.415 5.189 20 0 FKADRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000554074759 568399011 /nfs/dbraw/zinc/39/90/11/568399011.db2.gz FIONTFBSCRYQKK-FOIQADDNSA-N 1 0 361.913 5.292 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000554074760 568399028 /nfs/dbraw/zinc/39/90/28/568399028.db2.gz FIONTFBSCRYQKK-MGPUTAFESA-N 1 0 361.913 5.292 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000554074761 568399105 /nfs/dbraw/zinc/39/91/05/568399105.db2.gz FIONTFBSCRYQKK-QRWLVFNGSA-N 1 0 361.913 5.292 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000554074762 568399070 /nfs/dbraw/zinc/39/90/70/568399070.db2.gz FIONTFBSCRYQKK-YWZLYKJASA-N 1 0 361.913 5.292 20 0 FKADRO Cc1cc2c(cc1C)[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)CCS2 ZINC000554074963 568399083 /nfs/dbraw/zinc/39/90/83/568399083.db2.gz MDSLTCUVMLUFMX-MOPGFXCFSA-N 1 0 361.938 5.207 20 0 FKADRO Cc1cc2c(cc1C)[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)CCS2 ZINC000554074964 568399077 /nfs/dbraw/zinc/39/90/77/568399077.db2.gz MDSLTCUVMLUFMX-OALUTQOASA-N 1 0 361.938 5.207 20 0 FKADRO Cc1cc2c(cc1C)[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)CCS2 ZINC000554074965 568399108 /nfs/dbraw/zinc/39/91/08/568399108.db2.gz MDSLTCUVMLUFMX-RBUKOAKNSA-N 1 0 361.938 5.207 20 0 FKADRO Cc1cc2c(cc1C)[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)CCS2 ZINC000554074966 568399059 /nfs/dbraw/zinc/39/90/59/568399059.db2.gz MDSLTCUVMLUFMX-RTBURBONSA-N 1 0 361.938 5.207 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1cccc(OC(F)(F)F)c1 ZINC000554076625 568399102 /nfs/dbraw/zinc/39/91/02/568399102.db2.gz HMYJWSQKGHXQRX-PXAZEXFGSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1cccc(OC(F)(F)F)c1 ZINC000554076627 568399053 /nfs/dbraw/zinc/39/90/53/568399053.db2.gz HMYJWSQKGHXQRX-SJCJKPOMSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1cccc(OC(F)(F)F)c1 ZINC000554076628 568399097 /nfs/dbraw/zinc/39/90/97/568399097.db2.gz HMYJWSQKGHXQRX-SJKOYZFVSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1cccc(OC(F)(F)F)c1 ZINC000554076630 568399088 /nfs/dbraw/zinc/39/90/88/568399088.db2.gz HMYJWSQKGHXQRX-YVEFUNNKSA-N 1 0 373.802 5.013 20 0 FKADRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)C1 ZINC000554077996 568399048 /nfs/dbraw/zinc/39/90/48/568399048.db2.gz FMBIFMGECVDYPI-BRSBDYLESA-N 1 0 354.460 5.375 20 0 FKADRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)C1 ZINC000554077997 568399049 /nfs/dbraw/zinc/39/90/49/568399049.db2.gz FMBIFMGECVDYPI-BSDSXHPESA-N 1 0 354.460 5.375 20 0 FKADRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)C1 ZINC000554077998 568399111 /nfs/dbraw/zinc/39/91/11/568399111.db2.gz FMBIFMGECVDYPI-XWTMOSNGSA-N 1 0 354.460 5.375 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c2ccccc12 ZINC000554078649 568399044 /nfs/dbraw/zinc/39/90/44/568399044.db2.gz YBXFMLUATGLPCC-BTYIYWSLSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c2ccccc12 ZINC000554078657 568399158 /nfs/dbraw/zinc/39/91/58/568399158.db2.gz YBXFMLUATGLPCC-QVKFZJNVSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c2ccccc12 ZINC000554078659 568399136 /nfs/dbraw/zinc/39/91/36/568399136.db2.gz YBXFMLUATGLPCC-VFNWGFHPSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c2ccccc12 ZINC000554078662 568399167 /nfs/dbraw/zinc/39/91/67/568399167.db2.gz YBXFMLUATGLPCC-YCRPNKLZSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c2ccccc12 ZINC000554087203 568399300 /nfs/dbraw/zinc/39/93/00/568399300.db2.gz UZGHSHGZKBKSOG-MSOLQXFVSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c2ccccc12 ZINC000554087206 568399252 /nfs/dbraw/zinc/39/92/52/568399252.db2.gz UZGHSHGZKBKSOG-QZTJIDSGSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c2ccccc12 ZINC000554087209 568399319 /nfs/dbraw/zinc/39/93/19/568399319.db2.gz UZGHSHGZKBKSOG-ROUUACIJSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c2ccccc12 ZINC000554087214 568399321 /nfs/dbraw/zinc/39/93/21/568399321.db2.gz UZGHSHGZKBKSOG-ZWKOTPCHSA-N 1 0 371.484 5.446 20 0 FKADRO COc1ccsc1[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000554088167 568399260 /nfs/dbraw/zinc/39/92/60/568399260.db2.gz KVJUMZOFZSWZNC-INIZCTEOSA-N 1 0 353.487 5.187 20 0 FKADRO COc1ccsc1[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000554088168 568399283 /nfs/dbraw/zinc/39/92/83/568399283.db2.gz KVJUMZOFZSWZNC-MRXNPFEDSA-N 1 0 353.487 5.187 20 0 FKADRO CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)cc1 ZINC000554089634 568399311 /nfs/dbraw/zinc/39/93/11/568399311.db2.gz WICWCAJHYSZQIJ-GOSISDBHSA-N 1 0 374.484 5.075 20 0 FKADRO CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)cc1 ZINC000554089735 568399289 /nfs/dbraw/zinc/39/92/89/568399289.db2.gz WICWCAJHYSZQIJ-SFHVURJKSA-N 1 0 374.484 5.075 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(-c2ccccc2Br)s1 ZINC000554090446 568399291 /nfs/dbraw/zinc/39/92/91/568399291.db2.gz RQKJYRDJJBOJTP-CDMKHQONSA-N 1 0 372.278 5.482 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(-c2ccccc2Br)s1 ZINC000554090447 568399277 /nfs/dbraw/zinc/39/92/77/568399277.db2.gz RQKJYRDJJBOJTP-GAFUQQFSSA-N 1 0 372.278 5.482 20 0 FKADRO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000554090475 568399304 /nfs/dbraw/zinc/39/93/04/568399304.db2.gz SNKKWBNVALIGIZ-KRWDZBQOSA-N 1 0 356.338 5.010 20 0 FKADRO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000554090476 568399258 /nfs/dbraw/zinc/39/92/58/568399258.db2.gz SNKKWBNVALIGIZ-QGZVFWFLSA-N 1 0 356.338 5.010 20 0 FKADRO FC(F)Oc1ccc([C@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(Cl)cc2)cc1 ZINC000554091318 568399336 /nfs/dbraw/zinc/39/93/36/568399336.db2.gz FKRZSUJXRPWJTO-HRCADAONSA-N 1 0 373.777 5.274 20 0 FKADRO FC(F)Oc1ccc([C@@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(Cl)cc2)cc1 ZINC000554091319 568399367 /nfs/dbraw/zinc/39/93/67/568399367.db2.gz FKRZSUJXRPWJTO-JYJNAYRXSA-N 1 0 373.777 5.274 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(Cl)c2ccccc21 ZINC000554094999 568399358 /nfs/dbraw/zinc/39/93/58/568399358.db2.gz AOQIJJSXPKEXDS-JKDFXYPNSA-N 1 0 357.803 5.254 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(Cl)c2ccccc21 ZINC000554095000 568399324 /nfs/dbraw/zinc/39/93/24/568399324.db2.gz AOQIJJSXPKEXDS-NVGCLXPQSA-N 1 0 357.803 5.254 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(Cl)c2ccccc21 ZINC000554095001 568399346 /nfs/dbraw/zinc/39/93/46/568399346.db2.gz AOQIJJSXPKEXDS-PRXAMGSTSA-N 1 0 357.803 5.254 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(Cl)c2ccccc21 ZINC000554095002 568399330 /nfs/dbraw/zinc/39/93/30/568399330.db2.gz AOQIJJSXPKEXDS-XWCIJXRUSA-N 1 0 357.803 5.254 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+]C2(c3c(Cl)cccc3Cl)CCC2)CCO1 ZINC000554095412 568399344 /nfs/dbraw/zinc/39/93/44/568399344.db2.gz FDLSZOQGSQHOHH-GWCFXTLKSA-N 1 0 368.226 5.072 20 0 FKADRO FC(F)(F)[C@H]1C[C@@H]([NH2+]C2(c3c(Cl)cccc3Cl)CCC2)CCO1 ZINC000554095413 568399354 /nfs/dbraw/zinc/39/93/54/568399354.db2.gz FDLSZOQGSQHOHH-GXFFZTMASA-N 1 0 368.226 5.072 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+]C2(c3c(Cl)cccc3Cl)CCC2)CCO1 ZINC000554095414 568399356 /nfs/dbraw/zinc/39/93/56/568399356.db2.gz FDLSZOQGSQHOHH-MFKMUULPSA-N 1 0 368.226 5.072 20 0 FKADRO FC(F)(F)[C@H]1C[C@H]([NH2+]C2(c3c(Cl)cccc3Cl)CCC2)CCO1 ZINC000554095415 568399369 /nfs/dbraw/zinc/39/93/69/568399369.db2.gz FDLSZOQGSQHOHH-ZWNOBZJWSA-N 1 0 368.226 5.072 20 0 FKADRO CC(C)c1ccc(NC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C(C)C)c1 ZINC000554106728 568399498 /nfs/dbraw/zinc/39/94/98/568399498.db2.gz BEONQIVJURARJC-DFNIBXOVSA-N 1 0 357.542 5.022 20 0 FKADRO CC[C@@H]([NH2+]C(c1cccc(OC)c1)c1cccc(OC)c1)c1ccccc1 ZINC000554110818 568399624 /nfs/dbraw/zinc/39/96/24/568399624.db2.gz BFBNKQWMYZUXOF-HSZRJFAPSA-N 1 0 361.485 5.534 20 0 FKADRO CC[C@H]([NH2+]C(c1cccc(OC)c1)c1cccc(OC)c1)c1ccccc1 ZINC000554110821 568399651 /nfs/dbraw/zinc/39/96/51/568399651.db2.gz BFBNKQWMYZUXOF-QHCPKHFHSA-N 1 0 361.485 5.534 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000554110993 568399620 /nfs/dbraw/zinc/39/96/20/568399620.db2.gz XCMGLZARWCEWLY-AGRHKRQWSA-N 1 0 367.386 5.253 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000554110994 568399650 /nfs/dbraw/zinc/39/96/50/568399650.db2.gz XCMGLZARWCEWLY-BKTGTZMESA-N 1 0 367.386 5.253 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000554110995 568399656 /nfs/dbraw/zinc/39/96/56/568399656.db2.gz XCMGLZARWCEWLY-FASAQXTFSA-N 1 0 367.386 5.253 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000554110996 568399604 /nfs/dbraw/zinc/39/96/04/568399604.db2.gz XCMGLZARWCEWLY-MJXNMMHHSA-N 1 0 367.386 5.253 20 0 FKADRO COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C2CC(C(F)(F)F)C2)cc1 ZINC000554116388 568399605 /nfs/dbraw/zinc/39/96/05/568399605.db2.gz PJCGPTKOJPEHIR-GXOAENINSA-N 1 0 367.386 5.049 20 0 FKADRO COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC(C(F)(F)F)C2)cc1 ZINC000554116389 568399626 /nfs/dbraw/zinc/39/96/26/568399626.db2.gz PJCGPTKOJPEHIR-KVWWFHCMSA-N 1 0 367.386 5.049 20 0 FKADRO FC(F)(F)C1CC([NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000554120987 568399680 /nfs/dbraw/zinc/39/96/80/568399680.db2.gz XRMJZSVOPOCUKH-ABIUDSBCSA-N 1 0 374.200 5.062 20 0 FKADRO FC(F)(F)C1CC([NH2+][C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000554120993 568399662 /nfs/dbraw/zinc/39/96/62/568399662.db2.gz XRMJZSVOPOCUKH-HGMXIMQMSA-N 1 0 374.200 5.062 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)c(C)c1OC ZINC000554121809 568399833 /nfs/dbraw/zinc/39/98/33/568399833.db2.gz XHBYYCRNZAZESE-DETPVDSQSA-N 1 0 363.548 5.350 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)c(C)c1OC ZINC000554121810 568399776 /nfs/dbraw/zinc/39/97/76/568399776.db2.gz XHBYYCRNZAZESE-GHJWDPDVSA-N 1 0 363.548 5.350 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)c(C)c1OC ZINC000554121811 568399830 /nfs/dbraw/zinc/39/98/30/568399830.db2.gz XHBYYCRNZAZESE-NORZTCDRSA-N 1 0 363.548 5.350 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)c(C)c1OC ZINC000554121812 568399803 /nfs/dbraw/zinc/39/98/03/568399803.db2.gz XHBYYCRNZAZESE-RBOXIYTFSA-N 1 0 363.548 5.350 20 0 FKADRO C[C@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000554139562 568401184 /nfs/dbraw/zinc/40/11/84/568401184.db2.gz KXVSCZGGCJSCIT-GCVQQVDUSA-N 1 0 357.363 5.333 20 0 FKADRO C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000554139563 568401175 /nfs/dbraw/zinc/40/11/75/568401175.db2.gz KXVSCZGGCJSCIT-OIKLOGQESA-N 1 0 357.363 5.333 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]C3CC(C(F)(F)F)C3)C2)cc1 ZINC000554141072 568401275 /nfs/dbraw/zinc/40/12/75/568401275.db2.gz VKHTZVKLNOUHSF-CMAYJEJSSA-N 1 0 351.334 5.272 20 0 FKADRO FC(F)(F)c1ccc([C@H]2CC[C@H]([NH2+]C3CC(C(F)(F)F)C3)C2)cc1 ZINC000554141073 568401270 /nfs/dbraw/zinc/40/12/70/568401270.db2.gz VKHTZVKLNOUHSF-HQSMGLLHSA-N 1 0 351.334 5.272 20 0 FKADRO FC(F)(F)c1ccc([C@H]2CC[C@@H]([NH2+]C3CC(C(F)(F)F)C3)C2)cc1 ZINC000554141074 568401280 /nfs/dbraw/zinc/40/12/80/568401280.db2.gz VKHTZVKLNOUHSF-HRNJWANLSA-N 1 0 351.334 5.272 20 0 FKADRO FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]C3CC(C(F)(F)F)C3)C2)cc1 ZINC000554141075 568401278 /nfs/dbraw/zinc/40/12/78/568401278.db2.gz VKHTZVKLNOUHSF-VKITVTTRSA-N 1 0 351.334 5.272 20 0 FKADRO C[C@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc2ccccc2c1OC(F)F ZINC000554145229 568401721 /nfs/dbraw/zinc/40/17/21/568401721.db2.gz OTXRDLZNNKQQJM-PKSQDBQZSA-N 1 0 359.338 5.433 20 0 FKADRO C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc2ccccc2c1OC(F)F ZINC000554145239 568401747 /nfs/dbraw/zinc/40/17/47/568401747.db2.gz OTXRDLZNNKQQJM-QFWMXSHPSA-N 1 0 359.338 5.433 20 0 FKADRO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2cccc(C(=O)N3CCCCC3)c2)c1 ZINC000554148046 568402260 /nfs/dbraw/zinc/40/22/60/568402260.db2.gz MAXGJPMXVXLFEI-FQEVSTJZSA-N 1 0 364.533 5.123 20 0 FKADRO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2cccc(C(=O)N3CCCCC3)c2)c1 ZINC000554148047 568402255 /nfs/dbraw/zinc/40/22/55/568402255.db2.gz MAXGJPMXVXLFEI-HXUWFJFHSA-N 1 0 364.533 5.123 20 0 FKADRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000554194799 568403529 /nfs/dbraw/zinc/40/35/29/568403529.db2.gz QDJVJNHTQITWNG-GFCCVEGCSA-N 1 0 369.358 5.229 20 0 FKADRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000554194803 568403549 /nfs/dbraw/zinc/40/35/49/568403549.db2.gz QDJVJNHTQITWNG-LBPRGKRZSA-N 1 0 369.358 5.229 20 0 FKADRO COc1ccncc1C[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000554231217 568403747 /nfs/dbraw/zinc/40/37/47/568403747.db2.gz OFBBXDHJADWVNQ-HNNXBMFYSA-N 1 0 352.865 5.261 20 0 FKADRO COc1ccncc1C[NH2+][C@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000554231221 568403813 /nfs/dbraw/zinc/40/38/13/568403813.db2.gz OFBBXDHJADWVNQ-OAHLLOKOSA-N 1 0 352.865 5.261 20 0 FKADRO c1c[nH]c([C@H]2CCC[N@@H+](Cc3cccc(SCc4ccccc4)c3)C2)n1 ZINC000554247298 568403893 /nfs/dbraw/zinc/40/38/93/568403893.db2.gz RDUPINQVIHKVOY-FQEVSTJZSA-N 1 0 363.530 5.082 20 0 FKADRO c1c[nH]c([C@@H]2CCC[N@@H+](Cc3cccc(SCc4ccccc4)c3)C2)n1 ZINC000554247299 568403946 /nfs/dbraw/zinc/40/39/46/568403946.db2.gz RDUPINQVIHKVOY-HXUWFJFHSA-N 1 0 363.530 5.082 20 0 FKADRO COCC[C@H]([NH2+]Cc1cccc(SCc2ccccc2)c1)c1ccco1 ZINC000554262993 568404101 /nfs/dbraw/zinc/40/41/01/568404101.db2.gz GDYURSZUJKBCQB-NRFANRHFSA-N 1 0 367.514 5.439 20 0 FKADRO COCC[C@@H]([NH2+]Cc1cccc(SCc2ccccc2)c1)c1ccco1 ZINC000554262994 568404070 /nfs/dbraw/zinc/40/40/70/568404070.db2.gz GDYURSZUJKBCQB-OAQYLSRUSA-N 1 0 367.514 5.439 20 0 FKADRO C[C@@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccc2ncsc2c1 ZINC000554269757 568404144 /nfs/dbraw/zinc/40/41/44/568404144.db2.gz HDKMNJVYHZGRRL-SECBINFHSA-N 1 0 372.362 5.444 20 0 FKADRO C[C@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccc2ncsc2c1 ZINC000554269759 568404180 /nfs/dbraw/zinc/40/41/80/568404180.db2.gz HDKMNJVYHZGRRL-VIFPVBQESA-N 1 0 372.362 5.444 20 0 FKADRO CCS(=O)(=O)c1ccc(C[NH2+][C@H](CCCC(C)C)c2ccccc2)cc1 ZINC000554276505 568404347 /nfs/dbraw/zinc/40/43/47/568404347.db2.gz TVBTVNZVUBGNQC-JOCHJYFZSA-N 1 0 373.562 5.137 20 0 FKADRO CCS(=O)(=O)c1ccc(C[NH2+][C@@H](CCCC(C)C)c2ccccc2)cc1 ZINC000554276506 568404293 /nfs/dbraw/zinc/40/42/93/568404293.db2.gz TVBTVNZVUBGNQC-QFIPXVFZSA-N 1 0 373.562 5.137 20 0 FKADRO CC[N@H+](Cc1cc2ccccc2[nH]c1=O)C(c1ccccc1)c1ccccc1 ZINC000554331393 568404607 /nfs/dbraw/zinc/40/46/07/568404607.db2.gz PVGQEMXHDMHSIS-UHFFFAOYSA-N 1 0 368.480 5.552 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H]([NH+]2CCCC2)[C@@H]1C ZINC000554351050 568404889 /nfs/dbraw/zinc/40/48/89/568404889.db2.gz NPWIGCUAKWPOAG-PXNSSMCTSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H]([NH+]2CCCC2)[C@H]1C ZINC000554351051 568404901 /nfs/dbraw/zinc/40/49/01/568404901.db2.gz NPWIGCUAKWPOAG-XLIONFOSSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H]([NH+]2CCCC2)[C@H]1C ZINC000554351052 568404879 /nfs/dbraw/zinc/40/48/79/568404879.db2.gz NPWIGCUAKWPOAG-YLJYHZDGSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@@H]([NH+]2CCCC2)C[C@H]1C ZINC000554353816 568404893 /nfs/dbraw/zinc/40/48/93/568404893.db2.gz CAHMQTSVGBGYEJ-MSOLQXFVSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@H]([NH+]2CCCC2)C[C@H]1C ZINC000554353818 568404896 /nfs/dbraw/zinc/40/48/96/568404896.db2.gz CAHMQTSVGBGYEJ-QZTJIDSGSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@@H]([NH+]2CCCC2)C[C@@H]1C ZINC000554353819 568404913 /nfs/dbraw/zinc/40/49/13/568404913.db2.gz CAHMQTSVGBGYEJ-ROUUACIJSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@H]([NH+]2CCCC2)C[C@@H]1C ZINC000554353820 568404883 /nfs/dbraw/zinc/40/48/83/568404883.db2.gz CAHMQTSVGBGYEJ-ZWKOTPCHSA-N 1 0 357.542 5.024 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000554358204 568404954 /nfs/dbraw/zinc/40/49/54/568404954.db2.gz BETNTIDQMQRRIN-BLLLJJGKSA-N 1 0 352.931 5.003 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000554358205 568404958 /nfs/dbraw/zinc/40/49/58/568404958.db2.gz BETNTIDQMQRRIN-LRDDRELGSA-N 1 0 352.931 5.003 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000554358206 568404970 /nfs/dbraw/zinc/40/49/70/568404970.db2.gz BETNTIDQMQRRIN-MLGOLLRUSA-N 1 0 352.931 5.003 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(Cl)cc2)CCO1 ZINC000554362639 568405065 /nfs/dbraw/zinc/40/50/65/568405065.db2.gz TVMIFVCGYYIHTP-AEFFLSMTSA-N 1 0 369.814 5.207 20 0 FKADRO FC(F)(F)[C@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(Cl)cc2)CCO1 ZINC000554362645 568405067 /nfs/dbraw/zinc/40/50/67/568405067.db2.gz TVMIFVCGYYIHTP-FUHWJXTLSA-N 1 0 369.814 5.207 20 0 FKADRO FC(F)(F)[C@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(Cl)cc2)CCO1 ZINC000554362647 568405082 /nfs/dbraw/zinc/40/50/82/568405082.db2.gz TVMIFVCGYYIHTP-SJLPKXTDSA-N 1 0 369.814 5.207 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(Cl)cc2)CCO1 ZINC000554362649 568405090 /nfs/dbraw/zinc/40/50/90/568405090.db2.gz TVMIFVCGYYIHTP-WMZOPIPTSA-N 1 0 369.814 5.207 20 0 FKADRO CC[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000554363118 568405159 /nfs/dbraw/zinc/40/51/59/568405159.db2.gz HDVIRNNCQXFLCU-QZTJIDSGSA-N 1 0 369.839 5.106 20 0 FKADRO CC[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000554363120 568405110 /nfs/dbraw/zinc/40/51/10/568405110.db2.gz HDVIRNNCQXFLCU-ROUUACIJSA-N 1 0 369.839 5.106 20 0 FKADRO CC[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000554363121 568405149 /nfs/dbraw/zinc/40/51/49/568405149.db2.gz HDVIRNNCQXFLCU-ZWKOTPCHSA-N 1 0 369.839 5.106 20 0 FKADRO Fc1ccc([C@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)c2ccccn2)cc1 ZINC000554363685 568405125 /nfs/dbraw/zinc/40/51/25/568405125.db2.gz OJIOZSPILOXKFU-SUMDDJOVSA-N 1 0 366.402 5.268 20 0 FKADRO Fc1ccc([C@@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)c2ccccn2)cc1 ZINC000554363686 568405142 /nfs/dbraw/zinc/40/51/42/568405142.db2.gz OJIOZSPILOXKFU-SZVBFZGTSA-N 1 0 366.402 5.268 20 0 FKADRO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c1 ZINC000554364941 568405118 /nfs/dbraw/zinc/40/51/18/568405118.db2.gz UCXNETGWEIBJLK-CXAGYDPISA-N 1 0 369.839 5.024 20 0 FKADRO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c1 ZINC000554364942 568405157 /nfs/dbraw/zinc/40/51/57/568405157.db2.gz UCXNETGWEIBJLK-DYVFJYSZSA-N 1 0 369.839 5.024 20 0 FKADRO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c1 ZINC000554364943 568405102 /nfs/dbraw/zinc/40/51/02/568405102.db2.gz UCXNETGWEIBJLK-GUYCJALGSA-N 1 0 369.839 5.024 20 0 FKADRO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c1 ZINC000554364944 568405144 /nfs/dbraw/zinc/40/51/44/568405144.db2.gz UCXNETGWEIBJLK-SUMWQHHRSA-N 1 0 369.839 5.024 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C[C@@H]1CCCSC1)CCC2 ZINC000554366700 568405215 /nfs/dbraw/zinc/40/52/15/568405215.db2.gz QMZLGPYBTRYETE-BBRMVZONSA-N 1 0 362.539 5.059 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C[C@H]1CCCSC1)CCC2 ZINC000554367000 568405214 /nfs/dbraw/zinc/40/52/14/568405214.db2.gz QMZLGPYBTRYETE-CJNGLKHVSA-N 1 0 362.539 5.059 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C[C@H]1CCCSC1)CCC2 ZINC000554367001 568405167 /nfs/dbraw/zinc/40/51/67/568405167.db2.gz QMZLGPYBTRYETE-CZUORRHYSA-N 1 0 362.539 5.059 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C[C@@H]1CCCSC1)CCC2 ZINC000554367003 568405199 /nfs/dbraw/zinc/40/51/99/568405199.db2.gz QMZLGPYBTRYETE-XJKSGUPXSA-N 1 0 362.539 5.059 20 0 FKADRO OCC[C@H]([NH2+][C@@H]1CCSc2c(Cl)cccc21)c1ccc(Cl)cc1 ZINC000554367029 568405216 /nfs/dbraw/zinc/40/52/16/568405216.db2.gz QWOHJSAOYVEEEB-DLBZAZTESA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@@H]([NH2+][C@@H]1CCSc2c(Cl)cccc21)c1ccc(Cl)cc1 ZINC000554367032 568405170 /nfs/dbraw/zinc/40/51/70/568405170.db2.gz QWOHJSAOYVEEEB-IAGOWNOFSA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@H]([NH2+][C@H]1CCSc2c(Cl)cccc21)c1ccc(Cl)cc1 ZINC000554367034 568405196 /nfs/dbraw/zinc/40/51/96/568405196.db2.gz QWOHJSAOYVEEEB-IRXDYDNUSA-N 1 0 368.329 5.244 20 0 FKADRO OCC[C@@H]([NH2+][C@H]1CCSc2c(Cl)cccc21)c1ccc(Cl)cc1 ZINC000554367036 568405230 /nfs/dbraw/zinc/40/52/30/568405230.db2.gz QWOHJSAOYVEEEB-SJORKVTESA-N 1 0 368.329 5.244 20 0 FKADRO COc1ccc2cc([C@@H](C)[NH2+][C@H](CCO)c3ccc(Cl)cc3)ccc2c1 ZINC000554367052 568405185 /nfs/dbraw/zinc/40/51/85/568405185.db2.gz RCNCQOLIUIXVBB-IVZQSRNASA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc2cc([C@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)ccc2c1 ZINC000554367054 568405168 /nfs/dbraw/zinc/40/51/68/568405168.db2.gz RCNCQOLIUIXVBB-NYHFZMIOSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc2cc([C@H](C)[NH2+][C@H](CCO)c3ccc(Cl)cc3)ccc2c1 ZINC000554367055 568405177 /nfs/dbraw/zinc/40/51/77/568405177.db2.gz RCNCQOLIUIXVBB-OYHNWAKOSA-N 1 0 369.892 5.276 20 0 FKADRO COc1ccc2cc([C@@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)ccc2c1 ZINC000554367056 568405161 /nfs/dbraw/zinc/40/51/61/568405161.db2.gz RCNCQOLIUIXVBB-QRQCRPRQSA-N 1 0 369.892 5.276 20 0 FKADRO c1ccc(COc2cccc(C[NH2+][C@H]3CCCNc4ccccc43)c2)cc1 ZINC000554369940 568405165 /nfs/dbraw/zinc/40/51/65/568405165.db2.gz FQGVMJCTBDJFAH-DEOSSOPVSA-N 1 0 358.485 5.302 20 0 FKADRO c1ccc(COc2cccc(C[NH2+][C@@H]3CCCNc4ccccc43)c2)cc1 ZINC000554369941 568405220 /nfs/dbraw/zinc/40/52/20/568405220.db2.gz FQGVMJCTBDJFAH-XMMPIXPASA-N 1 0 358.485 5.302 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccs1)C1CCCC1)c1nccn1-c1ccccc1 ZINC000554370307 568405237 /nfs/dbraw/zinc/40/52/37/568405237.db2.gz MUBGBXJCXDIABG-JXFKEZNVSA-N 1 0 351.519 5.516 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccs1)C1CCCC1)c1nccn1-c1ccccc1 ZINC000554370308 568405172 /nfs/dbraw/zinc/40/51/72/568405172.db2.gz MUBGBXJCXDIABG-OXJNMPFZSA-N 1 0 351.519 5.516 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccs1)C1CCCC1)c1nccn1-c1ccccc1 ZINC000554370310 568405191 /nfs/dbraw/zinc/40/51/91/568405191.db2.gz MUBGBXJCXDIABG-OXQOHEQNSA-N 1 0 351.519 5.516 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccs1)C1CCCC1)c1nccn1-c1ccccc1 ZINC000554370312 568405174 /nfs/dbraw/zinc/40/51/74/568405174.db2.gz MUBGBXJCXDIABG-UZLBHIALSA-N 1 0 351.519 5.516 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 ZINC000554370952 568405259 /nfs/dbraw/zinc/40/52/59/568405259.db2.gz FFVAGMSPLWUOOS-ILXRZTDVSA-N 1 0 369.349 5.102 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 ZINC000554370953 568405284 /nfs/dbraw/zinc/40/52/84/568405284.db2.gz FFVAGMSPLWUOOS-KFWWJZLASA-N 1 0 369.349 5.102 20 0 FKADRO CC(C)[C@H]([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 ZINC000554370954 568405261 /nfs/dbraw/zinc/40/52/61/568405261.db2.gz FFVAGMSPLWUOOS-KKUMJFAQSA-N 1 0 369.349 5.102 20 0 FKADRO CC(C)[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 ZINC000554370955 568405243 /nfs/dbraw/zinc/40/52/43/568405243.db2.gz FFVAGMSPLWUOOS-ZNMIVQPWSA-N 1 0 369.349 5.102 20 0 FKADRO COCC(C)(C)CCC[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000554372011 568405281 /nfs/dbraw/zinc/40/52/81/568405281.db2.gz CVORUTILGHHROE-FQEVSTJZSA-N 1 0 360.929 5.061 20 0 FKADRO COCC(C)(C)CCC[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000554372012 568405241 /nfs/dbraw/zinc/40/52/41/568405241.db2.gz CVORUTILGHHROE-HXUWFJFHSA-N 1 0 360.929 5.061 20 0 FKADRO COCC(C)(C)CCC[NH2+][C@H](C)c1csc(-c2csc(C)n2)c1 ZINC000554373476 568405311 /nfs/dbraw/zinc/40/53/11/568405311.db2.gz GXQBKPUXOUOFIL-CYBMUJFWSA-N 1 0 352.569 5.283 20 0 FKADRO COCC(C)(C)CCC[NH2+][C@@H](C)c1csc(-c2csc(C)n2)c1 ZINC000554373477 568405322 /nfs/dbraw/zinc/40/53/22/568405322.db2.gz GXQBKPUXOUOFIL-ZDUSSCGKSA-N 1 0 352.569 5.283 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)Nc3cccc(C[NH+]4CCCCC4)c3)cc12 ZINC000554374168 568405305 /nfs/dbraw/zinc/40/53/05/568405305.db2.gz POEZDPLYGYNOKI-INIZCTEOSA-N 1 0 368.550 5.102 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)Nc3cccc(C[NH+]4CCCCC4)c3)cc12 ZINC000554374169 568405340 /nfs/dbraw/zinc/40/53/40/568405340.db2.gz POEZDPLYGYNOKI-MRXNPFEDSA-N 1 0 368.550 5.102 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)c1ccc2c(c1)COC2 ZINC000554376074 568405397 /nfs/dbraw/zinc/40/53/97/568405397.db2.gz DVJNVBDQDQRXQW-GOSISDBHSA-N 1 0 359.469 5.147 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)c1ccc2c(c1)COC2 ZINC000554376075 568405368 /nfs/dbraw/zinc/40/53/68/568405368.db2.gz DVJNVBDQDQRXQW-SFHVURJKSA-N 1 0 359.469 5.147 20 0 FKADRO CCc1nc(C)c([C@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)s1 ZINC000554376098 568405417 /nfs/dbraw/zinc/40/54/17/568405417.db2.gz FRNNVFSBAZZXIE-INIZCTEOSA-N 1 0 366.530 5.444 20 0 FKADRO CCc1nc(C)c([C@@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)s1 ZINC000554376099 568405363 /nfs/dbraw/zinc/40/53/63/568405363.db2.gz FRNNVFSBAZZXIE-MRXNPFEDSA-N 1 0 366.530 5.444 20 0 FKADRO CSc1cccc([C@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(F)c(F)c2)c1 ZINC000554376900 568405407 /nfs/dbraw/zinc/40/54/07/568405407.db2.gz HOGWLCCNXXELDS-JQFCIGGWSA-N 1 0 355.400 5.019 20 0 FKADRO CSc1cccc([C@@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(F)c(F)c2)c1 ZINC000554376902 568405421 /nfs/dbraw/zinc/40/54/21/568405421.db2.gz HOGWLCCNXXELDS-RRQGHBQHSA-N 1 0 355.400 5.019 20 0 FKADRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(OCc3ccccc3)c1)CCC2 ZINC000554377118 568405381 /nfs/dbraw/zinc/40/53/81/568405381.db2.gz IRNOEIJAELHKRA-FQEVSTJZSA-N 1 0 364.514 5.198 20 0 FKADRO Cc1nc2c(s1)[C@H]([NH2+]Cc1cccc(OCc3ccccc3)c1)CCC2 ZINC000554377119 568405402 /nfs/dbraw/zinc/40/54/02/568405402.db2.gz IRNOEIJAELHKRA-HXUWFJFHSA-N 1 0 364.514 5.198 20 0 FKADRO FC(F)[C@H]1C[C@@H]1[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000554377643 568405375 /nfs/dbraw/zinc/40/53/75/568405375.db2.gz RHEYKNGPAVLQMI-OBJOEFQTSA-N 1 0 354.853 5.084 20 0 FKADRO FC(F)[C@H]1C[C@@H]1[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000554377645 568405425 /nfs/dbraw/zinc/40/54/25/568405425.db2.gz RHEYKNGPAVLQMI-SCRDCRAPSA-N 1 0 354.853 5.084 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@H](C)c3cc4cccc(F)c4o3)cc12 ZINC000554377834 568405366 /nfs/dbraw/zinc/40/53/66/568405366.db2.gz UQTNLOJKWBZURH-NEPJUHHUSA-N 1 0 357.454 5.240 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@@H](C)c3cc4cccc(F)c4o3)cc12 ZINC000554377835 568405411 /nfs/dbraw/zinc/40/54/11/568405411.db2.gz UQTNLOJKWBZURH-NWDGAFQWSA-N 1 0 357.454 5.240 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@@H](C)c3cc4cccc(F)c4o3)cc12 ZINC000554377836 568405414 /nfs/dbraw/zinc/40/54/14/568405414.db2.gz UQTNLOJKWBZURH-RYUDHWBXSA-N 1 0 357.454 5.240 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@H](C)c3cc4cccc(F)c4o3)cc12 ZINC000554377837 568405419 /nfs/dbraw/zinc/40/54/19/568405419.db2.gz UQTNLOJKWBZURH-VXGBXAGGSA-N 1 0 357.454 5.240 20 0 FKADRO CC(C)c1ccc(NC(=O)N2CC[C@@H]([NH+]3CCCC3)[C@H]2C)c(C(C)C)c1 ZINC000554384252 568405798 /nfs/dbraw/zinc/40/57/98/568405798.db2.gz YZVDMURYNCBDGP-DYESRHJHSA-N 1 0 357.542 5.024 20 0 FKADRO CC(C)c1ccc(NC(=O)N2CC[C@H]([NH+]3CCCC3)[C@@H]2C)c(C(C)C)c1 ZINC000554384261 568405795 /nfs/dbraw/zinc/40/57/95/568405795.db2.gz YZVDMURYNCBDGP-UWJYYQICSA-N 1 0 357.542 5.024 20 0 FKADRO FC(F)c1ccnc(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000554391641 568405976 /nfs/dbraw/zinc/40/59/76/568405976.db2.gz VOPZYHYBSMKQRS-BXUZGUMPSA-N 1 0 372.246 5.147 20 0 FKADRO FC(F)c1ccnc(C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000554391642 568405979 /nfs/dbraw/zinc/40/59/79/568405979.db2.gz VOPZYHYBSMKQRS-FZMZJTMJSA-N 1 0 372.246 5.147 20 0 FKADRO FC(F)c1ccnc(C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000554391643 568406000 /nfs/dbraw/zinc/40/60/00/568406000.db2.gz VOPZYHYBSMKQRS-RISCZKNCSA-N 1 0 372.246 5.147 20 0 FKADRO FC(F)c1ccnc(C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000554391644 568406008 /nfs/dbraw/zinc/40/60/08/568406008.db2.gz VOPZYHYBSMKQRS-SMDDNHRTSA-N 1 0 372.246 5.147 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccn1 ZINC000554402188 568406111 /nfs/dbraw/zinc/40/61/11/568406111.db2.gz KSKQLFXMBCVMQH-CABCVRRESA-N 1 0 367.518 5.242 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccn1 ZINC000554402189 568406130 /nfs/dbraw/zinc/40/61/30/568406130.db2.gz KSKQLFXMBCVMQH-GJZGRUSLSA-N 1 0 367.518 5.242 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccn1 ZINC000554402190 568406095 /nfs/dbraw/zinc/40/60/95/568406095.db2.gz KSKQLFXMBCVMQH-HUUCEWRRSA-N 1 0 367.518 5.242 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccn1 ZINC000554402191 568406136 /nfs/dbraw/zinc/40/61/36/568406136.db2.gz KSKQLFXMBCVMQH-LSDHHAIUSA-N 1 0 367.518 5.242 20 0 FKADRO COc1cccc([C@H]([NH2+]C2CC(C(F)(F)F)C2)c2ccccc2Cl)c1 ZINC000554403514 568406090 /nfs/dbraw/zinc/40/60/90/568406090.db2.gz VBRUHXXTDABFSK-JRSKDTKFSA-N 1 0 369.814 5.369 20 0 FKADRO COc1cccc([C@@H]([NH2+]C2CC(C(F)(F)F)C2)c2ccccc2Cl)c1 ZINC000554403515 568406134 /nfs/dbraw/zinc/40/61/34/568406134.db2.gz VBRUHXXTDABFSK-WTNGLUPJSA-N 1 0 369.814 5.369 20 0 FKADRO COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+][C@H](C)c1ccc(OC)c(OC)c1C ZINC000554403918 568406121 /nfs/dbraw/zinc/40/61/21/568406121.db2.gz IMZYINXLRZUZCO-FOIQADDNSA-N 1 0 369.505 5.094 20 0 FKADRO COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C ZINC000554403919 568406113 /nfs/dbraw/zinc/40/61/13/568406113.db2.gz IMZYINXLRZUZCO-MGPUTAFESA-N 1 0 369.505 5.094 20 0 FKADRO COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+][C@H](C)c1ccc(OC)c(OC)c1C ZINC000554403920 568406085 /nfs/dbraw/zinc/40/60/85/568406085.db2.gz IMZYINXLRZUZCO-QRWLVFNGSA-N 1 0 369.505 5.094 20 0 FKADRO COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C ZINC000554403921 568406097 /nfs/dbraw/zinc/40/60/97/568406097.db2.gz IMZYINXLRZUZCO-YWZLYKJASA-N 1 0 369.505 5.094 20 0 FKADRO C[C@@H](c1ccccc1)N(C(=O)Nc1cccc(Oc2ccncc2)c1)C1CC1 ZINC000554447244 568407053 /nfs/dbraw/zinc/40/70/53/568407053.db2.gz VOYCOJLCEYTRSO-KRWDZBQOSA-N 1 0 373.456 5.631 20 0 FKADRO C[C@H](c1ccccc1)N(C(=O)Nc1cccc(Oc2ccncc2)c1)C1CC1 ZINC000554447245 568407055 /nfs/dbraw/zinc/40/70/55/568407055.db2.gz VOYCOJLCEYTRSO-QGZVFWFLSA-N 1 0 373.456 5.631 20 0 FKADRO Cc1cc(C[NH2+]Cc2cc3c(s2)CCCC3)ccc1Oc1cccnc1 ZINC000554527451 568407539 /nfs/dbraw/zinc/40/75/39/568407539.db2.gz DOQJFZFZIQKLAH-UHFFFAOYSA-N 1 0 364.514 5.412 20 0 FKADRO CC(C)[C@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1ccc(F)cc1 ZINC000554572945 568407923 /nfs/dbraw/zinc/40/79/23/568407923.db2.gz BCZFGUJDVSVFJH-PXAZEXFGSA-N 1 0 351.263 5.031 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1ccc(F)cc1 ZINC000554572946 568407890 /nfs/dbraw/zinc/40/78/90/568407890.db2.gz BCZFGUJDVSVFJH-SJCJKPOMSA-N 1 0 351.263 5.031 20 0 FKADRO CC(C)[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1ccc(F)cc1 ZINC000554572947 568407909 /nfs/dbraw/zinc/40/79/09/568407909.db2.gz BCZFGUJDVSVFJH-SJKOYZFVSA-N 1 0 351.263 5.031 20 0 FKADRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1ccc(F)cc1 ZINC000554572948 568407841 /nfs/dbraw/zinc/40/78/41/568407841.db2.gz BCZFGUJDVSVFJH-YVEFUNNKSA-N 1 0 351.263 5.031 20 0 FKADRO C[C@@H]1CC[N@H+](CCC(=O)Nc2c(Cl)cccc2Cl)[C@H]2CCCC[C@H]12 ZINC000554619995 568408142 /nfs/dbraw/zinc/40/81/42/568408142.db2.gz MIZHPIVYMDBKTN-CPUCHLNUSA-N 1 0 369.336 5.223 20 0 FKADRO C[C@@H]1CC[N@H+](CCC(=O)Nc2c(Cl)cccc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000554619996 568408184 /nfs/dbraw/zinc/40/81/84/568408184.db2.gz MIZHPIVYMDBKTN-JKIFEVAISA-N 1 0 369.336 5.223 20 0 FKADRO C[C@@H]1CC[N@H+](CCC(=O)Nc2c(Cl)cccc2Cl)[C@H]2CCCC[C@@H]12 ZINC000554619997 568408201 /nfs/dbraw/zinc/40/82/01/568408201.db2.gz MIZHPIVYMDBKTN-KEYYUXOJSA-N 1 0 369.336 5.223 20 0 FKADRO COc1ccccc1[C@@H]([NH2+]C1CC(c2ccc(F)cc2)C1)c1ccco1 ZINC000554697610 568408820 /nfs/dbraw/zinc/40/88/20/568408820.db2.gz YVGQQBVHSBNGIT-CWZMJNCASA-N 1 0 351.421 5.053 20 0 FKADRO COc1ccccc1[C@H]([NH2+]C1CC(c2ccc(F)cc2)C1)c1ccco1 ZINC000554697611 568408774 /nfs/dbraw/zinc/40/87/74/568408774.db2.gz YVGQQBVHSBNGIT-QRFVXNFXSA-N 1 0 351.421 5.053 20 0 FKADRO COCCOCc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000554713531 568408919 /nfs/dbraw/zinc/40/89/19/568408919.db2.gz FJFZUVPJJXWVBR-HSZRJFAPSA-N 1 0 371.496 5.010 20 0 FKADRO COCCOCc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000554713532 568408881 /nfs/dbraw/zinc/40/88/81/568408881.db2.gz FJFZUVPJJXWVBR-QHCPKHFHSA-N 1 0 371.496 5.010 20 0 FKADRO CCc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(COCCOC)cc1 ZINC000554714502 568408932 /nfs/dbraw/zinc/40/89/32/568408932.db2.gz YWSZHHHESALQLY-KRWDZBQOSA-N 1 0 367.489 5.009 20 0 FKADRO CCc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(COCCOC)cc1 ZINC000554714503 568408922 /nfs/dbraw/zinc/40/89/22/568408922.db2.gz YWSZHHHESALQLY-QGZVFWFLSA-N 1 0 367.489 5.009 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(Oc2cccnc2)cc1 ZINC000554718931 568408950 /nfs/dbraw/zinc/40/89/50/568408950.db2.gz DQFNBCOCEUSCHY-OAHLLOKOSA-N 1 0 370.399 5.326 20 0 FKADRO COc1cc(C)c(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000554719102 568408995 /nfs/dbraw/zinc/40/89/95/568408995.db2.gz GLFFZPDTCDRSAA-HNNXBMFYSA-N 1 0 353.437 5.155 20 0 FKADRO COc1cc(C)c(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000554719103 568408988 /nfs/dbraw/zinc/40/89/88/568408988.db2.gz GLFFZPDTCDRSAA-OAHLLOKOSA-N 1 0 353.437 5.155 20 0 FKADRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(OCc3ccccn3)c1)CCC2 ZINC000554719840 568408980 /nfs/dbraw/zinc/40/89/80/568408980.db2.gz OHMLROMZPNWBSF-DEOSSOPVSA-N 1 0 358.485 5.136 20 0 FKADRO CCn1c(C[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)nc2ccccc21 ZINC000554720178 568408939 /nfs/dbraw/zinc/40/89/39/568408939.db2.gz WNVXNXIQNUGENP-KRWDZBQOSA-N 1 0 372.472 5.094 20 0 FKADRO CCn1c(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)nc2ccccc21 ZINC000554720179 568408937 /nfs/dbraw/zinc/40/89/37/568408937.db2.gz WNVXNXIQNUGENP-QGZVFWFLSA-N 1 0 372.472 5.094 20 0 FKADRO C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(Oc2cccnc2)cc1 ZINC000554720225 568408957 /nfs/dbraw/zinc/40/89/57/568408957.db2.gz YLYWYYXWRXDIIA-AWEZNQCLSA-N 1 0 356.828 5.517 20 0 FKADRO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(Oc2cccnc2)cc1 ZINC000554720226 568408991 /nfs/dbraw/zinc/40/89/91/568408991.db2.gz YLYWYYXWRXDIIA-CQSZACIVSA-N 1 0 356.828 5.517 20 0 FKADRO FC(F)(F)c1ccc(-c2nc(C[NH2+]C[C@H]3CCCSC3)cs2)cc1 ZINC000554720356 568408974 /nfs/dbraw/zinc/40/89/74/568408974.db2.gz OSFHCUBHCVEJIH-GFCCVEGCSA-N 1 0 372.481 5.062 20 0 FKADRO FC(F)(F)c1ccc(-c2nc(C[NH2+]C[C@@H]3CCCSC3)cs2)cc1 ZINC000554720357 568408972 /nfs/dbraw/zinc/40/89/72/568408972.db2.gz OSFHCUBHCVEJIH-LBPRGKRZSA-N 1 0 372.481 5.062 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@H]3C[C@H](C)c4ccccc43)cn2)c1 ZINC000554735974 568409153 /nfs/dbraw/zinc/40/91/53/568409153.db2.gz ZYEGGKKUWZWNDV-AOMKIAJQSA-N 1 0 360.457 5.221 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@@H]3C[C@H](C)c4ccccc43)cn2)c1 ZINC000554735975 568409126 /nfs/dbraw/zinc/40/91/26/568409126.db2.gz ZYEGGKKUWZWNDV-KSFYIVLOSA-N 1 0 360.457 5.221 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@@H]3C[C@@H](C)c4ccccc43)cn2)c1 ZINC000554735976 568409137 /nfs/dbraw/zinc/40/91/37/568409137.db2.gz ZYEGGKKUWZWNDV-OPAMFIHVSA-N 1 0 360.457 5.221 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@H]3C[C@@H](C)c4ccccc43)cn2)c1 ZINC000554735977 568409165 /nfs/dbraw/zinc/40/91/65/568409165.db2.gz ZYEGGKKUWZWNDV-ZHRRBRCNSA-N 1 0 360.457 5.221 20 0 FKADRO Fc1cccc(OC(F)F)c1C[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000554736634 568409172 /nfs/dbraw/zinc/40/91/72/568409172.db2.gz BYXCTDXGQYIYCH-KRWDZBQOSA-N 1 0 360.379 5.076 20 0 FKADRO Fc1cccc(OC(F)F)c1C[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000554736635 568409151 /nfs/dbraw/zinc/40/91/51/568409151.db2.gz BYXCTDXGQYIYCH-QGZVFWFLSA-N 1 0 360.379 5.076 20 0 FKADRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000554736728 568409167 /nfs/dbraw/zinc/40/91/67/568409167.db2.gz AZZGIVRAJDWSPP-QRWLVFNGSA-N 1 0 358.489 5.266 20 0 FKADRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000554736729 568409266 /nfs/dbraw/zinc/40/92/66/568409266.db2.gz AZZGIVRAJDWSPP-YWZLYKJASA-N 1 0 358.489 5.266 20 0 FKADRO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]Cc1cccc(OC(F)F)c1 ZINC000554739256 568409226 /nfs/dbraw/zinc/40/92/26/568409226.db2.gz QUAISWBTNUVCDX-IBGZPJMESA-N 1 0 356.416 5.245 20 0 FKADRO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]Cc1cccc(OC(F)F)c1 ZINC000554739258 568409238 /nfs/dbraw/zinc/40/92/38/568409238.db2.gz QUAISWBTNUVCDX-LJQANCHMSA-N 1 0 356.416 5.245 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000554739569 568409209 /nfs/dbraw/zinc/40/92/09/568409209.db2.gz VGGMCMIJNXQMFR-BTYIYWSLSA-N 1 0 364.537 5.464 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000554739571 568409254 /nfs/dbraw/zinc/40/92/54/568409254.db2.gz VGGMCMIJNXQMFR-QVKFZJNVSA-N 1 0 364.537 5.464 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000554739572 568409217 /nfs/dbraw/zinc/40/92/17/568409217.db2.gz VGGMCMIJNXQMFR-VFNWGFHPSA-N 1 0 364.537 5.464 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000554739573 568409259 /nfs/dbraw/zinc/40/92/59/568409259.db2.gz VGGMCMIJNXQMFR-YCRPNKLZSA-N 1 0 364.537 5.464 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)c1ccc(OC)c(OC)c1 ZINC000554740151 568409207 /nfs/dbraw/zinc/40/92/07/568409207.db2.gz BYCNFJXVTQHGHY-ICSRJNTNSA-N 1 0 364.489 5.303 20 0 FKADRO CC[C@@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)c1ccc(OC)c(OC)c1 ZINC000554740154 568409246 /nfs/dbraw/zinc/40/92/46/568409246.db2.gz BYCNFJXVTQHGHY-QUCCMNQESA-N 1 0 364.489 5.303 20 0 FKADRO CC[C@@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)c1ccc(OC)c(OC)c1 ZINC000554740157 568409240 /nfs/dbraw/zinc/40/92/40/568409240.db2.gz BYCNFJXVTQHGHY-UYAOXDASSA-N 1 0 364.489 5.303 20 0 FKADRO COc1ccc2c(c1F)CC[C@H]2[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000554740395 568409235 /nfs/dbraw/zinc/40/92/35/568409235.db2.gz GTQUPISSFFLDJT-MEDUHNTESA-N 1 0 353.359 5.191 20 0 FKADRO COc1ccc2c(c1F)CC[C@@H]2[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000554740400 568409219 /nfs/dbraw/zinc/40/92/19/568409219.db2.gz GTQUPISSFFLDJT-ZBEGNZNMSA-N 1 0 353.359 5.191 20 0 FKADRO COC[C@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000554741671 568409348 /nfs/dbraw/zinc/40/93/48/568409348.db2.gz MNQNQVQTONKDCV-OALUTQOASA-N 1 0 357.881 5.064 20 0 FKADRO COC[C@@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000554741674 568409337 /nfs/dbraw/zinc/40/93/37/568409337.db2.gz MNQNQVQTONKDCV-RBUKOAKNSA-N 1 0 357.881 5.064 20 0 FKADRO COC[C@@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000554741675 568409365 /nfs/dbraw/zinc/40/93/65/568409365.db2.gz MNQNQVQTONKDCV-RTBURBONSA-N 1 0 357.881 5.064 20 0 FKADRO C[N@H+](Cc1csc(-c2ccc(F)cc2)n1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000554749354 568409380 /nfs/dbraw/zinc/40/93/80/568409380.db2.gz NBVCLKDCMUVEMN-AKAXFMLLSA-N 1 0 372.431 5.502 20 0 FKADRO C[N@H+](Cc1cnc(-c2ccccc2)s1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000554749917 568409412 /nfs/dbraw/zinc/40/94/12/568409412.db2.gz UVYBDMVYZACABG-GASCZTMLSA-N 1 0 354.441 5.363 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cnc(-c2ccccc2)nc1)c1ccc(Cl)cc1 ZINC000554775060 568409752 /nfs/dbraw/zinc/40/97/52/568409752.db2.gz WBJCVZUSBLJYIR-FQEVSTJZSA-N 1 0 351.881 5.284 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cnc(-c2ccccc2)nc1)c1ccc(Cl)cc1 ZINC000554775069 568409727 /nfs/dbraw/zinc/40/97/27/568409727.db2.gz WBJCVZUSBLJYIR-HXUWFJFHSA-N 1 0 351.881 5.284 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)c1cc[nH]c1C1CCC1)C1CCCCC1 ZINC000554777021 568409721 /nfs/dbraw/zinc/40/97/21/568409721.db2.gz AQVONKYMNUYBBR-UHFFFAOYSA-N 1 0 365.521 5.299 20 0 FKADRO Cc1ccc([C@@H]2CC[N@@H+]([C@@H](C)c3nnc(-c4ccccc4F)s3)C2)cc1 ZINC000554816238 568410135 /nfs/dbraw/zinc/41/01/35/568410135.db2.gz QWLDANRBDLOWAM-DOTOQJQBSA-N 1 0 367.493 5.203 20 0 FKADRO Cc1ccc([C@@H]2CC[N@@H+]([C@H](C)c3nnc(-c4ccccc4F)s3)C2)cc1 ZINC000554816242 568410151 /nfs/dbraw/zinc/41/01/51/568410151.db2.gz QWLDANRBDLOWAM-NVXWUHKLSA-N 1 0 367.493 5.203 20 0 FKADRO Cc1ccc([C@H]2CC[N@@H+]([C@@H](C)c3nnc(-c4ccccc4F)s3)C2)cc1 ZINC000554816244 568410191 /nfs/dbraw/zinc/41/01/91/568410191.db2.gz QWLDANRBDLOWAM-RDJZCZTQSA-N 1 0 367.493 5.203 20 0 FKADRO Cc1ccc([C@H]2CC[N@@H+]([C@H](C)c3nnc(-c4ccccc4F)s3)C2)cc1 ZINC000554816245 568410220 /nfs/dbraw/zinc/41/02/20/568410220.db2.gz QWLDANRBDLOWAM-WBVHZDCISA-N 1 0 367.493 5.203 20 0 FKADRO CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000554858182 568410738 /nfs/dbraw/zinc/41/07/38/568410738.db2.gz IRLBNAPWWVXSLK-DLBZAZTESA-N 1 0 355.478 5.047 20 0 FKADRO CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000554858185 568410652 /nfs/dbraw/zinc/41/06/52/568410652.db2.gz IRLBNAPWWVXSLK-IAGOWNOFSA-N 1 0 355.478 5.047 20 0 FKADRO CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000554858187 568410683 /nfs/dbraw/zinc/41/06/83/568410683.db2.gz IRLBNAPWWVXSLK-IRXDYDNUSA-N 1 0 355.478 5.047 20 0 FKADRO CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000554858189 568410677 /nfs/dbraw/zinc/41/06/77/568410677.db2.gz IRLBNAPWWVXSLK-SJORKVTESA-N 1 0 355.478 5.047 20 0 FKADRO c1coc(COCc2cccc(C[NH2+][C@@H]3CCCNc4ccccc43)c2)c1 ZINC000554858696 568410725 /nfs/dbraw/zinc/41/07/25/568410725.db2.gz UROAMMLZENGKKL-HSZRJFAPSA-N 1 0 362.473 5.033 20 0 FKADRO c1coc(COCc2cccc(C[NH2+][C@H]3CCCNc4ccccc43)c2)c1 ZINC000554858697 568410712 /nfs/dbraw/zinc/41/07/12/568410712.db2.gz UROAMMLZENGKKL-QHCPKHFHSA-N 1 0 362.473 5.033 20 0 FKADRO CC(C)(C)OCc1cc(C[NH2+]CC2CCC(c3ccccc3)CC2)no1 ZINC000554861848 568410811 /nfs/dbraw/zinc/41/08/11/568410811.db2.gz VUEALHUBUUMGSL-UHFFFAOYSA-N 1 0 356.510 5.053 20 0 FKADRO COc1ccc(-c2csc(C[NH2+][C@@H]3CCCNc4ccccc43)c2)cc1 ZINC000554862010 568410775 /nfs/dbraw/zinc/41/07/75/568410775.db2.gz VONXGPVGOJXTAY-JOCHJYFZSA-N 1 0 364.514 5.460 20 0 FKADRO COc1ccc(-c2csc(C[NH2+][C@H]3CCCNc4ccccc43)c2)cc1 ZINC000554862011 568410806 /nfs/dbraw/zinc/41/08/06/568410806.db2.gz VONXGPVGOJXTAY-QFIPXVFZSA-N 1 0 364.514 5.460 20 0 FKADRO Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)cc1 ZINC000554864854 568410745 /nfs/dbraw/zinc/41/07/45/568410745.db2.gz HNNOUTWQOCFRNE-HUUCEWRRSA-N 1 0 363.436 5.478 20 0 FKADRO Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)cc1 ZINC000554864855 568410769 /nfs/dbraw/zinc/41/07/69/568410769.db2.gz HNNOUTWQOCFRNE-LSDHHAIUSA-N 1 0 363.436 5.478 20 0 FKADRO C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(Br)cc1 ZINC000554866436 568410766 /nfs/dbraw/zinc/41/07/66/568410766.db2.gz FYCILXNRYMYECO-CBCUQQMYSA-N 1 0 354.332 5.084 20 0 FKADRO C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(Br)cc1 ZINC000554866439 568410804 /nfs/dbraw/zinc/41/08/04/568410804.db2.gz FYCILXNRYMYECO-TUBUQKNSSA-N 1 0 354.332 5.084 20 0 FKADRO C[C@H](CCc1ccsc1)[NH2+][C@H](C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000554867637 568410773 /nfs/dbraw/zinc/41/07/73/568410773.db2.gz RKFCJKLXIHDSTP-CHWSQXEVSA-N 1 0 361.898 5.123 20 0 FKADRO C[C@H](CCc1ccsc1)[NH2+][C@@H](C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000554867641 568410797 /nfs/dbraw/zinc/41/07/97/568410797.db2.gz RKFCJKLXIHDSTP-OLZOCXBDSA-N 1 0 361.898 5.123 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)CCc1ccsc1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000554867642 568410808 /nfs/dbraw/zinc/41/08/08/568410808.db2.gz RKFCJKLXIHDSTP-QWHCGFSZSA-N 1 0 361.898 5.123 20 0 FKADRO C[C@@H](CCc1ccsc1)[NH2+][C@@H](C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000554867643 568410777 /nfs/dbraw/zinc/41/07/77/568410777.db2.gz RKFCJKLXIHDSTP-STQMWFEESA-N 1 0 361.898 5.123 20 0 FKADRO FC(F)c1nc2ccc(NC3CC[NH+](Cc4ccccc4)CC3)cc2s1 ZINC000554872732 568410800 /nfs/dbraw/zinc/41/08/00/568410800.db2.gz AEJPFZPYYFKPNL-UHFFFAOYSA-N 1 0 373.472 5.310 20 0 FKADRO CC(C)c1ccc(CC[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554875588 568410858 /nfs/dbraw/zinc/41/08/58/568410858.db2.gz IXGZRJMACAHXOH-FQEVSTJZSA-N 1 0 353.510 5.230 20 0 FKADRO CC(C)c1ccc(CC[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554875589 568410830 /nfs/dbraw/zinc/41/08/30/568410830.db2.gz IXGZRJMACAHXOH-HXUWFJFHSA-N 1 0 353.510 5.230 20 0 FKADRO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(-c2ccccc2)cc1OC ZINC000554877678 568410819 /nfs/dbraw/zinc/41/08/19/568410819.db2.gz PURIPWVARVMJIK-JOCHJYFZSA-N 1 0 374.484 5.103 20 0 FKADRO COc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(-c2ccccc2)cc1OC ZINC000554877679 568410826 /nfs/dbraw/zinc/41/08/26/568410826.db2.gz PURIPWVARVMJIK-QFIPXVFZSA-N 1 0 374.484 5.103 20 0 FKADRO Cc1ccccc1-c1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000554884497 568411200 /nfs/dbraw/zinc/41/12/00/568411200.db2.gz UCMTWWJXORMPIS-GOSISDBHSA-N 1 0 370.496 5.398 20 0 FKADRO Cc1ccccc1-c1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000554884498 568411203 /nfs/dbraw/zinc/41/12/03/568411203.db2.gz UCMTWWJXORMPIS-SFHVURJKSA-N 1 0 370.496 5.398 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)c(-c2cnn(C)c2)c1 ZINC000554915335 568411431 /nfs/dbraw/zinc/41/14/31/568411431.db2.gz RGHOMKMTMSNZIC-JOCHJYFZSA-N 1 0 365.908 5.290 20 0 FKADRO Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)c(-c2cnn(C)c2)c1 ZINC000554915336 568411427 /nfs/dbraw/zinc/41/14/27/568411427.db2.gz RGHOMKMTMSNZIC-QFIPXVFZSA-N 1 0 365.908 5.290 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)ccc2n1C1CC1 ZINC000554917621 568411368 /nfs/dbraw/zinc/41/13/68/568411368.db2.gz DRHBZVLMBHKTNL-UHFFFAOYSA-N 1 0 372.516 5.322 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H]3CCC[C@@H](C(F)(F)F)C3)ccc2n1C1CC1 ZINC000554917656 568411373 /nfs/dbraw/zinc/41/13/73/568411373.db2.gz GTKMZWHHSCZACG-CABCVRRESA-N 1 0 365.443 5.144 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H]3CCC[C@H](C(F)(F)F)C3)ccc2n1C1CC1 ZINC000554917657 568411415 /nfs/dbraw/zinc/41/14/15/568411415.db2.gz GTKMZWHHSCZACG-GJZGRUSLSA-N 1 0 365.443 5.144 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H]3CCC[C@@H](C(F)(F)F)C3)ccc2n1C1CC1 ZINC000554917658 568411399 /nfs/dbraw/zinc/41/13/99/568411399.db2.gz GTKMZWHHSCZACG-HUUCEWRRSA-N 1 0 365.443 5.144 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)ccc2n1C1CC1 ZINC000554917659 568411425 /nfs/dbraw/zinc/41/14/25/568411425.db2.gz GTKMZWHHSCZACG-LSDHHAIUSA-N 1 0 365.443 5.144 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3cc(Cl)ccc3F)ccc2n1C1CC1 ZINC000554922035 568411391 /nfs/dbraw/zinc/41/13/91/568411391.db2.gz JEBQSVIGRANZOM-UHFFFAOYSA-N 1 0 357.860 5.016 20 0 FKADRO CCn1c(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)nc2ccccc21 ZINC000554939990 568411588 /nfs/dbraw/zinc/41/15/88/568411588.db2.gz SNFRAHGTAVOFLO-HXUWFJFHSA-N 1 0 373.422 5.316 20 0 FKADRO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2n1C)c1ccc(C(F)(F)F)cc1 ZINC000554955478 568407283 /nfs/dbraw/zinc/40/72/83/568407283.db2.gz XDVQQYQYLHRWDY-NSHDSACASA-N 1 0 367.802 5.096 20 0 FKADRO C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000554977538 568407462 /nfs/dbraw/zinc/40/74/62/568407462.db2.gz URLQERGVBLPDSZ-AJAJECMGSA-N 1 0 373.443 5.059 20 0 FKADRO C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000554977539 568407435 /nfs/dbraw/zinc/40/74/35/568407435.db2.gz URLQERGVBLPDSZ-IXRNMBTOSA-N 1 0 373.443 5.059 20 0 FKADRO Cc1cc(C[NH2+]Cc2cc(-c3ccccc3)cs2)cc(N2CCCC2)n1 ZINC000554982601 568407820 /nfs/dbraw/zinc/40/78/20/568407820.db2.gz WWWQKTQLPBGQLJ-UHFFFAOYSA-N 1 0 363.530 5.009 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1nccc2ccccc21)c1ccc(Br)cc1 ZINC000554985575 568408159 /nfs/dbraw/zinc/40/81/59/568408159.db2.gz MLEMLEXNWMAWGH-KBPBESRZSA-N 1 0 355.279 5.409 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1nccc2ccccc21)c1ccc(Br)cc1 ZINC000554985576 568408147 /nfs/dbraw/zinc/40/81/47/568408147.db2.gz MLEMLEXNWMAWGH-KGLIPLIRSA-N 1 0 355.279 5.409 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1)c1nccc2ccccc21 ZINC000554985577 568408150 /nfs/dbraw/zinc/40/81/50/568408150.db2.gz MLEMLEXNWMAWGH-UONOGXRCSA-N 1 0 355.279 5.409 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1nccc2ccccc21)c1ccc(Br)cc1 ZINC000554985578 568408138 /nfs/dbraw/zinc/40/81/38/568408138.db2.gz MLEMLEXNWMAWGH-ZIAGYGMSSA-N 1 0 355.279 5.409 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1nccc2ccccc21 ZINC000554988876 568408199 /nfs/dbraw/zinc/40/81/99/568408199.db2.gz QHGFJNZLWDZBHW-ACJLOTCBSA-N 1 0 354.906 5.776 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1nccc2ccccc21 ZINC000554988877 568408192 /nfs/dbraw/zinc/40/81/92/568408192.db2.gz QHGFJNZLWDZBHW-FZKQIMNGSA-N 1 0 354.906 5.776 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1nccc2ccccc21 ZINC000554988878 568408219 /nfs/dbraw/zinc/40/82/19/568408219.db2.gz QHGFJNZLWDZBHW-SCLBCKFNSA-N 1 0 354.906 5.776 20 0 FKADRO C[C@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1nccc2ccccc21 ZINC000554988879 568408254 /nfs/dbraw/zinc/40/82/54/568408254.db2.gz QHGFJNZLWDZBHW-UGSOOPFHSA-N 1 0 354.906 5.776 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000554990285 568408453 /nfs/dbraw/zinc/40/84/53/568408453.db2.gz GOCZJDVJSZBINM-HOTGVXAUSA-N 1 0 373.525 6.079 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)c1nccc2ccccc21 ZINC000554990286 568408428 /nfs/dbraw/zinc/40/84/28/568408428.db2.gz GOCZJDVJSZBINM-HZPDHXFCSA-N 1 0 373.525 6.079 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000554990287 568408420 /nfs/dbraw/zinc/40/84/20/568408420.db2.gz GOCZJDVJSZBINM-JKSUJKDBSA-N 1 0 373.525 6.079 20 0 FKADRO COc1ccc2c(c1)[C@H]([NH2+][C@H]1CCc3sc(Cl)cc31)CCCS2 ZINC000554992106 568408650 /nfs/dbraw/zinc/40/86/50/568408650.db2.gz WDONCPOXJYXVNE-CABCVRRESA-N 1 0 365.951 5.614 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCc3sc(Cl)cc31)CCCS2 ZINC000554992107 568408614 /nfs/dbraw/zinc/40/86/14/568408614.db2.gz WDONCPOXJYXVNE-GJZGRUSLSA-N 1 0 365.951 5.614 20 0 FKADRO COc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCc3sc(Cl)cc31)CCCS2 ZINC000554992108 568408655 /nfs/dbraw/zinc/40/86/55/568408655.db2.gz WDONCPOXJYXVNE-HUUCEWRRSA-N 1 0 365.951 5.614 20 0 FKADRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCc3sc(Cl)cc31)CCCS2 ZINC000554992109 568408616 /nfs/dbraw/zinc/40/86/16/568408616.db2.gz WDONCPOXJYXVNE-LSDHHAIUSA-N 1 0 365.951 5.614 20 0 FKADRO Cc1cc([C@@H]([NH2+]Cc2cccc(CO)c2)c2cccc(Cl)c2)c(C)s1 ZINC000554997959 568410071 /nfs/dbraw/zinc/41/00/71/568410071.db2.gz SIUKVJTZCMRYHV-NRFANRHFSA-N 1 0 371.933 5.390 20 0 FKADRO Cc1cc([C@H]([NH2+]Cc2cccc(CO)c2)c2cccc(Cl)c2)c(C)s1 ZINC000554997960 568410025 /nfs/dbraw/zinc/41/00/25/568410025.db2.gz SIUKVJTZCMRYHV-OAQYLSRUSA-N 1 0 371.933 5.390 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Oc2cccc(F)c2)nc1)c1nccc2ccccc21 ZINC000554998221 568410094 /nfs/dbraw/zinc/41/00/94/568410094.db2.gz XAICOKYOYRVUTI-INIZCTEOSA-N 1 0 373.431 5.412 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Oc2cccc(F)c2)nc1)c1nccc2ccccc21 ZINC000554998222 568410121 /nfs/dbraw/zinc/41/01/21/568410121.db2.gz XAICOKYOYRVUTI-MRXNPFEDSA-N 1 0 373.431 5.412 20 0 FKADRO Cc1cc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)cc(N2CCCC2)n1 ZINC000555000760 568411135 /nfs/dbraw/zinc/41/11/35/568411135.db2.gz XXNOASYQAUVPPL-AWEZNQCLSA-N 1 0 364.320 5.148 20 0 FKADRO Cc1cc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)cc(N2CCCC2)n1 ZINC000555000761 568411166 /nfs/dbraw/zinc/41/11/66/568411166.db2.gz XXNOASYQAUVPPL-CQSZACIVSA-N 1 0 364.320 5.148 20 0 FKADRO Cc1ccc2cc([C@H](C)[NH2+][C@@H]3c4ccccc4CC34CCOCC4)oc2c1 ZINC000555002468 568411359 /nfs/dbraw/zinc/41/13/59/568411359.db2.gz FZKNLWVQPAPDOM-GAJHUEQPSA-N 1 0 361.485 5.486 20 0 FKADRO Cc1ccc2cc([C@@H](C)[NH2+][C@H]3c4ccccc4CC34CCOCC4)oc2c1 ZINC000555002471 568411419 /nfs/dbraw/zinc/41/14/19/568411419.db2.gz FZKNLWVQPAPDOM-HXOBKFHXSA-N 1 0 361.485 5.486 20 0 FKADRO Cc1ccc2cc([C@H](C)[NH2+][C@H]3c4ccccc4CC34CCOCC4)oc2c1 ZINC000555002473 568411378 /nfs/dbraw/zinc/41/13/78/568411378.db2.gz FZKNLWVQPAPDOM-SBUREZEXSA-N 1 0 361.485 5.486 20 0 FKADRO Cc1ccc2cc([C@@H](C)[NH2+][C@@H]3c4ccccc4CC34CCOCC4)oc2c1 ZINC000555002474 568411381 /nfs/dbraw/zinc/41/13/81/568411381.db2.gz FZKNLWVQPAPDOM-UZUQRXQVSA-N 1 0 361.485 5.486 20 0 FKADRO COc1ccccc1[C@@H](C[NH2+][C@@H](C)c1nccc2ccccc21)OC(C)C ZINC000555002519 568411366 /nfs/dbraw/zinc/41/13/66/568411366.db2.gz HOZJHPQXIWAARM-HTAPYJJXSA-N 1 0 364.489 5.060 20 0 FKADRO COc1ccccc1[C@H](C[NH2+][C@@H](C)c1nccc2ccccc21)OC(C)C ZINC000555002520 568411423 /nfs/dbraw/zinc/41/14/23/568411423.db2.gz HOZJHPQXIWAARM-JTSKRJEESA-N 1 0 364.489 5.060 20 0 FKADRO COc1ccccc1[C@@H](C[NH2+][C@H](C)c1nccc2ccccc21)OC(C)C ZINC000555002521 568411364 /nfs/dbraw/zinc/41/13/64/568411364.db2.gz HOZJHPQXIWAARM-VGOFRKELSA-N 1 0 364.489 5.060 20 0 FKADRO COc1ccccc1[C@H](C[NH2+][C@H](C)c1nccc2ccccc21)OC(C)C ZINC000555002522 568411393 /nfs/dbraw/zinc/41/13/93/568411393.db2.gz HOZJHPQXIWAARM-VGSWGCGISA-N 1 0 364.489 5.060 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000555003265 568411480 /nfs/dbraw/zinc/41/14/80/568411480.db2.gz WMJYQMANOIAJRP-HOTGVXAUSA-N 1 0 373.422 5.362 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000555003267 568411508 /nfs/dbraw/zinc/41/15/08/568411508.db2.gz WMJYQMANOIAJRP-JKSUJKDBSA-N 1 0 373.422 5.362 20 0 FKADRO CO[C@@H](C[NH+]1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 ZINC000555015111 568415198 /nfs/dbraw/zinc/41/51/98/568415198.db2.gz PBCOALGGHSZCMS-FQEVSTJZSA-N 1 0 370.880 5.048 20 0 FKADRO CO[C@H](C[NH+]1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 ZINC000555015112 568415185 /nfs/dbraw/zinc/41/51/85/568415185.db2.gz PBCOALGGHSZCMS-HXUWFJFHSA-N 1 0 370.880 5.048 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1sccc1Cl ZINC000555051206 568416003 /nfs/dbraw/zinc/41/60/03/568416003.db2.gz CWUWBMIFDMBZFX-JTQLQIEISA-N 1 0 366.914 5.823 20 0 FKADRO C[C@H](CCCCO)[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000555058334 568416419 /nfs/dbraw/zinc/41/64/19/568416419.db2.gz JVKPMBKHLPCLCZ-AUUYWEPGSA-N 1 0 369.402 5.075 20 0 FKADRO C[C@@H](CCCCO)[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000555058335 568416620 /nfs/dbraw/zinc/41/66/20/568416620.db2.gz JVKPMBKHLPCLCZ-IFXJQAMLSA-N 1 0 369.402 5.075 20 0 FKADRO C[C@H](CCCCO)[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000555058336 568416602 /nfs/dbraw/zinc/41/66/02/568416602.db2.gz JVKPMBKHLPCLCZ-KUHUBIRLSA-N 1 0 369.402 5.075 20 0 FKADRO C[C@@H](CCCCO)[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000555058337 568416570 /nfs/dbraw/zinc/41/65/70/568416570.db2.gz JVKPMBKHLPCLCZ-LIRRHRJNSA-N 1 0 369.402 5.075 20 0 FKADRO C[NH+](C)CCCCC(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 ZINC000555078200 568416721 /nfs/dbraw/zinc/41/67/21/568416721.db2.gz HIGGYKMBNVDUQF-UHFFFAOYSA-N 1 0 372.512 5.691 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000555091757 568416913 /nfs/dbraw/zinc/41/69/13/568416913.db2.gz GKTOYFUIICIVDU-CXAGYDPISA-N 1 0 355.425 5.024 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000555091760 568416947 /nfs/dbraw/zinc/41/69/47/568416947.db2.gz GKTOYFUIICIVDU-DYVFJYSZSA-N 1 0 355.425 5.024 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000555091762 568416928 /nfs/dbraw/zinc/41/69/28/568416928.db2.gz GKTOYFUIICIVDU-GUYCJALGSA-N 1 0 355.425 5.024 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000555091763 568416882 /nfs/dbraw/zinc/41/68/82/568416882.db2.gz GKTOYFUIICIVDU-SUMWQHHRSA-N 1 0 355.425 5.024 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+]Cc2cscc2C(F)(F)F)cc1OCC ZINC000555093476 568416941 /nfs/dbraw/zinc/41/69/41/568416941.db2.gz DBNXSPUQGQTXOV-GFCCVEGCSA-N 1 0 373.440 5.415 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+]Cc2cscc2C(F)(F)F)cc1OCC ZINC000555093477 568416919 /nfs/dbraw/zinc/41/69/19/568416919.db2.gz DBNXSPUQGQTXOV-LBPRGKRZSA-N 1 0 373.440 5.415 20 0 FKADRO CC(C)Cc1ncc(C[NH+]2CCC(c3noc4cc(F)ccc43)CC2)s1 ZINC000555099290 568417192 /nfs/dbraw/zinc/41/71/92/568417192.db2.gz MMXRPXJCDDURSN-UHFFFAOYSA-N 1 0 373.497 5.002 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000555103944 568417365 /nfs/dbraw/zinc/41/73/65/568417365.db2.gz NXUQAAIWWKKUPF-HUUCEWRRSA-N 1 0 361.816 5.040 20 0 FKADRO FC(F)(F)c1cscc1C[NH2+][C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000555103945 568417359 /nfs/dbraw/zinc/41/73/59/568417359.db2.gz NXUQAAIWWKKUPF-LSDHHAIUSA-N 1 0 361.816 5.040 20 0 FKADRO Cc1ccc(C)c([C@H](C)N[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164542 568418848 /nfs/dbraw/zinc/41/88/48/568418848.db2.gz SNROKBNZZUUFHD-HRAATJIYSA-N 1 0 353.897 5.131 20 0 FKADRO Cc1ccc(C)c([C@@H](C)N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164554 568418936 /nfs/dbraw/zinc/41/89/36/568418936.db2.gz SNROKBNZZUUFHD-IERDGZPVSA-N 1 0 353.897 5.131 20 0 FKADRO Cc1ccc(C)c([C@@H](C)N[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164558 568418889 /nfs/dbraw/zinc/41/88/89/568418889.db2.gz SNROKBNZZUUFHD-IIBYNOLFSA-N 1 0 353.897 5.131 20 0 FKADRO Cc1ccc(C)c([C@H](C)N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164561 568418878 /nfs/dbraw/zinc/41/88/78/568418878.db2.gz SNROKBNZZUUFHD-KKSFZXQISA-N 1 0 353.897 5.131 20 0 FKADRO CCOc1cccc(C[NH2+]C2(c3ccc(Br)cc3)CCC2)c1 ZINC000555190522 568411646 /nfs/dbraw/zinc/41/16/46/568411646.db2.gz JITILCDBOIXGAB-UHFFFAOYSA-N 1 0 360.295 5.017 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000555226062 568411938 /nfs/dbraw/zinc/41/19/38/568411938.db2.gz IQISSHCQLUPUNT-PMACEKPBSA-N 1 0 369.892 5.101 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000555226065 568411875 /nfs/dbraw/zinc/41/18/75/568411875.db2.gz IQISSHCQLUPUNT-UXHICEINSA-N 1 0 369.892 5.101 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000555226067 568411878 /nfs/dbraw/zinc/41/18/78/568411878.db2.gz IQISSHCQLUPUNT-VQTJNVASSA-N 1 0 369.892 5.101 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000555226068 568411920 /nfs/dbraw/zinc/41/19/20/568411920.db2.gz IQISSHCQLUPUNT-WOJBJXKFSA-N 1 0 369.892 5.101 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2SC)c2ccccc21 ZINC000555226233 568411899 /nfs/dbraw/zinc/41/18/99/568411899.db2.gz VIBLOWSTWUTETR-CDHQVMDDSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2SC)c2ccccc21 ZINC000555226234 568411931 /nfs/dbraw/zinc/41/19/31/568411931.db2.gz VIBLOWSTWUTETR-UIAACRFSSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2SC)c2ccccc21 ZINC000555226235 568411929 /nfs/dbraw/zinc/41/19/29/568411929.db2.gz VIBLOWSTWUTETR-XPGWFJOJSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2SC)c2ccccc21 ZINC000555226236 568411890 /nfs/dbraw/zinc/41/18/90/568411890.db2.gz VIBLOWSTWUTETR-YSGRDPCXSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2cccc(Cl)c2)c2ccccc21 ZINC000555226489 568411936 /nfs/dbraw/zinc/41/19/36/568411936.db2.gz WGRXMBAKLXDXKE-XMCHAPAWSA-N 1 0 357.881 5.172 20 0 FKADRO C[C@@H]1CC(CC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@@H](C)O1 ZINC000555226567 568411914 /nfs/dbraw/zinc/41/19/14/568411914.db2.gz WQZYWCWXYKGYHA-DRSNIGMVSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@H](C)O1 ZINC000555226575 568411912 /nfs/dbraw/zinc/41/19/12/568411912.db2.gz WQZYWCWXYKGYHA-SUWCGCSTSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1C[C@@H](CC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@H](C)O1 ZINC000555226576 568411883 /nfs/dbraw/zinc/41/18/83/568411883.db2.gz WQZYWCWXYKGYHA-WYADAEROSA-N 1 0 372.940 5.202 20 0 FKADRO C[C@@H]1CC(CC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@@H](C)O1 ZINC000555226577 568411877 /nfs/dbraw/zinc/41/18/77/568411877.db2.gz WQZYWCWXYKGYHA-YVHKJVDXSA-N 1 0 372.940 5.202 20 0 FKADRO CCc1cnc(C[NH2+][C@H]2CCCCc3cc(Br)ccc32)s1 ZINC000555226854 568411895 /nfs/dbraw/zinc/41/18/95/568411895.db2.gz OIKYBMYCDZSWJB-INIZCTEOSA-N 1 0 365.340 5.025 20 0 FKADRO CCc1cnc(C[NH2+][C@@H]2CCCCc3cc(Br)ccc32)s1 ZINC000555226855 568411887 /nfs/dbraw/zinc/41/18/87/568411887.db2.gz OIKYBMYCDZSWJB-MRXNPFEDSA-N 1 0 365.340 5.025 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnccn1 ZINC000555227640 568411903 /nfs/dbraw/zinc/41/19/03/568411903.db2.gz VMWILLNZFJMGPK-AUUYWEPGSA-N 1 0 363.427 5.468 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnccn1 ZINC000555227646 568411910 /nfs/dbraw/zinc/41/19/10/568411910.db2.gz VMWILLNZFJMGPK-IFXJQAMLSA-N 1 0 363.427 5.468 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnccn1 ZINC000555227648 568411905 /nfs/dbraw/zinc/41/19/05/568411905.db2.gz VMWILLNZFJMGPK-KUHUBIRLSA-N 1 0 363.427 5.468 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cnccn1 ZINC000555227651 568411917 /nfs/dbraw/zinc/41/19/17/568411917.db2.gz VMWILLNZFJMGPK-LIRRHRJNSA-N 1 0 363.427 5.468 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1nccn1C ZINC000555227767 568411901 /nfs/dbraw/zinc/41/19/01/568411901.db2.gz XAUIIERISWRBRM-KBXCAEBGSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1nccn1C ZINC000555227772 568411922 /nfs/dbraw/zinc/41/19/22/568411922.db2.gz XAUIIERISWRBRM-KDOFPFPSSA-N 1 0 365.443 5.411 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1nccn1C ZINC000555227774 568411881 /nfs/dbraw/zinc/41/18/81/568411881.db2.gz XAUIIERISWRBRM-KSSFIOAISA-N 1 0 365.443 5.411 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1nccn1C ZINC000555227776 568411942 /nfs/dbraw/zinc/41/19/42/568411942.db2.gz XAUIIERISWRBRM-RDTXWAMCSA-N 1 0 365.443 5.411 20 0 FKADRO CC(C)CC[C@H]([NH2+][C@H](C)[C@H](OC1CCOCC1)c1ccccc1)C1CC1 ZINC000555228788 568411919 /nfs/dbraw/zinc/41/19/19/568411919.db2.gz JIZVVMDRFKRJIF-LEOXJPRUSA-N 1 0 359.554 5.116 20 0 FKADRO CC(C)CC[C@H]([NH2+][C@@H](C)[C@@H](OC1CCOCC1)c1ccccc1)C1CC1 ZINC000555228789 568411925 /nfs/dbraw/zinc/41/19/25/568411925.db2.gz JIZVVMDRFKRJIF-OFAXGOBFSA-N 1 0 359.554 5.116 20 0 FKADRO CC(C)CC[C@H]([NH2+][C@@H](C)[C@H](OC1CCOCC1)c1ccccc1)C1CC1 ZINC000555228790 568411907 /nfs/dbraw/zinc/41/19/07/568411907.db2.gz JIZVVMDRFKRJIF-TZYHBYERSA-N 1 0 359.554 5.116 20 0 FKADRO CC(C)CC[C@H]([NH2+][C@H](C)[C@@H](OC1CCOCC1)c1ccccc1)C1CC1 ZINC000555228791 568411892 /nfs/dbraw/zinc/41/18/92/568411892.db2.gz JIZVVMDRFKRJIF-YFXJRYMSSA-N 1 0 359.554 5.116 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H]3CCCc4sccc43)ccc2n1C1CC1 ZINC000555232275 568412141 /nfs/dbraw/zinc/41/21/41/568412141.db2.gz AARSIEDQTLMNJQ-KRWDZBQOSA-N 1 0 351.519 5.162 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H]3CCCc4sccc43)ccc2n1C1CC1 ZINC000555232276 568412111 /nfs/dbraw/zinc/41/21/11/568412111.db2.gz AARSIEDQTLMNJQ-QGZVFWFLSA-N 1 0 351.519 5.162 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cc(F)c(F)c(F)c3)ccc2n1C1CC1 ZINC000555232738 568412156 /nfs/dbraw/zinc/41/21/56/568412156.db2.gz LKLRNRYRKTWUCZ-GFCCVEGCSA-N 1 0 373.422 5.202 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](C)c3cc(F)c(F)c(F)c3)ccc2n1C1CC1 ZINC000555232739 568412224 /nfs/dbraw/zinc/41/22/24/568412224.db2.gz LKLRNRYRKTWUCZ-LBPRGKRZSA-N 1 0 373.422 5.202 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cccc(F)c3F)ccc2n1C1CC1 ZINC000555233371 568412228 /nfs/dbraw/zinc/41/22/28/568412228.db2.gz VETFWOLIIRILBC-CYBMUJFWSA-N 1 0 355.432 5.063 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](C)c3cccc(F)c3F)ccc2n1C1CC1 ZINC000555233372 568412171 /nfs/dbraw/zinc/41/21/71/568412171.db2.gz VETFWOLIIRILBC-ZDUSSCGKSA-N 1 0 355.432 5.063 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000555234544 568412354 /nfs/dbraw/zinc/41/23/54/568412354.db2.gz QKQHHFVSWFSNNU-CYUUQNCZSA-N 1 0 354.441 5.395 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000555234545 568412348 /nfs/dbraw/zinc/41/23/48/568412348.db2.gz QKQHHFVSWFSNNU-MXAVVETBSA-N 1 0 354.441 5.395 20 0 FKADRO CC[C@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000555234546 568412320 /nfs/dbraw/zinc/41/23/20/568412320.db2.gz QKQHHFVSWFSNNU-UNQGMJICSA-N 1 0 354.441 5.395 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000555234547 568412338 /nfs/dbraw/zinc/41/23/38/568412338.db2.gz QKQHHFVSWFSNNU-UQOMUDLDSA-N 1 0 354.441 5.395 20 0 FKADRO CCC[C@@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1cccc(C(F)(F)F)c1 ZINC000555241505 568412342 /nfs/dbraw/zinc/41/23/42/568412342.db2.gz BDLIXXNUGFIYGY-GOSISDBHSA-N 1 0 361.411 5.223 20 0 FKADRO CCC[C@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1cccc(C(F)(F)F)c1 ZINC000555241507 568412333 /nfs/dbraw/zinc/41/23/33/568412333.db2.gz BDLIXXNUGFIYGY-SFHVURJKSA-N 1 0 361.411 5.223 20 0 FKADRO Cn1ncc2ccc(C[NH2+][C@@H]3CCCc4c(Cl)sc(Cl)c43)cc21 ZINC000555241604 568412344 /nfs/dbraw/zinc/41/23/44/568412344.db2.gz RXIRPCPAGHBMGD-CYBMUJFWSA-N 1 0 366.317 5.109 20 0 FKADRO Cn1ncc2ccc(C[NH2+][C@H]3CCCc4c(Cl)sc(Cl)c43)cc21 ZINC000555241606 568412373 /nfs/dbraw/zinc/41/23/73/568412373.db2.gz RXIRPCPAGHBMGD-ZDUSSCGKSA-N 1 0 366.317 5.109 20 0 FKADRO c1nc(-c2ccncc2)sc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000555339731 568413041 /nfs/dbraw/zinc/41/30/41/568413041.db2.gz HEDVGMSFHAYMHO-ACDBMABISA-N 1 0 361.514 5.116 20 0 FKADRO FC(F)(F)[C@H]1CC[N@H+](Cc2cnc(-c3cccs3)s2)CC12CCC2 ZINC000555349511 568413392 /nfs/dbraw/zinc/41/33/92/568413392.db2.gz PNAPIOGBUJPFQQ-AWEZNQCLSA-N 1 0 372.481 5.426 20 0 FKADRO FC(F)(F)[C@@H]1CC[N@H+](Cc2cnc(-c3cccs3)s2)CC12CCC2 ZINC000555349512 568413337 /nfs/dbraw/zinc/41/33/37/568413337.db2.gz PNAPIOGBUJPFQQ-CQSZACIVSA-N 1 0 372.481 5.426 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccc(Br)cn1 ZINC000555379982 568413736 /nfs/dbraw/zinc/41/37/36/568413736.db2.gz KYCOJFAXPCOJON-AXAPSJFSSA-N 1 0 365.702 5.094 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccc(Br)cn1 ZINC000555379986 568413687 /nfs/dbraw/zinc/41/36/87/568413687.db2.gz KYCOJFAXPCOJON-RBOXIYTFSA-N 1 0 365.702 5.094 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@H](C)c3ccccc3OC(F)F)cc2)cs1 ZINC000555406922 568413759 /nfs/dbraw/zinc/41/37/59/568413759.db2.gz ZANQPWOPRGIIBS-CYBMUJFWSA-N 1 0 374.456 5.571 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+][C@@H](C)c3ccccc3OC(F)F)cc2)cs1 ZINC000555406923 568413709 /nfs/dbraw/zinc/41/37/09/568413709.db2.gz ZANQPWOPRGIIBS-ZDUSSCGKSA-N 1 0 374.456 5.571 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000555415857 568413994 /nfs/dbraw/zinc/41/39/94/568413994.db2.gz SHQOQCFHYBIAHO-LLVKDONJSA-N 1 0 363.288 5.074 20 0 FKADRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)C)nc2CC)cc1OC ZINC000555420752 568413900 /nfs/dbraw/zinc/41/39/00/568413900.db2.gz QNJXOPFCSVMEJY-INIZCTEOSA-N 1 0 356.510 5.026 20 0 FKADRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)C)nc2CC)cc1OC ZINC000555420755 568414010 /nfs/dbraw/zinc/41/40/10/568414010.db2.gz QNJXOPFCSVMEJY-MRXNPFEDSA-N 1 0 356.510 5.026 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000555420795 568413971 /nfs/dbraw/zinc/41/39/71/568413971.db2.gz NKRYONYZRKERHN-FDDCHVKYSA-N 1 0 352.522 5.025 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000555420796 568414007 /nfs/dbraw/zinc/41/40/07/568414007.db2.gz NKRYONYZRKERHN-JPYJTQIMSA-N 1 0 352.522 5.025 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000555420797 568413938 /nfs/dbraw/zinc/41/39/38/568413938.db2.gz NKRYONYZRKERHN-MBSDFSHPSA-N 1 0 352.522 5.025 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000555420798 568414017 /nfs/dbraw/zinc/41/40/17/568414017.db2.gz NKRYONYZRKERHN-WZONZLPQSA-N 1 0 352.522 5.025 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000555421279 568414027 /nfs/dbraw/zinc/41/40/27/568414027.db2.gz YESCBPYWIDFRJE-HNNXBMFYSA-N 1 0 370.855 5.304 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000555421280 568414068 /nfs/dbraw/zinc/41/40/68/568414068.db2.gz YESCBPYWIDFRJE-OAHLLOKOSA-N 1 0 370.855 5.304 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+]Cc3ccc(C(C)C)nc3C)c(C)c2c1 ZINC000555424544 568414081 /nfs/dbraw/zinc/41/40/81/568414081.db2.gz JDQVYDCWRKEOHR-MRXNPFEDSA-N 1 0 352.478 5.427 20 0 FKADRO Cc1nc2ccccc2n1C1CC[NH+](Cc2ccc(C(C)C)nc2C)CC1 ZINC000555461879 568414563 /nfs/dbraw/zinc/41/45/63/568414563.db2.gz BVRDDEUZINXKOR-UHFFFAOYSA-N 1 0 362.521 5.009 20 0 FKADRO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1ccc(C(C)C)nc1C ZINC000555462720 568414570 /nfs/dbraw/zinc/41/45/70/568414570.db2.gz NEHHWNCFGMNQJT-IBGZPJMESA-N 1 0 350.428 5.605 20 0 FKADRO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(C(C)C)nc1C ZINC000555462730 568414574 /nfs/dbraw/zinc/41/45/74/568414574.db2.gz NEHHWNCFGMNQJT-LJQANCHMSA-N 1 0 350.428 5.605 20 0 FKADRO COCC[C@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(Cl)c(Cl)c1 ZINC000555511096 568415239 /nfs/dbraw/zinc/41/52/39/568415239.db2.gz ZCIHVTHUTVXEMF-IBGZPJMESA-N 1 0 368.304 5.007 20 0 FKADRO COCC[C@@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(Cl)c(Cl)c1 ZINC000555511105 568415393 /nfs/dbraw/zinc/41/53/93/568415393.db2.gz ZCIHVTHUTVXEMF-LJQANCHMSA-N 1 0 368.304 5.007 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+]Cc3cc4ccc(F)cc4[nH]3)cc2)cs1 ZINC000555514635 568417496 /nfs/dbraw/zinc/41/74/96/568417496.db2.gz XXSYSRHQIJVMDK-UHFFFAOYSA-N 1 0 351.450 5.029 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@H+](C)Cc1cccc2ccccc21 ZINC000555515846 568418005 /nfs/dbraw/zinc/41/80/05/568418005.db2.gz IBJBYNRDELBORQ-UHFFFAOYSA-N 1 0 364.514 5.022 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000555523788 568411823 /nfs/dbraw/zinc/41/18/23/568411823.db2.gz BSSRLNFLRQWZGL-UHFFFAOYSA-N 1 0 371.937 5.148 20 0 FKADRO COc1ccc(Oc2cc(C[NH2+]Cc3cc(C)cc(Cl)c3)ccn2)cc1 ZINC000555524305 568412219 /nfs/dbraw/zinc/41/22/19/568412219.db2.gz OYALPDGNQDPRAE-UHFFFAOYSA-N 1 0 368.864 5.134 20 0 FKADRO Cc1c2cccc(Cl)c2sc1CN[C@H](C)c1nc(C(C)(C)C)no1 ZINC000555553321 568414342 /nfs/dbraw/zinc/41/43/42/568414342.db2.gz QPKIMMYPRUNZMZ-LLVKDONJSA-N 1 0 363.914 5.394 20 0 FKADRO Cc1c2cccc(Cl)c2sc1CN[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000555553327 568414293 /nfs/dbraw/zinc/41/42/93/568414293.db2.gz QPKIMMYPRUNZMZ-NSHDSACASA-N 1 0 363.914 5.394 20 0 FKADRO CSCc1cnc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000555564497 568419890 /nfs/dbraw/zinc/41/98/90/568419890.db2.gz OIHSGXVWEQUFHH-NEPJUHHUSA-N 1 0 374.497 5.307 20 0 FKADRO CSCc1cnc(C[NH2+][C@H](C)[C@H](C)c2ccccc2C(F)(F)F)s1 ZINC000555564500 568419864 /nfs/dbraw/zinc/41/98/64/568419864.db2.gz OIHSGXVWEQUFHH-NWDGAFQWSA-N 1 0 374.497 5.307 20 0 FKADRO CSCc1cnc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2C(F)(F)F)s1 ZINC000555564502 568419853 /nfs/dbraw/zinc/41/98/53/568419853.db2.gz OIHSGXVWEQUFHH-RYUDHWBXSA-N 1 0 374.497 5.307 20 0 FKADRO CSCc1cnc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000555564504 568419933 /nfs/dbraw/zinc/41/99/33/568419933.db2.gz OIHSGXVWEQUFHH-VXGBXAGGSA-N 1 0 374.497 5.307 20 0 FKADRO CCC[N@H+](Cc1cn2cccnc2n1)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000555574744 568420513 /nfs/dbraw/zinc/42/05/13/568420513.db2.gz RDRUPVHXUIXROL-CYBMUJFWSA-N 1 0 363.292 5.009 20 0 FKADRO CCC[N@H+](Cc1cn2cccnc2n1)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000555574745 568420331 /nfs/dbraw/zinc/42/03/31/568420331.db2.gz RDRUPVHXUIXROL-ZDUSSCGKSA-N 1 0 363.292 5.009 20 0 FKADRO COc1ccc2ccccc2c1-c1cc(C[NH2+]Cc2ccsc2C)on1 ZINC000555577630 568420874 /nfs/dbraw/zinc/42/08/74/568420874.db2.gz MAOONTQJKIPPCX-UHFFFAOYSA-N 1 0 364.470 5.163 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000555578022 568420863 /nfs/dbraw/zinc/42/08/63/568420863.db2.gz XRKWZVCEDGPNAW-JXFKEZNVSA-N 1 0 371.933 5.731 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000555578027 568420842 /nfs/dbraw/zinc/42/08/42/568420842.db2.gz XRKWZVCEDGPNAW-OXJNMPFZSA-N 1 0 371.933 5.731 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000555578028 568420812 /nfs/dbraw/zinc/42/08/12/568420812.db2.gz XRKWZVCEDGPNAW-OXQOHEQNSA-N 1 0 371.933 5.731 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000555578029 568420825 /nfs/dbraw/zinc/42/08/25/568420825.db2.gz XRKWZVCEDGPNAW-UZLBHIALSA-N 1 0 371.933 5.731 20 0 FKADRO Cc1nc(-c2ccc(C[NH2+]Cc3ccc4nc(C)sc4c3)cc2)cs1 ZINC000555582647 568421019 /nfs/dbraw/zinc/42/10/19/568421019.db2.gz IXRJMEUCWBZNAR-UHFFFAOYSA-N 1 0 365.527 5.326 20 0 FKADRO c1c2ccccc2sc1C[NH2+]Cc1ccc(OCc2ccncc2)cc1 ZINC000555590908 568421058 /nfs/dbraw/zinc/42/10/58/568421058.db2.gz NQSCSZRFSFKAAJ-UHFFFAOYSA-N 1 0 360.482 5.165 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1 ZINC000555592368 568421060 /nfs/dbraw/zinc/42/10/60/568421060.db2.gz PKFLLCCKZUGCDG-GOSISDBHSA-N 1 0 360.379 5.167 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1 ZINC000555592369 568421013 /nfs/dbraw/zinc/42/10/13/568421013.db2.gz PKFLLCCKZUGCDG-SFHVURJKSA-N 1 0 360.379 5.167 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)ccc21)c1ccc(-n2cccn2)c(F)c1 ZINC000555597659 568421238 /nfs/dbraw/zinc/42/12/38/568421238.db2.gz LISQDUQCGXXZSO-BFUOFWGJSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1ccc(-n2cccn2)c(F)c1 ZINC000555597663 568421206 /nfs/dbraw/zinc/42/12/06/568421206.db2.gz LISQDUQCGXXZSO-YJYMSZOUSA-N 1 0 355.844 5.003 20 0 FKADRO CCn1nc(C)c(C[NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)c1C ZINC000555600016 568421174 /nfs/dbraw/zinc/42/11/74/568421174.db2.gz PYWJPBOYCPXEBY-IBGZPJMESA-N 1 0 373.953 5.308 20 0 FKADRO CCn1nc(C)c(C[NH2+][C@H](Cc2ccccc2Cl)c2cccs2)c1C ZINC000555600019 568421233 /nfs/dbraw/zinc/42/12/33/568421233.db2.gz PYWJPBOYCPXEBY-LJQANCHMSA-N 1 0 373.953 5.308 20 0 FKADRO C[C@H]([NH2+][C@H]1CCCc2sc(Cl)cc21)c1ccc2c(c1)CCC(=O)N2 ZINC000555607851 568421223 /nfs/dbraw/zinc/42/12/23/568421223.db2.gz KQXZGRMJVUPAHY-ZBEGNZNMSA-N 1 0 360.910 5.014 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(-c2cccc(Cl)c2Cl)o1)c1cc[nH]c(=O)c1 ZINC000555608668 568421225 /nfs/dbraw/zinc/42/12/25/568421225.db2.gz ZYEQKARZFOHORA-LLVKDONJSA-N 1 0 363.244 5.205 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(-c2cccc(Cl)c2Cl)o1)c1cc[nH]c(=O)c1 ZINC000555608669 568421213 /nfs/dbraw/zinc/42/12/13/568421213.db2.gz ZYEQKARZFOHORA-NSHDSACASA-N 1 0 363.244 5.205 20 0 FKADRO C[C@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000555625691 568421760 /nfs/dbraw/zinc/42/17/60/568421760.db2.gz HKJZMLDTHNTFQR-DJJJIMSYSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000555625692 568421720 /nfs/dbraw/zinc/42/17/20/568421720.db2.gz HKJZMLDTHNTFQR-ORAYPTAESA-N 1 0 355.844 5.003 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1Cl ZINC000555626407 568421928 /nfs/dbraw/zinc/42/19/28/568421928.db2.gz QSLXDGZGPADYQW-KBPBESRZSA-N 1 0 373.859 5.085 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1Cl ZINC000555626408 568421862 /nfs/dbraw/zinc/42/18/62/568421862.db2.gz QSLXDGZGPADYQW-KGLIPLIRSA-N 1 0 373.859 5.085 20 0 FKADRO C[C@H]([NH2+][C@H]1CCc2ccc(Cl)cc21)c1ccc(-n2cccn2)c(F)c1 ZINC000555626838 568421892 /nfs/dbraw/zinc/42/18/92/568421892.db2.gz XLLDIQMKNJCSRR-DJJJIMSYSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCc2ccc(Cl)cc21)c1ccc(-n2cccn2)c(F)c1 ZINC000555626839 568421932 /nfs/dbraw/zinc/42/19/32/568421932.db2.gz XLLDIQMKNJCSRR-ORAYPTAESA-N 1 0 355.844 5.003 20 0 FKADRO Cc1sc(C2([NH2+]Cc3ccccc3)CCC2)nc1-c1ccccc1F ZINC000555646311 568422042 /nfs/dbraw/zinc/42/20/42/568422042.db2.gz TYFBMFKLZAVXFI-UHFFFAOYSA-N 1 0 352.478 5.427 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+]Cc2cccc3c(Br)cccc23)cn1 ZINC000555662569 568422179 /nfs/dbraw/zinc/42/21/79/568422179.db2.gz LGYVVHZXVQXWQE-AWEZNQCLSA-N 1 0 372.310 5.231 20 0 FKADRO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000555707565 568423403 /nfs/dbraw/zinc/42/34/03/568423403.db2.gz HFIRPVVXNUQIGE-DLBZAZTESA-N 1 0 351.519 5.396 20 0 FKADRO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000555707566 568423413 /nfs/dbraw/zinc/42/34/13/568423413.db2.gz HFIRPVVXNUQIGE-IAGOWNOFSA-N 1 0 351.519 5.396 20 0 FKADRO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000555707567 568423450 /nfs/dbraw/zinc/42/34/50/568423450.db2.gz HFIRPVVXNUQIGE-IRXDYDNUSA-N 1 0 351.519 5.396 20 0 FKADRO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000555707568 568423385 /nfs/dbraw/zinc/42/33/85/568423385.db2.gz HFIRPVVXNUQIGE-SJORKVTESA-N 1 0 351.519 5.396 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3c(Cl)cccc3Cl)o2)[C@@H]2CCC[C@H]21 ZINC000555721769 568423442 /nfs/dbraw/zinc/42/34/42/568423442.db2.gz VYDGUADSHNMJDN-BXUZGUMPSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3c(Cl)cccc3Cl)o2)[C@H]2CCC[C@@H]21 ZINC000555721771 568423436 /nfs/dbraw/zinc/42/34/36/568423436.db2.gz VYDGUADSHNMJDN-FZMZJTMJSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3c(Cl)cccc3Cl)o2)[C@H]2CCC[C@H]21 ZINC000555721772 568423467 /nfs/dbraw/zinc/42/34/67/568423467.db2.gz VYDGUADSHNMJDN-RISCZKNCSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3c(Cl)cccc3Cl)o2)[C@@H]2CCC[C@@H]21 ZINC000555721773 568423371 /nfs/dbraw/zinc/42/33/71/568423371.db2.gz VYDGUADSHNMJDN-SMDDNHRTSA-N 1 0 366.292 5.054 20 0 FKADRO Cc1sc(C2([NH2+]CCC(F)(F)F)CCC2)nc1-c1ccccc1F ZINC000555773491 568424151 /nfs/dbraw/zinc/42/41/51/568424151.db2.gz XTJUCBPSTQCLNH-UHFFFAOYSA-N 1 0 358.404 5.179 20 0 FKADRO Cc1sc(C2([NH2+][C@@H]3C[C@@H](C)O[C@@H](C)C3)CCC2)nc1-c1ccccc1F ZINC000555774538 568424160 /nfs/dbraw/zinc/42/41/60/568424160.db2.gz BARJABQOZZJNIX-MIFYACCESA-N 1 0 374.525 5.182 20 0 FKADRO C[NH+](C)[C@H]1CCOc2c(NCc3cnc(C4CCCCC4)s3)cccc21 ZINC000555789605 568424350 /nfs/dbraw/zinc/42/43/50/568424350.db2.gz UWTUISDWGINQKU-IBGZPJMESA-N 1 0 371.550 5.188 20 0 FKADRO C[NH+](C)[C@@H]1CCOc2c(NCc3cnc(C4CCCCC4)s3)cccc21 ZINC000555789606 568424386 /nfs/dbraw/zinc/42/43/86/568424386.db2.gz UWTUISDWGINQKU-LJQANCHMSA-N 1 0 371.550 5.188 20 0 FKADRO COc1cccc2c1CCC[C@@H]2[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000555948206 568426703 /nfs/dbraw/zinc/42/67/03/568426703.db2.gz BKXXARAILUROCG-HNNXBMFYSA-N 1 0 358.894 5.126 20 0 FKADRO COc1cccc2c1CCC[C@H]2[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000555948207 568426671 /nfs/dbraw/zinc/42/66/71/568426671.db2.gz BKXXARAILUROCG-OAHLLOKOSA-N 1 0 358.894 5.126 20 0 FKADRO COc1cccc2c1CCC[C@@H]2[NH2+]Cc1cccc(COC(C)(C)C)c1 ZINC000555948285 568426698 /nfs/dbraw/zinc/42/66/98/568426698.db2.gz LPKRJBKHTJMIPZ-NRFANRHFSA-N 1 0 353.506 5.178 20 0 FKADRO COc1cccc2c1CCC[C@H]2[NH2+]Cc1cccc(COC(C)(C)C)c1 ZINC000555948286 568426685 /nfs/dbraw/zinc/42/66/85/568426685.db2.gz LPKRJBKHTJMIPZ-OAQYLSRUSA-N 1 0 353.506 5.178 20 0 FKADRO CSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1sccc1Br ZINC000555951375 568426683 /nfs/dbraw/zinc/42/66/83/568426683.db2.gz DKXNJEFHXGDMCP-QWRGUYRKSA-N 1 0 356.354 5.644 20 0 FKADRO CSc1ccccc1[C@H](C)[NH2+][C@H](C)c1sccc1Br ZINC000555951376 568426725 /nfs/dbraw/zinc/42/67/25/568426725.db2.gz DKXNJEFHXGDMCP-WDEREUQCSA-N 1 0 356.354 5.644 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)c1 ZINC000556051643 568427716 /nfs/dbraw/zinc/42/77/16/568427716.db2.gz VCGQJWVYJXYVEV-CABCVRRESA-N 1 0 350.437 5.349 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)c1 ZINC000556051646 568427713 /nfs/dbraw/zinc/42/77/13/568427713.db2.gz VCGQJWVYJXYVEV-GJZGRUSLSA-N 1 0 350.437 5.349 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)c1 ZINC000556051648 568427692 /nfs/dbraw/zinc/42/76/92/568427692.db2.gz VCGQJWVYJXYVEV-HUUCEWRRSA-N 1 0 350.437 5.349 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)c1 ZINC000556051650 568427649 /nfs/dbraw/zinc/42/76/49/568427649.db2.gz VCGQJWVYJXYVEV-LSDHHAIUSA-N 1 0 350.437 5.349 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(F)c2ccccc21 ZINC000556052106 568427709 /nfs/dbraw/zinc/42/77/09/568427709.db2.gz CANOCYKBXJUOJS-BXKMTCNYSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(F)c2ccccc21 ZINC000556052107 568427720 /nfs/dbraw/zinc/42/77/20/568427720.db2.gz CANOCYKBXJUOJS-MZNJEOGPSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(F)c2ccccc21 ZINC000556052108 568427670 /nfs/dbraw/zinc/42/76/70/568427670.db2.gz CANOCYKBXJUOJS-OSPHWJPCSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(F)c2ccccc21 ZINC000556052110 568427730 /nfs/dbraw/zinc/42/77/30/568427730.db2.gz CANOCYKBXJUOJS-XDHUDOTRSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(Cn2ccnc2)c1)c1ccc(F)c2ccccc21 ZINC000556054676 568427641 /nfs/dbraw/zinc/42/76/41/568427641.db2.gz GVSNYSBXHJVMSS-QGZVFWFLSA-N 1 0 359.448 5.075 20 0 FKADRO Clc1cccc([C@H]([NH2+]Cc2cnc3ccccc3c2)c2ccccc2)c1 ZINC000556055661 568427734 /nfs/dbraw/zinc/42/77/34/568427734.db2.gz WIPSRAHNMRKIHF-HSZRJFAPSA-N 1 0 358.872 5.767 20 0 FKADRO Clc1cccc([C@@H]([NH2+]Cc2cnc3ccccc3c2)c2ccccc2)c1 ZINC000556055662 568427705 /nfs/dbraw/zinc/42/77/05/568427705.db2.gz WIPSRAHNMRKIHF-QHCPKHFHSA-N 1 0 358.872 5.767 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000556057751 568427726 /nfs/dbraw/zinc/42/77/26/568427726.db2.gz VRHVNORKIDLCNI-CABCVRRESA-N 1 0 353.437 5.408 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000556057752 568427724 /nfs/dbraw/zinc/42/77/24/568427724.db2.gz VRHVNORKIDLCNI-GJZGRUSLSA-N 1 0 353.437 5.408 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000556057753 568427722 /nfs/dbraw/zinc/42/77/22/568427722.db2.gz VRHVNORKIDLCNI-HUUCEWRRSA-N 1 0 353.437 5.408 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000556057754 568427698 /nfs/dbraw/zinc/42/76/98/568427698.db2.gz VRHVNORKIDLCNI-LSDHHAIUSA-N 1 0 353.437 5.408 20 0 FKADRO CC(C)Oc1ccccc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000556058776 568427676 /nfs/dbraw/zinc/42/76/76/568427676.db2.gz OTUOWUDKJDLYGD-AWEZNQCLSA-N 1 0 366.324 5.075 20 0 FKADRO CC(C)Oc1ccccc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000556058780 568427658 /nfs/dbraw/zinc/42/76/58/568427658.db2.gz OTUOWUDKJDLYGD-CQSZACIVSA-N 1 0 366.324 5.075 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Oc2cccnc2)c(F)c1)c1cccc(C2CC2)c1 ZINC000556058886 568427835 /nfs/dbraw/zinc/42/78/35/568427835.db2.gz GSNIENDNZJAUMX-INIZCTEOSA-N 1 0 362.448 5.741 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Oc2cccnc2)c(F)c1)c1cccc(C2CC2)c1 ZINC000556058887 568427831 /nfs/dbraw/zinc/42/78/31/568427831.db2.gz GSNIENDNZJAUMX-MRXNPFEDSA-N 1 0 362.448 5.741 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)c1cccc(C2CC2)c1 ZINC000556058892 568427823 /nfs/dbraw/zinc/42/78/23/568427823.db2.gz GVCLZQSHFXHFAV-KRWDZBQOSA-N 1 0 371.484 5.062 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)c1cccc(C2CC2)c1 ZINC000556058893 568427857 /nfs/dbraw/zinc/42/78/57/568427857.db2.gz GVCLZQSHFXHFAV-QGZVFWFLSA-N 1 0 371.484 5.062 20 0 FKADRO CC(C)CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)c1 ZINC000556059363 568427819 /nfs/dbraw/zinc/42/78/19/568427819.db2.gz YLFYUPCVQDBRPR-KRWDZBQOSA-N 1 0 350.506 5.399 20 0 FKADRO CC(C)CC(=O)Nc1cccc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)c1 ZINC000556059364 568427827 /nfs/dbraw/zinc/42/78/27/568427827.db2.gz YLFYUPCVQDBRPR-QGZVFWFLSA-N 1 0 350.506 5.399 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(OCc2ccccn2)c1)c1cccc(C2CC2)c1 ZINC000556059647 568427838 /nfs/dbraw/zinc/42/78/38/568427838.db2.gz UYDJHTMBDKBSRB-GOSISDBHSA-N 1 0 358.485 5.389 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(OCc2ccccn2)c1)c1cccc(C2CC2)c1 ZINC000556059648 568427798 /nfs/dbraw/zinc/42/77/98/568427798.db2.gz UYDJHTMBDKBSRB-SFHVURJKSA-N 1 0 358.485 5.389 20 0 FKADRO CC[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C(=O)OC)cc1 ZINC000556060714 568427852 /nfs/dbraw/zinc/42/78/52/568427852.db2.gz LKLPNWYFHPBQRI-MSOLQXFVSA-N 1 0 365.395 5.208 20 0 FKADRO CC[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccc(C(=O)OC)cc1 ZINC000556060720 568427801 /nfs/dbraw/zinc/42/78/01/568427801.db2.gz LKLPNWYFHPBQRI-QZTJIDSGSA-N 1 0 365.395 5.208 20 0 FKADRO CC[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C(=O)OC)cc1 ZINC000556060722 568427810 /nfs/dbraw/zinc/42/78/10/568427810.db2.gz LKLPNWYFHPBQRI-ROUUACIJSA-N 1 0 365.395 5.208 20 0 FKADRO CC[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccc(C(=O)OC)cc1 ZINC000556060723 568427859 /nfs/dbraw/zinc/42/78/59/568427859.db2.gz LKLPNWYFHPBQRI-ZWKOTPCHSA-N 1 0 365.395 5.208 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2)c1)c1cccc(C2CC2)c1 ZINC000556061076 568427803 /nfs/dbraw/zinc/42/78/03/568427803.db2.gz RNRUQDKLTWNYMZ-GOSISDBHSA-N 1 0 370.496 5.667 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2)c1)c1cccc(C2CC2)c1 ZINC000556061077 568427840 /nfs/dbraw/zinc/42/78/40/568427840.db2.gz RNRUQDKLTWNYMZ-SFHVURJKSA-N 1 0 370.496 5.667 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc(F)c2ccccc21 ZINC000556061188 568427796 /nfs/dbraw/zinc/42/77/96/568427796.db2.gz TUUINBOJTFBJIV-KRWDZBQOSA-N 1 0 363.480 5.215 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc(F)c2ccccc21 ZINC000556061189 568427815 /nfs/dbraw/zinc/42/78/15/568427815.db2.gz TUUINBOJTFBJIV-QGZVFWFLSA-N 1 0 363.480 5.215 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccc(Br)cc1)C1CCC1)c1ccncc1F ZINC000556062127 568427862 /nfs/dbraw/zinc/42/78/62/568427862.db2.gz MQYJYLHOUMCBJZ-KZULUSFZSA-N 1 0 363.274 5.175 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccc(Br)cc1)C1CCC1)c1ccncc1F ZINC000556062128 568427854 /nfs/dbraw/zinc/42/78/54/568427854.db2.gz MQYJYLHOUMCBJZ-SGTLLEGYSA-N 1 0 363.274 5.175 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccc(Br)cc1)C1CCC1)c1ccncc1F ZINC000556062129 568427805 /nfs/dbraw/zinc/42/78/05/568427805.db2.gz MQYJYLHOUMCBJZ-XIKOKIGWSA-N 1 0 363.274 5.175 20 0 FKADRO CC(C)C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cccc(C(F)(F)F)c1 ZINC000556067790 568427937 /nfs/dbraw/zinc/42/79/37/568427937.db2.gz ICPYLOCNZPNLRS-GOSISDBHSA-N 1 0 361.411 5.459 20 0 FKADRO CC(C)C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cccc(C(F)(F)F)c1 ZINC000556067791 568427962 /nfs/dbraw/zinc/42/79/62/568427962.db2.gz ICPYLOCNZPNLRS-SFHVURJKSA-N 1 0 361.411 5.459 20 0 FKADRO CC[C@H]([NH2+]Cc1cccc(COC(C)(C)C)c1)c1ccc(C(=O)OC)cc1 ZINC000556076511 568428327 /nfs/dbraw/zinc/42/83/27/568428327.db2.gz OQUXAJYPYMCDTK-NRFANRHFSA-N 1 0 369.505 5.029 20 0 FKADRO CC[C@@H]([NH2+]Cc1cccc(COC(C)(C)C)c1)c1ccc(C(=O)OC)cc1 ZINC000556076512 568428311 /nfs/dbraw/zinc/42/83/11/568428311.db2.gz OQUXAJYPYMCDTK-OAQYLSRUSA-N 1 0 369.505 5.029 20 0 FKADRO CSc1ccc(F)cc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000556077779 568428277 /nfs/dbraw/zinc/42/82/77/568428277.db2.gz KSJMQJHCZSETDM-GFCCVEGCSA-N 1 0 372.328 5.149 20 0 FKADRO CSc1ccc(F)cc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000556077780 568428256 /nfs/dbraw/zinc/42/82/56/568428256.db2.gz KSJMQJHCZSETDM-LBPRGKRZSA-N 1 0 372.328 5.149 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000556078439 568428296 /nfs/dbraw/zinc/42/82/96/568428296.db2.gz LYRJHWBOFWNEHB-OALUTQOASA-N 1 0 360.501 5.635 20 0 FKADRO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000556078443 568428324 /nfs/dbraw/zinc/42/83/24/568428324.db2.gz LYRJHWBOFWNEHB-RBUKOAKNSA-N 1 0 360.501 5.635 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(F)c2ccccc21 ZINC000556118376 568428992 /nfs/dbraw/zinc/42/89/92/568428992.db2.gz BZAIMHKMQYXYRA-AYNSBQOLSA-N 1 0 355.478 5.128 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(F)c2ccccc21 ZINC000556118385 568428964 /nfs/dbraw/zinc/42/89/64/568428964.db2.gz BZAIMHKMQYXYRA-SKHRDNQBSA-N 1 0 355.478 5.128 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1ccc([S@](C)=O)cc1 ZINC000556118388 568428997 /nfs/dbraw/zinc/42/89/97/568428997.db2.gz BZAIMHKMQYXYRA-XHQUFGICSA-N 1 0 355.478 5.128 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1ccc([S@@](C)=O)cc1 ZINC000556118390 568429016 /nfs/dbraw/zinc/42/90/16/568429016.db2.gz BZAIMHKMQYXYRA-XSKAOVLVSA-N 1 0 355.478 5.128 20 0 FKADRO CN1CC[C@H]([NH2+]C(c2cccs2)c2cccs2)C[C@H]1c1ccccc1 ZINC000556118721 568429073 /nfs/dbraw/zinc/42/90/73/568429073.db2.gz ITCWJMOTZSOWOL-ROUUACIJSA-N 1 0 368.571 5.324 20 0 FKADRO CN1CC[C@H]([NH2+]C(c2cccs2)c2cccs2)C[C@@H]1c1ccccc1 ZINC000556118722 568428980 /nfs/dbraw/zinc/42/89/80/568428980.db2.gz ITCWJMOTZSOWOL-ZWKOTPCHSA-N 1 0 368.571 5.324 20 0 FKADRO CC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc(F)c3ccccc32)c2ccccc21 ZINC000556120777 568428966 /nfs/dbraw/zinc/42/89/66/568428966.db2.gz ZBACGYFOMQXHGR-IVZQSRNASA-N 1 0 362.448 5.127 20 0 FKADRO CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c3ccccc32)c2ccccc21 ZINC000556120778 568429032 /nfs/dbraw/zinc/42/90/32/568429032.db2.gz ZBACGYFOMQXHGR-NYHFZMIOSA-N 1 0 362.448 5.127 20 0 FKADRO CC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc(F)c3ccccc32)c2ccccc21 ZINC000556120779 568428961 /nfs/dbraw/zinc/42/89/61/568428961.db2.gz ZBACGYFOMQXHGR-OYHNWAKOSA-N 1 0 362.448 5.127 20 0 FKADRO CC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(F)c3ccccc32)c2ccccc21 ZINC000556120780 568428957 /nfs/dbraw/zinc/42/89/57/568428957.db2.gz ZBACGYFOMQXHGR-QRQCRPRQSA-N 1 0 362.448 5.127 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)c1ccncc1F ZINC000556160332 568425122 /nfs/dbraw/zinc/42/51/22/568425122.db2.gz VZAPNVBCSHXHRW-ULFGMLNVSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccncc1F ZINC000556160333 568425017 /nfs/dbraw/zinc/42/50/17/568425017.db2.gz VZAPNVBCSHXHRW-XZOAIXRZSA-N 1 0 352.375 5.226 20 0 FKADRO COCc1nc(C[NH2+][C@@H]2CCCC23CCCC3)c(-c2ccccc2)s1 ZINC000556177565 568425875 /nfs/dbraw/zinc/42/58/75/568425875.db2.gz BOAPZEBVHKUUQG-GOSISDBHSA-N 1 0 356.535 5.159 20 0 FKADRO COCc1nc(C[NH2+][C@H]2CCCC23CCCC3)c(-c2ccccc2)s1 ZINC000556177566 568425796 /nfs/dbraw/zinc/42/57/96/568425796.db2.gz BOAPZEBVHKUUQG-SFHVURJKSA-N 1 0 356.535 5.159 20 0 FKADRO CN1CC[C@@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)C[C@H]1c1ccccc1 ZINC000556177574 568425778 /nfs/dbraw/zinc/42/57/78/568425778.db2.gz BWHBTRWTBGEIJU-AEAFLJPSSA-N 1 0 372.915 5.092 20 0 FKADRO CN1CC[C@@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)C[C@@H]1c1ccccc1 ZINC000556177575 568425802 /nfs/dbraw/zinc/42/58/02/568425802.db2.gz BWHBTRWTBGEIJU-BJTVZRGDSA-N 1 0 372.915 5.092 20 0 FKADRO CN1CC[C@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)C[C@H]1c1ccccc1 ZINC000556177576 568425837 /nfs/dbraw/zinc/42/58/37/568425837.db2.gz BWHBTRWTBGEIJU-NUTQKKSESA-N 1 0 372.915 5.092 20 0 FKADRO CN1CC[C@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)C[C@@H]1c1ccccc1 ZINC000556177577 568426018 /nfs/dbraw/zinc/42/60/18/568426018.db2.gz BWHBTRWTBGEIJU-XZFTYKLISA-N 1 0 372.915 5.092 20 0 FKADRO CSCc1cccc(C[NH2+][C@H]2CCc3sc(Br)cc32)c1 ZINC000556177717 568426044 /nfs/dbraw/zinc/42/60/44/568426044.db2.gz IJPYKJIRUGETSJ-AWEZNQCLSA-N 1 0 368.365 5.151 20 0 FKADRO CSCc1cccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)c1 ZINC000556177718 568425998 /nfs/dbraw/zinc/42/59/98/568425998.db2.gz IJPYKJIRUGETSJ-CQSZACIVSA-N 1 0 368.365 5.151 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000556178037 568425975 /nfs/dbraw/zinc/42/59/75/568425975.db2.gz UBKBRYBKPHHQDU-CABCVRRESA-N 1 0 353.485 5.651 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000556178049 568426304 /nfs/dbraw/zinc/42/63/04/568426304.db2.gz UBKBRYBKPHHQDU-GJZGRUSLSA-N 1 0 353.485 5.651 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000556178050 568426302 /nfs/dbraw/zinc/42/63/02/568426302.db2.gz UBKBRYBKPHHQDU-HUUCEWRRSA-N 1 0 353.485 5.651 20 0 FKADRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000556178051 568426306 /nfs/dbraw/zinc/42/63/06/568426306.db2.gz UBKBRYBKPHHQDU-LSDHHAIUSA-N 1 0 353.485 5.651 20 0 FKADRO C[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(F)c2ccccc21 ZINC000556178239 568426277 /nfs/dbraw/zinc/42/62/77/568426277.db2.gz FHNKTKCMBRNJSC-KRWDZBQOSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(F)c2ccccc21 ZINC000556178241 568426313 /nfs/dbraw/zinc/42/63/13/568426313.db2.gz FHNKTKCMBRNJSC-QGZVFWFLSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@H]([NH2+]Cc1ccnc(Oc2ccccc2F)c1)c1cccc(C2CC2)c1 ZINC000556178929 568426405 /nfs/dbraw/zinc/42/64/05/568426405.db2.gz PQSSXXOADYBBJG-INIZCTEOSA-N 1 0 362.448 5.741 20 0 FKADRO C[C@@H]([NH2+]Cc1ccnc(Oc2ccccc2F)c1)c1cccc(C2CC2)c1 ZINC000556178930 568426390 /nfs/dbraw/zinc/42/63/90/568426390.db2.gz PQSSXXOADYBBJG-MRXNPFEDSA-N 1 0 362.448 5.741 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cc2cccc(F)c2o1)c1ccc(C(=O)OC)cc1 ZINC000556179265 568426592 /nfs/dbraw/zinc/42/65/92/568426592.db2.gz PPGIXMBLFBKJBB-ACJLOTCBSA-N 1 0 355.409 5.160 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1cc2cccc(F)c2o1)c1ccc(C(=O)OC)cc1 ZINC000556179266 568426564 /nfs/dbraw/zinc/42/65/64/568426564.db2.gz PPGIXMBLFBKJBB-FZKQIMNGSA-N 1 0 355.409 5.160 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cc2cccc(F)c2o1)c1ccc(C(=O)OC)cc1 ZINC000556179267 568426527 /nfs/dbraw/zinc/42/65/27/568426527.db2.gz PPGIXMBLFBKJBB-SCLBCKFNSA-N 1 0 355.409 5.160 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1cc2cccc(F)c2o1)c1ccc(C(=O)OC)cc1 ZINC000556179268 568426543 /nfs/dbraw/zinc/42/65/43/568426543.db2.gz PPGIXMBLFBKJBB-UGSOOPFHSA-N 1 0 355.409 5.160 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C[C@H]1c1ccccc1 ZINC000556179674 568426560 /nfs/dbraw/zinc/42/65/60/568426560.db2.gz VSTPISYHMRDCLW-QESAQDPVSA-N 1 0 354.925 5.011 20 0 FKADRO CN1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C[C@@H]1c1ccccc1 ZINC000556179675 568426507 /nfs/dbraw/zinc/42/65/07/568426507.db2.gz VSTPISYHMRDCLW-ZHHKINOHSA-N 1 0 354.925 5.011 20 0 FKADRO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc(N2CCCC2)n1 ZINC000556196057 568428612 /nfs/dbraw/zinc/42/86/12/568428612.db2.gz PQGHOLNHRVVEOE-KRWDZBQOSA-N 1 0 363.480 5.133 20 0 FKADRO Cc1cc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc(N2CCCC2)n1 ZINC000556196058 568428622 /nfs/dbraw/zinc/42/86/22/568428622.db2.gz PQGHOLNHRVVEOE-QGZVFWFLSA-N 1 0 363.480 5.133 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H]3CCc4sc(Br)cc43)ccc2[nH]1 ZINC000556196117 568428617 /nfs/dbraw/zinc/42/86/17/568428617.db2.gz RVIABSBLWMXXQO-OAHLLOKOSA-N 1 0 361.308 5.077 20 0 FKADRO Clc1cccc([C@@H](Cc2cccnc2)[NH2+]Cc2coc3ccccc23)c1 ZINC000556198584 568423423 /nfs/dbraw/zinc/42/34/23/568423423.db2.gz VRFIWJDMRPHIQY-OAQYLSRUSA-N 1 0 362.860 5.555 20 0 FKADRO Fc1ccc([C@H]2C[C@H]([NH2+][C@H](c3cccnc3)c3ccc(F)cc3F)C2)cc1 ZINC000556202985 568440049 /nfs/dbraw/zinc/44/00/49/568440049.db2.gz FFEXBLIJSXLUNY-ZWDAVXSWSA-N 1 0 368.402 5.124 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000556203200 568440042 /nfs/dbraw/zinc/44/00/42/568440042.db2.gz HVAYLNOSLPSUJR-QRFRQXIXSA-N 1 0 368.496 5.202 20 0 FKADRO CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000556203206 568440088 /nfs/dbraw/zinc/44/00/88/568440088.db2.gz HVAYLNOSLPSUJR-YVWKXTFCSA-N 1 0 368.496 5.202 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000556214398 568440212 /nfs/dbraw/zinc/44/02/12/568440212.db2.gz ANPCZRLHYKDTGN-JXFKEZNVSA-N 1 0 363.423 5.195 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000556214402 568440193 /nfs/dbraw/zinc/44/01/93/568440193.db2.gz ANPCZRLHYKDTGN-OXJNMPFZSA-N 1 0 363.423 5.195 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000556214405 568440184 /nfs/dbraw/zinc/44/01/84/568440184.db2.gz ANPCZRLHYKDTGN-OXQOHEQNSA-N 1 0 363.423 5.195 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000556214406 568440197 /nfs/dbraw/zinc/44/01/97/568440197.db2.gz ANPCZRLHYKDTGN-UZLBHIALSA-N 1 0 363.423 5.195 20 0 FKADRO C[C@H]([NH2+]CC[C@@H](c1ccccc1)C(F)(F)F)c1cnn(C2CCCC2)c1 ZINC000556215761 568440207 /nfs/dbraw/zinc/44/02/07/568440207.db2.gz GIPBOCWBSDUMDY-KXBFYZLASA-N 1 0 365.443 5.385 20 0 FKADRO Clc1ccc([C@H](Cc2cccnc2)[NH2+]Cc2coc3ccccc23)cc1 ZINC000556216521 568429712 /nfs/dbraw/zinc/42/97/12/568429712.db2.gz IEVGRGPAZDNBIY-NRFANRHFSA-N 1 0 362.860 5.555 20 0 FKADRO Clc1ccc([C@@H](Cc2cccnc2)[NH2+]Cc2coc3ccccc23)cc1 ZINC000556216524 568429739 /nfs/dbraw/zinc/42/97/39/568429739.db2.gz IEVGRGPAZDNBIY-OAQYLSRUSA-N 1 0 362.860 5.555 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(-c2ccncc2)cc1 ZINC000556217484 568429786 /nfs/dbraw/zinc/42/97/86/568429786.db2.gz LWGVYURBXVIYRG-HNNXBMFYSA-N 1 0 371.406 5.056 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccc(-c2ccncc2)cc1 ZINC000556217491 568429726 /nfs/dbraw/zinc/42/97/26/568429726.db2.gz LWGVYURBXVIYRG-OAHLLOKOSA-N 1 0 371.406 5.056 20 0 FKADRO CC(C)c1nc([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cs1 ZINC000556217734 568429657 /nfs/dbraw/zinc/42/96/57/568429657.db2.gz OWKONRKUTPFVIE-DZGCQCFKSA-N 1 0 356.457 5.653 20 0 FKADRO CC(C)c1nc([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cs1 ZINC000556217741 568429795 /nfs/dbraw/zinc/42/97/95/568429795.db2.gz OWKONRKUTPFVIE-HIFRSBDPSA-N 1 0 356.457 5.653 20 0 FKADRO CC(C)c1nc([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cs1 ZINC000556217743 568429803 /nfs/dbraw/zinc/42/98/03/568429803.db2.gz OWKONRKUTPFVIE-UKRRQHHQSA-N 1 0 356.457 5.653 20 0 FKADRO CC(C)c1nc([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cs1 ZINC000556217745 568429678 /nfs/dbraw/zinc/42/96/78/568429678.db2.gz OWKONRKUTPFVIE-ZFWWWQNUSA-N 1 0 356.457 5.653 20 0 FKADRO COc1ccc([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1F ZINC000556218168 568429784 /nfs/dbraw/zinc/42/97/84/568429784.db2.gz RNHBGBYCWGOJNT-BBRMVZONSA-N 1 0 355.375 5.221 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1F ZINC000556218173 568429820 /nfs/dbraw/zinc/42/98/20/568429820.db2.gz RNHBGBYCWGOJNT-CJNGLKHVSA-N 1 0 355.375 5.221 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1F ZINC000556218174 568429818 /nfs/dbraw/zinc/42/98/18/568429818.db2.gz RNHBGBYCWGOJNT-CZUORRHYSA-N 1 0 355.375 5.221 20 0 FKADRO COc1ccc([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1F ZINC000556218175 568429770 /nfs/dbraw/zinc/42/97/70/568429770.db2.gz RNHBGBYCWGOJNT-XJKSGUPXSA-N 1 0 355.375 5.221 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2coc3ccccc23)c(Br)c1 ZINC000556218326 568429805 /nfs/dbraw/zinc/42/98/05/568429805.db2.gz RFYLEVMARNBOGQ-LBPRGKRZSA-N 1 0 360.251 5.055 20 0 FKADRO Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2cc3ccccc3s2)c(C)c1 ZINC000556218427 568429743 /nfs/dbraw/zinc/42/97/43/568429743.db2.gz UIIKNGKUUSBDKP-INIZCTEOSA-N 1 0 352.503 5.025 20 0 FKADRO Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2cc3ccccc3s2)c(C)c1 ZINC000556218429 568429773 /nfs/dbraw/zinc/42/97/73/568429773.db2.gz UIIKNGKUUSBDKP-MRXNPFEDSA-N 1 0 352.503 5.025 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC000556218568 568429967 /nfs/dbraw/zinc/42/99/67/568429967.db2.gz ZMTNAFLXXOSZDZ-GOSISDBHSA-N 1 0 355.444 5.052 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC000556218569 568429878 /nfs/dbraw/zinc/42/98/78/568429878.db2.gz ZMTNAFLXXOSZDZ-SFHVURJKSA-N 1 0 355.444 5.052 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1cc2ccccc2s1 ZINC000556218586 568429847 /nfs/dbraw/zinc/42/98/47/568429847.db2.gz VTJGWCKVIBBNNN-GFCCVEGCSA-N 1 0 350.409 5.208 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1cc2ccccc2s1 ZINC000556218587 568429887 /nfs/dbraw/zinc/42/98/87/568429887.db2.gz VTJGWCKVIBBNNN-LBPRGKRZSA-N 1 0 350.409 5.208 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1)c1cc(F)ccc1F ZINC000556221731 568429921 /nfs/dbraw/zinc/42/99/21/568429921.db2.gz FMTDJRLPWDFPCZ-BFUOFWGJSA-N 1 0 359.395 5.092 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1)c1cc(F)ccc1F ZINC000556221737 568429917 /nfs/dbraw/zinc/42/99/17/568429917.db2.gz FMTDJRLPWDFPCZ-YJYMSZOUSA-N 1 0 359.395 5.092 20 0 FKADRO C[C@@H]([NH2+][C@@H]1C[C@H](C)Sc2sccc21)c1ccc(-n2cccn2)c(F)c1 ZINC000556222373 568429959 /nfs/dbraw/zinc/42/99/59/568429959.db2.gz SYJAPXUXFSLJOX-OGHNNQOOSA-N 1 0 373.522 5.349 20 0 FKADRO CC(C)OCc1ccccc1C[NH2+]Cc1ccc(-c2ccccc2F)o1 ZINC000556222703 568429900 /nfs/dbraw/zinc/42/99/00/568429900.db2.gz ISZXROGMKVIFHS-UHFFFAOYSA-N 1 0 353.437 5.301 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1cc2ccccc2s1 ZINC000556223229 568429929 /nfs/dbraw/zinc/42/99/29/568429929.db2.gz WIPJMYSUWOQANH-ZDUSSCGKSA-N 1 0 365.527 5.579 20 0 FKADRO Cc1ccccc1COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000556223488 568429943 /nfs/dbraw/zinc/42/99/43/568429943.db2.gz KIDUZGPIBYWCKR-MSOLQXFVSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1ccccc1COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000556223501 568429882 /nfs/dbraw/zinc/42/98/82/568429882.db2.gz KIDUZGPIBYWCKR-QZTJIDSGSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1ccccc1COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000556223504 568429889 /nfs/dbraw/zinc/42/98/89/568429889.db2.gz KIDUZGPIBYWCKR-ROUUACIJSA-N 1 0 362.473 5.086 20 0 FKADRO Cc1ccccc1COc1ccc([C@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000556223507 568429951 /nfs/dbraw/zinc/42/99/51/568429951.db2.gz KIDUZGPIBYWCKR-ZWKOTPCHSA-N 1 0 362.473 5.086 20 0 FKADRO COCC1(CC[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)CCC1 ZINC000556224323 568429941 /nfs/dbraw/zinc/42/99/41/568429941.db2.gz MNYZWLNUQFIXGN-AWEZNQCLSA-N 1 0 362.514 5.115 20 0 FKADRO COCC1(CC[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)CCC1 ZINC000556224325 568429913 /nfs/dbraw/zinc/42/99/13/568429913.db2.gz MNYZWLNUQFIXGN-CQSZACIVSA-N 1 0 362.514 5.115 20 0 FKADRO c1ccc(Oc2ccc(C[NH2+]Cc3ccccc3OC3CCCC3)cn2)cc1 ZINC000556224342 568429893 /nfs/dbraw/zinc/42/98/93/568429893.db2.gz RVGRXRPYQCANDK-UHFFFAOYSA-N 1 0 374.484 5.485 20 0 FKADRO COCC1(CC[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)CCC1 ZINC000556225956 568430004 /nfs/dbraw/zinc/43/00/04/568430004.db2.gz WFSJQHBGDNVZKJ-AWEZNQCLSA-N 1 0 361.473 5.198 20 0 FKADRO COCC1(CC[NH2+][C@H](C)c2ccc(SCC(F)(F)F)cc2)CCC1 ZINC000556225957 568430063 /nfs/dbraw/zinc/43/00/63/568430063.db2.gz WFSJQHBGDNVZKJ-CQSZACIVSA-N 1 0 361.473 5.198 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1cc2ccccc2s1 ZINC000556229810 568430029 /nfs/dbraw/zinc/43/00/29/568430029.db2.gz IWNJUTWYRWLITD-GFCCVEGCSA-N 1 0 350.409 5.208 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1cc2ccccc2s1 ZINC000556229812 568430077 /nfs/dbraw/zinc/43/00/77/568430077.db2.gz IWNJUTWYRWLITD-LBPRGKRZSA-N 1 0 350.409 5.208 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)ccn1 ZINC000556231347 568430183 /nfs/dbraw/zinc/43/01/83/568430183.db2.gz AAJCPCBDHYODAT-VFNWGFHPSA-N 1 0 352.865 5.184 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1cccc(-c2ccncc2)c1 ZINC000556231555 568430221 /nfs/dbraw/zinc/43/02/21/568430221.db2.gz FJOSIFAOOXJXEZ-HNNXBMFYSA-N 1 0 371.406 5.056 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1cccc(-c2ccncc2)c1 ZINC000556231559 568430132 /nfs/dbraw/zinc/43/01/32/568430132.db2.gz FJOSIFAOOXJXEZ-OAHLLOKOSA-N 1 0 371.406 5.056 20 0 FKADRO Fc1ccc(C2=CC[C@@H]([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)cc1 ZINC000556231890 568430233 /nfs/dbraw/zinc/43/02/33/568430233.db2.gz DAPKILAHGNINOZ-GOSISDBHSA-N 1 0 364.386 5.008 20 0 FKADRO Fc1ccc(C2=CC[C@H]([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)cc1 ZINC000556231891 568430168 /nfs/dbraw/zinc/43/01/68/568430168.db2.gz DAPKILAHGNINOZ-SFHVURJKSA-N 1 0 364.386 5.008 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)[C@@H](C)c1ccc(Cl)cc1 ZINC000556232145 568430189 /nfs/dbraw/zinc/43/01/89/568430189.db2.gz HWFIYWSLNYTNLP-CHWSQXEVSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)[C@@H](C)c1ccc(Cl)cc1 ZINC000556232159 568430213 /nfs/dbraw/zinc/43/02/13/568430213.db2.gz HWFIYWSLNYTNLP-OLZOCXBDSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)[C@H](C)c1ccc(Cl)cc1 ZINC000556232163 568430235 /nfs/dbraw/zinc/43/02/35/568430235.db2.gz HWFIYWSLNYTNLP-QWHCGFSZSA-N 1 0 356.819 5.078 20 0 FKADRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCc1cc(C(F)(F)F)ccn1 ZINC000556232165 568430205 /nfs/dbraw/zinc/43/02/05/568430205.db2.gz HWFIYWSLNYTNLP-STQMWFEESA-N 1 0 356.819 5.078 20 0 FKADRO Cc1nc(C)c(CC[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000556233210 568430181 /nfs/dbraw/zinc/43/01/81/568430181.db2.gz HIFJDLZYLOZSIO-AWEZNQCLSA-N 1 0 355.551 5.130 20 0 FKADRO Cc1nc(C)c(CC[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)s1 ZINC000556233218 568430229 /nfs/dbraw/zinc/43/02/29/568430229.db2.gz HIFJDLZYLOZSIO-CQSZACIVSA-N 1 0 355.551 5.130 20 0 FKADRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F ZINC000556233779 568430319 /nfs/dbraw/zinc/43/03/19/568430319.db2.gz RZDQNVUXTOLTLC-LLVKDONJSA-N 1 0 362.317 5.013 20 0 FKADRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F ZINC000556233780 568430344 /nfs/dbraw/zinc/43/03/44/568430344.db2.gz RZDQNVUXTOLTLC-NSHDSACASA-N 1 0 362.317 5.013 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000556234306 568430347 /nfs/dbraw/zinc/43/03/47/568430347.db2.gz PJTZEOASUISORZ-DEOSSOPVSA-N 1 0 373.496 5.276 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000556234325 568430338 /nfs/dbraw/zinc/43/03/38/568430338.db2.gz PJTZEOASUISORZ-XMMPIXPASA-N 1 0 373.496 5.276 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1OCCC ZINC000556235948 568430331 /nfs/dbraw/zinc/43/03/31/568430331.db2.gz KCHRYDJEBZXQAL-DYESRHJHSA-N 1 0 369.505 5.186 20 0 FKADRO CCCOc1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1OCCC ZINC000556235949 568430350 /nfs/dbraw/zinc/43/03/50/568430350.db2.gz KCHRYDJEBZXQAL-LAUBAEHRSA-N 1 0 369.505 5.186 20 0 FKADRO CCCOc1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)cc1OCCC ZINC000556235950 568430257 /nfs/dbraw/zinc/43/02/57/568430257.db2.gz KCHRYDJEBZXQAL-UTKZUKDTSA-N 1 0 369.505 5.186 20 0 FKADRO CCCOc1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)cc1OCCC ZINC000556235951 568430352 /nfs/dbraw/zinc/43/03/52/568430352.db2.gz KCHRYDJEBZXQAL-UWJYYQICSA-N 1 0 369.505 5.186 20 0 FKADRO C[C@H]([NH2+]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl)c1cn[nH]c1 ZINC000556236082 568430359 /nfs/dbraw/zinc/43/03/59/568430359.db2.gz LSOIVDWPDUXTJZ-KBXCAEBGSA-N 1 0 364.880 5.027 20 0 FKADRO C[C@@H]([NH2+]C[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl)c1cn[nH]c1 ZINC000556236083 568430483 /nfs/dbraw/zinc/43/04/83/568430483.db2.gz LSOIVDWPDUXTJZ-KDOFPFPSSA-N 1 0 364.880 5.027 20 0 FKADRO C[C@H]([NH2+]C[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl)c1cn[nH]c1 ZINC000556236084 568430428 /nfs/dbraw/zinc/43/04/28/568430428.db2.gz LSOIVDWPDUXTJZ-KSSFIOAISA-N 1 0 364.880 5.027 20 0 FKADRO C[C@@H]([NH2+]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl)c1cn[nH]c1 ZINC000556236085 568430395 /nfs/dbraw/zinc/43/03/95/568430395.db2.gz LSOIVDWPDUXTJZ-RDTXWAMCSA-N 1 0 364.880 5.027 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@@H]2CCCc3ccc(O)cc32)c2ccccn2)cc1 ZINC000556236293 568430420 /nfs/dbraw/zinc/43/04/20/568430420.db2.gz PSXZPFNZLKWTQT-ISKFKSNPSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@H]2CCCc3ccc(O)cc32)c2ccccn2)cc1 ZINC000556236294 568430475 /nfs/dbraw/zinc/43/04/75/568430475.db2.gz PSXZPFNZLKWTQT-LADGPHEKSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@H]2CCCc3ccc(O)cc32)c2ccccn2)cc1 ZINC000556236295 568430448 /nfs/dbraw/zinc/43/04/48/568430448.db2.gz PSXZPFNZLKWTQT-UPVQGACJSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@@H]2CCCc3ccc(O)cc32)c2ccccn2)cc1 ZINC000556236296 568430468 /nfs/dbraw/zinc/43/04/68/568430468.db2.gz PSXZPFNZLKWTQT-VWNXMTODSA-N 1 0 358.485 5.047 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccn1 ZINC000556237752 568430455 /nfs/dbraw/zinc/43/04/55/568430455.db2.gz WWTPCCMFZXTOQP-CHWSQXEVSA-N 1 0 371.481 5.073 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccn1 ZINC000556237753 568430445 /nfs/dbraw/zinc/43/04/45/568430445.db2.gz WWTPCCMFZXTOQP-OLZOCXBDSA-N 1 0 371.481 5.073 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccn1 ZINC000556237755 568430434 /nfs/dbraw/zinc/43/04/34/568430434.db2.gz WWTPCCMFZXTOQP-QWHCGFSZSA-N 1 0 371.481 5.073 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccn1 ZINC000556237756 568430477 /nfs/dbraw/zinc/43/04/77/568430477.db2.gz WWTPCCMFZXTOQP-STQMWFEESA-N 1 0 371.481 5.073 20 0 FKADRO Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)CCCO2 ZINC000556238133 568430396 /nfs/dbraw/zinc/43/03/96/568430396.db2.gz HLOVZTLVFSXIIX-KRWDZBQOSA-N 1 0 365.395 5.047 20 0 FKADRO Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)CCCO2 ZINC000556238145 568430485 /nfs/dbraw/zinc/43/04/85/568430485.db2.gz HLOVZTLVFSXIIX-QGZVFWFLSA-N 1 0 365.395 5.047 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000556238672 568430424 /nfs/dbraw/zinc/43/04/24/568430424.db2.gz KZKKGEPLZUIFMQ-KBPBESRZSA-N 1 0 372.513 5.312 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000556238683 568430438 /nfs/dbraw/zinc/43/04/38/568430438.db2.gz KZKKGEPLZUIFMQ-UONOGXRCSA-N 1 0 372.513 5.312 20 0 FKADRO CCOc1ccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)C(C)C)cc1OCC ZINC000556238913 568430585 /nfs/dbraw/zinc/43/05/85/568430585.db2.gz WMYZRTZLERJMDD-BTYIYWSLSA-N 1 0 360.473 5.066 20 0 FKADRO CCOc1ccc([C@H]([NH2+][C@H](C)c2ccncc2F)C(C)C)cc1OCC ZINC000556238914 568430569 /nfs/dbraw/zinc/43/05/69/568430569.db2.gz WMYZRTZLERJMDD-QVKFZJNVSA-N 1 0 360.473 5.066 20 0 FKADRO CCOc1ccc([C@@H]([NH2+][C@H](C)c2ccncc2F)C(C)C)cc1OCC ZINC000556238915 568430564 /nfs/dbraw/zinc/43/05/64/568430564.db2.gz WMYZRTZLERJMDD-VFNWGFHPSA-N 1 0 360.473 5.066 20 0 FKADRO CCOc1ccc([C@H]([NH2+][C@@H](C)c2ccncc2F)C(C)C)cc1OCC ZINC000556238916 568430567 /nfs/dbraw/zinc/43/05/67/568430567.db2.gz WMYZRTZLERJMDD-YCRPNKLZSA-N 1 0 360.473 5.066 20 0 FKADRO Fc1cc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)ccc1OC(F)F ZINC000556239072 568430539 /nfs/dbraw/zinc/43/05/39/568430539.db2.gz GMJZZRPMIQQRLU-HNNXBMFYSA-N 1 0 371.786 5.084 20 0 FKADRO Fc1cc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)ccc1OC(F)F ZINC000556239081 568430558 /nfs/dbraw/zinc/43/05/58/568430558.db2.gz GMJZZRPMIQQRLU-OAHLLOKOSA-N 1 0 371.786 5.084 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)ccn1 ZINC000556243887 568430822 /nfs/dbraw/zinc/43/08/22/568430822.db2.gz QLTQEFROQGDDTJ-ROUUACIJSA-N 1 0 362.473 5.081 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)ccn1 ZINC000556243888 568430812 /nfs/dbraw/zinc/43/08/12/568430812.db2.gz QLTQEFROQGDDTJ-ZWKOTPCHSA-N 1 0 362.473 5.081 20 0 FKADRO COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cn3ccccc3n2)cc1 ZINC000556248173 568430806 /nfs/dbraw/zinc/43/08/06/568430806.db2.gz YXOJXXLUZPGADT-MSOLQXFVSA-N 1 0 371.484 5.422 20 0 FKADRO COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cn3ccccc3n2)cc1 ZINC000556248189 568430790 /nfs/dbraw/zinc/43/07/90/568430790.db2.gz YXOJXXLUZPGADT-QZTJIDSGSA-N 1 0 371.484 5.422 20 0 FKADRO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cn3ccccc3n2)cc1 ZINC000556248190 568430816 /nfs/dbraw/zinc/43/08/16/568430816.db2.gz YXOJXXLUZPGADT-ROUUACIJSA-N 1 0 371.484 5.422 20 0 FKADRO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)c2cn3ccccc3n2)cc1 ZINC000556248192 568430780 /nfs/dbraw/zinc/43/07/80/568430780.db2.gz YXOJXXLUZPGADT-ZWKOTPCHSA-N 1 0 371.484 5.422 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000556252207 568430944 /nfs/dbraw/zinc/43/09/44/568430944.db2.gz IDSQKCBXSPXVJW-AUUYWEPGSA-N 1 0 350.487 5.041 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000556252208 568430868 /nfs/dbraw/zinc/43/08/68/568430868.db2.gz IDSQKCBXSPXVJW-IFXJQAMLSA-N 1 0 350.487 5.041 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000556252209 568430876 /nfs/dbraw/zinc/43/08/76/568430876.db2.gz IDSQKCBXSPXVJW-KUHUBIRLSA-N 1 0 350.487 5.041 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000556252210 568430946 /nfs/dbraw/zinc/43/09/46/568430946.db2.gz IDSQKCBXSPXVJW-LIRRHRJNSA-N 1 0 350.487 5.041 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cn[nH]c1 ZINC000556254530 568431030 /nfs/dbraw/zinc/43/10/30/568431030.db2.gz XLECICWNOGURJW-ACJLOTCBSA-N 1 0 351.416 5.401 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cn[nH]c1 ZINC000556254531 568431057 /nfs/dbraw/zinc/43/10/57/568431057.db2.gz XLECICWNOGURJW-FZKQIMNGSA-N 1 0 351.416 5.401 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cn[nH]c1 ZINC000556254532 568431020 /nfs/dbraw/zinc/43/10/20/568431020.db2.gz XLECICWNOGURJW-SCLBCKFNSA-N 1 0 351.416 5.401 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1cn[nH]c1 ZINC000556254533 568431026 /nfs/dbraw/zinc/43/10/26/568431026.db2.gz XLECICWNOGURJW-UGSOOPFHSA-N 1 0 351.416 5.401 20 0 FKADRO Cc1cc(C[NH2+][C@@H](C)c2ccncc2F)ccc1Oc1ccc(F)cc1 ZINC000556258026 568431189 /nfs/dbraw/zinc/43/11/89/568431189.db2.gz VMFADPQWWGNGLU-HNNXBMFYSA-N 1 0 354.400 5.311 20 0 FKADRO Cc1cc(C[NH2+][C@H](C)c2ccncc2F)ccc1Oc1ccc(F)cc1 ZINC000556258027 568431136 /nfs/dbraw/zinc/43/11/36/568431136.db2.gz VMFADPQWWGNGLU-OAHLLOKOSA-N 1 0 354.400 5.311 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ncc(Br)s1 ZINC000556259524 568431160 /nfs/dbraw/zinc/43/11/60/568431160.db2.gz DSRZTQHFXAFLGE-DCAQKATOSA-N 1 0 371.731 5.156 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ncc(Br)s1 ZINC000556259533 568431102 /nfs/dbraw/zinc/43/11/02/568431102.db2.gz DSRZTQHFXAFLGE-GMTAPVOTSA-N 1 0 371.731 5.156 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000556259709 568431177 /nfs/dbraw/zinc/43/11/77/568431177.db2.gz KYVCJDOIUDCGFI-IFXJQAMLSA-N 1 0 364.514 5.552 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000556259713 568431170 /nfs/dbraw/zinc/43/11/70/568431170.db2.gz KYVCJDOIUDCGFI-KUHUBIRLSA-N 1 0 364.514 5.552 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000556259716 568431132 /nfs/dbraw/zinc/43/11/32/568431132.db2.gz KYVCJDOIUDCGFI-LIRRHRJNSA-N 1 0 364.514 5.552 20 0 FKADRO CCc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000556261192 568431203 /nfs/dbraw/zinc/43/12/03/568431203.db2.gz QQADCYCYGXYUCO-KBAYOESNSA-N 1 0 370.924 5.155 20 0 FKADRO CCc1ccccc1NC(=O)C[C@H](C)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000556261197 568431188 /nfs/dbraw/zinc/43/11/88/568431188.db2.gz QQADCYCYGXYUCO-SZMVWBNQSA-N 1 0 370.924 5.155 20 0 FKADRO COc1ccc(-c2csc(C[NH2+][C@H]3CCCc4c(O)cccc43)c2)cc1 ZINC000556261350 568431182 /nfs/dbraw/zinc/43/11/82/568431182.db2.gz LKDKHYPUNSLDTA-NRFANRHFSA-N 1 0 365.498 5.297 20 0 FKADRO COc1ccc(-c2csc(C[NH2+][C@@H]3CCCc4c(O)cccc43)c2)cc1 ZINC000556261351 568431151 /nfs/dbraw/zinc/43/11/51/568431151.db2.gz LKDKHYPUNSLDTA-OAQYLSRUSA-N 1 0 365.498 5.297 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1)c1ccncc1F ZINC000556262820 568431314 /nfs/dbraw/zinc/43/13/14/568431314.db2.gz URJBFUHYZDPUPC-AWEZNQCLSA-N 1 0 356.441 5.362 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1)c1ccncc1F ZINC000556262846 568431271 /nfs/dbraw/zinc/43/12/71/568431271.db2.gz URJBFUHYZDPUPC-CQSZACIVSA-N 1 0 356.441 5.362 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccncc1F ZINC000556263533 568431241 /nfs/dbraw/zinc/43/12/41/568431241.db2.gz BTNCRSKKZRYUCD-PNPHSEOMSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccncc1F ZINC000556263555 568431343 /nfs/dbraw/zinc/43/13/43/568431343.db2.gz BTNCRSKKZRYUCD-QITLCBANSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccncc1F ZINC000556263560 568431267 /nfs/dbraw/zinc/43/12/67/568431267.db2.gz BTNCRSKKZRYUCD-WBHUJUFNSA-N 1 0 352.375 5.226 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccncc1F ZINC000556263562 568431339 /nfs/dbraw/zinc/43/13/39/568431339.db2.gz BTNCRSKKZRYUCD-XLWVJDPXSA-N 1 0 352.375 5.226 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000556263751 568431318 /nfs/dbraw/zinc/43/13/18/568431318.db2.gz IMZZMDQWNKSPTL-DLBZAZTESA-N 1 0 353.359 5.192 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000556263752 568431255 /nfs/dbraw/zinc/43/12/55/568431255.db2.gz IMZZMDQWNKSPTL-IAGOWNOFSA-N 1 0 353.359 5.192 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000556263753 568431248 /nfs/dbraw/zinc/43/12/48/568431248.db2.gz IMZZMDQWNKSPTL-IRXDYDNUSA-N 1 0 353.359 5.192 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000556263754 568431341 /nfs/dbraw/zinc/43/13/41/568431341.db2.gz IMZZMDQWNKSPTL-SJORKVTESA-N 1 0 353.359 5.192 20 0 FKADRO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000556264130 568431289 /nfs/dbraw/zinc/43/12/89/568431289.db2.gz LCRJPQYHQWAPQD-MSOLQXFVSA-N 1 0 354.538 5.306 20 0 FKADRO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000556264135 568431245 /nfs/dbraw/zinc/43/12/45/568431245.db2.gz LCRJPQYHQWAPQD-QZTJIDSGSA-N 1 0 354.538 5.306 20 0 FKADRO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000556264136 568431334 /nfs/dbraw/zinc/43/13/34/568431334.db2.gz LCRJPQYHQWAPQD-ROUUACIJSA-N 1 0 354.538 5.306 20 0 FKADRO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000556264137 568431351 /nfs/dbraw/zinc/43/13/51/568431351.db2.gz LCRJPQYHQWAPQD-ZWKOTPCHSA-N 1 0 354.538 5.306 20 0 FKADRO Cc1sc(C2([NH2+]C3CCSCC3)CCC2)nc1-c1ccccc1F ZINC000556269423 568431411 /nfs/dbraw/zinc/43/14/11/568431411.db2.gz SNEMCDBGJXKPKK-UHFFFAOYSA-N 1 0 362.539 5.122 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)cc1Cl ZINC000556292040 568431694 /nfs/dbraw/zinc/43/16/94/568431694.db2.gz HQNCEDQMRIVWMM-LBPRGKRZSA-N 1 0 355.812 5.191 20 0 FKADRO COc1ccccc1[C@H]1CCC[N@@H+]1CCC(=O)Nc1cccc2ccccc21 ZINC000556314238 568432412 /nfs/dbraw/zinc/43/24/12/568432412.db2.gz DTNMJDRPFIMRMC-JOCHJYFZSA-N 1 0 374.484 5.014 20 0 FKADRO COc1ccccc1[C@@H]1CCC[N@@H+]1CCC(=O)Nc1cccc2ccccc21 ZINC000556314245 568432373 /nfs/dbraw/zinc/43/23/73/568432373.db2.gz DTNMJDRPFIMRMC-QFIPXVFZSA-N 1 0 374.484 5.014 20 0 FKADRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(OCc2ccccn2)cc1 ZINC000556326245 568432871 /nfs/dbraw/zinc/43/28/71/568432871.db2.gz FBEDDXZTQDHSJT-QHCPKHFHSA-N 1 0 374.484 5.006 20 0 FKADRO COc1ccc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)cc1O ZINC000556385435 568434011 /nfs/dbraw/zinc/43/40/11/568434011.db2.gz IEBVVYIIEUHCGM-UHFFFAOYSA-N 1 0 353.849 5.011 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3cccc4cccnc43)s2)cc1 ZINC000556386318 568434067 /nfs/dbraw/zinc/43/40/67/568434067.db2.gz OWCLNHYCFWBWEN-UHFFFAOYSA-N 1 0 365.889 5.302 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cn1 ZINC000556386862 568434118 /nfs/dbraw/zinc/43/41/18/568434118.db2.gz PHVKCVYSRATRHV-ZDUSSCGKSA-N 1 0 360.914 5.092 20 0 FKADRO COc1ccc(C)cc1C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556387724 568434125 /nfs/dbraw/zinc/43/41/25/568434125.db2.gz VAIDYTDECDZXDF-UHFFFAOYSA-N 1 0 358.894 5.070 20 0 FKADRO CCn1nc(C)c(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)c1C ZINC000556388072 568434008 /nfs/dbraw/zinc/43/40/08/568434008.db2.gz ZJUJTXSRRROKKL-UHFFFAOYSA-N 1 0 353.897 5.130 20 0 FKADRO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc(OCc4ccccc4)cc3)cn2c1 ZINC000556388117 568433997 /nfs/dbraw/zinc/43/39/97/568433997.db2.gz ONXVGAHOAQSTRN-IBGZPJMESA-N 1 0 371.484 5.073 20 0 FKADRO Fc1ccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cc1F ZINC000556388886 568434056 /nfs/dbraw/zinc/43/40/56/568434056.db2.gz ZCQVHPSACCOWNB-UHFFFAOYSA-N 1 0 350.821 5.032 20 0 FKADRO CC(C)c1ccoc1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000556393924 568434206 /nfs/dbraw/zinc/43/42/06/568434206.db2.gz IGDGHKGZCBATNO-UHFFFAOYSA-N 1 0 354.494 5.420 20 0 FKADRO Cc1nn(C)c(C)c1C[NH2+]Cc1cccc(Oc2cccc3ccccc32)c1 ZINC000556404748 568434280 /nfs/dbraw/zinc/43/42/80/568434280.db2.gz WMBDYUOIUIKBCZ-UHFFFAOYSA-N 1 0 371.484 5.272 20 0 FKADRO FC(F)(F)c1cccc([C@@H]([NH2+]Cc2ccc(Cl)o2)C2CCOCC2)c1 ZINC000556407237 568434484 /nfs/dbraw/zinc/43/44/84/568434484.db2.gz CKPDYYPWRUNRTG-KRWDZBQOSA-N 1 0 373.802 5.209 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2ccc(Cl)o2)C2CCOCC2)c1 ZINC000556407240 568434472 /nfs/dbraw/zinc/43/44/72/568434472.db2.gz CKPDYYPWRUNRTG-QGZVFWFLSA-N 1 0 373.802 5.209 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3scnc3C3CC3)s2)cc1 ZINC000556407479 568434495 /nfs/dbraw/zinc/43/44/95/568434495.db2.gz KBBDEMJOORKXLT-UHFFFAOYSA-N 1 0 361.923 5.087 20 0 FKADRO Fc1ccccc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556407552 568434531 /nfs/dbraw/zinc/43/45/31/568434531.db2.gz LJZDIQZMUNKDKH-IBGZPJMESA-N 1 0 367.386 5.102 20 0 FKADRO Fc1ccccc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556407555 568434466 /nfs/dbraw/zinc/43/44/66/568434466.db2.gz LJZDIQZMUNKDKH-LJQANCHMSA-N 1 0 367.386 5.102 20 0 FKADRO Cc1nc2ccc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)cc2s1 ZINC000556407569 568434501 /nfs/dbraw/zinc/43/45/01/568434501.db2.gz GDZQUJICDRXWAH-UHFFFAOYSA-N 1 0 352.503 5.216 20 0 FKADRO Cc1ccccc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556408319 568434457 /nfs/dbraw/zinc/43/44/57/568434457.db2.gz WDXXOTNSICCGPB-FQEVSTJZSA-N 1 0 363.423 5.271 20 0 FKADRO Cc1ccccc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556408320 568434512 /nfs/dbraw/zinc/43/45/12/568434512.db2.gz WDXXOTNSICCGPB-HXUWFJFHSA-N 1 0 363.423 5.271 20 0 FKADRO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2c(Cl)cccc2Cl)c(C)c1 ZINC000556408821 568434520 /nfs/dbraw/zinc/43/45/20/568434520.db2.gz FBCCQMSIRLYWGX-AWEZNQCLSA-N 1 0 365.304 5.242 20 0 FKADRO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2c(Cl)cccc2Cl)c(C)c1 ZINC000556408822 568434468 /nfs/dbraw/zinc/43/44/68/568434468.db2.gz FBCCQMSIRLYWGX-CQSZACIVSA-N 1 0 365.304 5.242 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cnc(-c3ccccc3)s2)cc1Cl ZINC000556409199 568434482 /nfs/dbraw/zinc/43/44/82/568434482.db2.gz DXSVTEOWWIIRDP-UHFFFAOYSA-N 1 0 358.894 5.152 20 0 FKADRO COc1sc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)cc1Br ZINC000556409262 568434488 /nfs/dbraw/zinc/43/44/88/568434488.db2.gz APFWFVHSKOSWTR-UHFFFAOYSA-N 1 0 374.731 5.198 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+]Cc3cccc4cc[nH]c43)s2)cc1 ZINC000556409859 568434476 /nfs/dbraw/zinc/43/44/76/568434476.db2.gz GYVIRGOKHMWLAC-UHFFFAOYSA-N 1 0 353.878 5.235 20 0 FKADRO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556410629 568434462 /nfs/dbraw/zinc/43/44/62/568434462.db2.gz UCMYLZJPBYEMSG-QGZVFWFLSA-N 1 0 374.868 5.216 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2ccc(-c3ccncc3)cc2F)cc1Cl ZINC000556411193 568434474 /nfs/dbraw/zinc/43/44/74/568434474.db2.gz WEEPRZCIXRHFEC-UHFFFAOYSA-N 1 0 370.855 5.230 20 0 FKADRO Cc1cc(C[NH2+]Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)n(C)n1 ZINC000556411375 568434534 /nfs/dbraw/zinc/43/45/34/568434534.db2.gz BOWQYMBVTHDWCX-UHFFFAOYSA-N 1 0 366.317 5.054 20 0 FKADRO CC(C)n1cc(C[NH2+]Cc2ccc(Sc3ccc(F)cc3)cc2)cn1 ZINC000556411432 568434507 /nfs/dbraw/zinc/43/45/07/568434507.db2.gz BPEARIYNNMVIHK-UHFFFAOYSA-N 1 0 355.482 5.044 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cnc(-c3cccs3)s2)cc1Cl ZINC000556412076 568434464 /nfs/dbraw/zinc/43/44/64/568434464.db2.gz KVVLMXOUTQSJFX-UHFFFAOYSA-N 1 0 364.923 5.214 20 0 FKADRO Fc1cc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cc(F)c1F ZINC000556430915 568435306 /nfs/dbraw/zinc/43/53/06/568435306.db2.gz RXQQLBBSAWYUBU-UHFFFAOYSA-N 1 0 368.811 5.171 20 0 FKADRO COc1cc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)ccc1SC ZINC000556431426 568435216 /nfs/dbraw/zinc/43/52/16/568435216.db2.gz WBEGJIUKWJTCLV-UHFFFAOYSA-N 1 0 357.519 5.028 20 0 FKADRO CC1(C)CCC[N@H+](Cc2nnc(-c3c(Cl)cccc3Cl)o2)CC1 ZINC000556484929 568436087 /nfs/dbraw/zinc/43/60/87/568436087.db2.gz ZHLOUMGMFZGQIO-UHFFFAOYSA-N 1 0 354.281 5.056 20 0 FKADRO FC(F)(F)c1ccc(CN2CCC[C@H]2c2nc3ccccc3s2)nc1 ZINC000556492642 568436311 /nfs/dbraw/zinc/43/63/11/568436311.db2.gz QLLLIGVITFGRRG-HNNXBMFYSA-N 1 0 363.408 5.047 20 0 FKADRO FC(F)(F)c1ccc(CN2CCC[C@@H]2c2nc3ccccc3s2)nc1 ZINC000556492643 568436240 /nfs/dbraw/zinc/43/62/40/568436240.db2.gz QLLLIGVITFGRRG-OAHLLOKOSA-N 1 0 363.408 5.047 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)C(C)C ZINC000556501794 568436450 /nfs/dbraw/zinc/43/64/50/568436450.db2.gz NTSHHSZOKIWSFN-GOSISDBHSA-N 1 0 362.395 5.642 20 0 FKADRO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)C(C)C ZINC000556501796 568436411 /nfs/dbraw/zinc/43/64/11/568436411.db2.gz NTSHHSZOKIWSFN-SFHVURJKSA-N 1 0 362.395 5.642 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)nc1 ZINC000556502244 568436460 /nfs/dbraw/zinc/43/64/60/568436460.db2.gz RYXMJKVTZIBAPT-KRWDZBQOSA-N 1 0 354.803 5.385 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)nc1 ZINC000556502245 568436388 /nfs/dbraw/zinc/43/63/88/568436388.db2.gz RYXMJKVTZIBAPT-QGZVFWFLSA-N 1 0 354.803 5.385 20 0 FKADRO COc1cc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)ccc1SC ZINC000556503080 568436438 /nfs/dbraw/zinc/43/64/38/568436438.db2.gz MTSHAWMYYQVACO-UHFFFAOYSA-N 1 0 367.436 5.215 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)nc1 ZINC000556503198 568436476 /nfs/dbraw/zinc/43/64/76/568436476.db2.gz GFVWBHOIKHTOEY-UHFFFAOYSA-N 1 0 354.803 5.313 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3ccc(Br)cc3)CC2)c1 ZINC000556503447 568436447 /nfs/dbraw/zinc/43/64/47/568436447.db2.gz WVTPSHMZJOTNBU-UHFFFAOYSA-N 1 0 370.212 5.247 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccccc1Cl ZINC000556516041 568436590 /nfs/dbraw/zinc/43/65/90/568436590.db2.gz YKASGPBVVXWRMQ-APPDUMDISA-N 1 0 365.702 5.299 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccccc1Cl ZINC000556516042 568436582 /nfs/dbraw/zinc/43/65/82/568436582.db2.gz YKASGPBVVXWRMQ-DIFFPNOSSA-N 1 0 365.702 5.299 20 0 FKADRO C[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccccc1Cl ZINC000556516043 568436603 /nfs/dbraw/zinc/43/66/03/568436603.db2.gz YKASGPBVVXWRMQ-GTNSWQLSSA-N 1 0 365.702 5.299 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccccc1Cl ZINC000556516044 568436750 /nfs/dbraw/zinc/43/67/50/568436750.db2.gz YKASGPBVVXWRMQ-PIGZYNQJSA-N 1 0 365.702 5.299 20 0 FKADRO Cc1ccccc1[C@H](C)[N@@H+](Cc1csc(-c2ncccn2)n1)CC(C)C ZINC000556519272 568436822 /nfs/dbraw/zinc/43/68/22/568436822.db2.gz IHQDUXWDLKRFBK-KRWDZBQOSA-N 1 0 366.534 5.128 20 0 FKADRO Cc1ccccc1[C@@H](C)[N@@H+](Cc1csc(-c2ncccn2)n1)CC(C)C ZINC000556519277 568436849 /nfs/dbraw/zinc/43/68/49/568436849.db2.gz IHQDUXWDLKRFBK-QGZVFWFLSA-N 1 0 366.534 5.128 20 0 FKADRO Cc1cc(-c2nnc(C[N@@H+](CC(C)C)[C@@H](C)c3ccccc3C)o2)c(C)o1 ZINC000556519785 568436859 /nfs/dbraw/zinc/43/68/59/568436859.db2.gz MBJIPTCRIJQGDB-KRWDZBQOSA-N 1 0 367.493 5.474 20 0 FKADRO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556522252 568436876 /nfs/dbraw/zinc/43/68/76/568436876.db2.gz FNTRUKJTAXEOEU-AUUYWEPGSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556522254 568436881 /nfs/dbraw/zinc/43/68/81/568436881.db2.gz FNTRUKJTAXEOEU-IFXJQAMLSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556522256 568436797 /nfs/dbraw/zinc/43/67/97/568436797.db2.gz FNTRUKJTAXEOEU-KUHUBIRLSA-N 1 0 359.311 5.263 20 0 FKADRO Clc1ccc(C[NH+]2CC(c3nc4ccccc4s3)C2)c2ncccc12 ZINC000556571610 568437852 /nfs/dbraw/zinc/43/78/52/568437852.db2.gz OIOLYKKYDZZSAU-UHFFFAOYSA-N 1 0 365.889 5.097 20 0 FKADRO Cc1cc(C[NH2+][C@H](C)c2ccc(-c3ccc(Cl)cc3F)s2)n(C)n1 ZINC000556574204 568437875 /nfs/dbraw/zinc/43/78/75/568437875.db2.gz VGGSILDGVRQMER-GFCCVEGCSA-N 1 0 363.889 5.100 20 0 FKADRO COCc1cc(C[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)ccc1F ZINC000556580184 568438031 /nfs/dbraw/zinc/43/80/31/568438031.db2.gz CTGZUQIAGFVSEY-AWEZNQCLSA-N 1 0 365.876 5.264 20 0 FKADRO COCc1cc(C[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)ccc1F ZINC000556580186 568437992 /nfs/dbraw/zinc/43/79/92/568437992.db2.gz CTGZUQIAGFVSEY-CQSZACIVSA-N 1 0 365.876 5.264 20 0 FKADRO Cc1ccccc1C[C@H]([NH2+][C@@H](C)c1nc(-c2ccncc2)cs1)C1CC1 ZINC000556584048 568438013 /nfs/dbraw/zinc/43/80/13/568438013.db2.gz OOLVPDRXUOVHAT-JXFKEZNVSA-N 1 0 363.530 5.185 20 0 FKADRO Cc1ccccc1C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccncc2)cs1)C1CC1 ZINC000556584049 568437965 /nfs/dbraw/zinc/43/79/65/568437965.db2.gz OOLVPDRXUOVHAT-OXJNMPFZSA-N 1 0 363.530 5.185 20 0 FKADRO Cc1ccccc1C[C@@H]([NH2+][C@H](C)c1nc(-c2ccncc2)cs1)C1CC1 ZINC000556584050 568437999 /nfs/dbraw/zinc/43/79/99/568437999.db2.gz OOLVPDRXUOVHAT-OXQOHEQNSA-N 1 0 363.530 5.185 20 0 FKADRO Cc1ccccc1C[C@H]([NH2+][C@H](C)c1nc(-c2ccncc2)cs1)C1CC1 ZINC000556584051 568438027 /nfs/dbraw/zinc/43/80/27/568438027.db2.gz OOLVPDRXUOVHAT-UZLBHIALSA-N 1 0 363.530 5.185 20 0 FKADRO CC(C)c1nnc(C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)s1 ZINC000556584571 568437974 /nfs/dbraw/zinc/43/79/74/568437974.db2.gz WUPKQHGSKDKVNL-CABCVRRESA-N 1 0 369.456 5.106 20 0 FKADRO CC(C)c1nnc(C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)s1 ZINC000556584572 568438015 /nfs/dbraw/zinc/43/80/15/568438015.db2.gz WUPKQHGSKDKVNL-GJZGRUSLSA-N 1 0 369.456 5.106 20 0 FKADRO CC(C)c1nnc(C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)s1 ZINC000556584573 568438007 /nfs/dbraw/zinc/43/80/07/568438007.db2.gz WUPKQHGSKDKVNL-HUUCEWRRSA-N 1 0 369.456 5.106 20 0 FKADRO CC(C)c1nnc(C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)s1 ZINC000556584576 568438041 /nfs/dbraw/zinc/43/80/41/568438041.db2.gz WUPKQHGSKDKVNL-LSDHHAIUSA-N 1 0 369.456 5.106 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc1Cl ZINC000556586031 568438039 /nfs/dbraw/zinc/43/80/39/568438039.db2.gz LCATXIPMIPYLAI-GHMZBOCLSA-N 1 0 358.791 5.174 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc1Cl ZINC000556586032 568437990 /nfs/dbraw/zinc/43/79/90/568437990.db2.gz LCATXIPMIPYLAI-MNOVXSKESA-N 1 0 358.791 5.174 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc1Cl ZINC000556586033 568438190 /nfs/dbraw/zinc/43/81/90/568438190.db2.gz LCATXIPMIPYLAI-QWRGUYRKSA-N 1 0 358.791 5.174 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc1Cl ZINC000556586034 568438182 /nfs/dbraw/zinc/43/81/82/568438182.db2.gz LCATXIPMIPYLAI-WDEREUQCSA-N 1 0 358.791 5.174 20 0 FKADRO CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000556588002 568438210 /nfs/dbraw/zinc/43/82/10/568438210.db2.gz ZPCSTFNXBUQYEN-GOSISDBHSA-N 1 0 368.521 5.311 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000556588003 568438218 /nfs/dbraw/zinc/43/82/18/568438218.db2.gz ZPCSTFNXBUQYEN-SFHVURJKSA-N 1 0 368.521 5.311 20 0 FKADRO COc1ccc(C[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1F ZINC000556588383 568438113 /nfs/dbraw/zinc/43/81/13/568438113.db2.gz DLNAILTVJSLYQZ-CYBMUJFWSA-N 1 0 351.849 5.126 20 0 FKADRO COc1ccc(C[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1F ZINC000556588384 568438198 /nfs/dbraw/zinc/43/81/98/568438198.db2.gz DLNAILTVJSLYQZ-ZDUSSCGKSA-N 1 0 351.849 5.126 20 0 FKADRO COc1ncc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)cc1Cl ZINC000556589452 568438208 /nfs/dbraw/zinc/43/82/08/568438208.db2.gz LCNKUBFRNBOZMQ-HNNXBMFYSA-N 1 0 352.865 5.184 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)cc1Cl ZINC000556589453 568438132 /nfs/dbraw/zinc/43/81/32/568438132.db2.gz LCNKUBFRNBOZMQ-OAHLLOKOSA-N 1 0 352.865 5.184 20 0 FKADRO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)C(C)C ZINC000556596736 568438120 /nfs/dbraw/zinc/43/81/20/568438120.db2.gz RLCDSSNSRSYKCT-LJQANCHMSA-N 1 0 351.494 5.316 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000556599417 568438316 /nfs/dbraw/zinc/43/83/16/568438316.db2.gz PKIYYOZZRQJQTP-MRXNPFEDSA-N 1 0 363.480 5.431 20 0 FKADRO COc1cc(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)ccc1OC(F)F ZINC000556601468 568438628 /nfs/dbraw/zinc/43/86/28/568438628.db2.gz MPMCEDFRBMNTMY-INIZCTEOSA-N 1 0 367.823 5.117 20 0 FKADRO COc1cc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)ccc1OC(F)F ZINC000556601477 568438621 /nfs/dbraw/zinc/43/86/21/568438621.db2.gz MPMCEDFRBMNTMY-MRXNPFEDSA-N 1 0 367.823 5.117 20 0 FKADRO CC[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc(C)cc1 ZINC000556605761 568438720 /nfs/dbraw/zinc/43/87/20/568438720.db2.gz HEBIHCHKHIQDDV-MOPGFXCFSA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc(C)cc1 ZINC000556605762 568438689 /nfs/dbraw/zinc/43/86/89/568438689.db2.gz HEBIHCHKHIQDDV-OALUTQOASA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc(C)cc1 ZINC000556605763 568438779 /nfs/dbraw/zinc/43/87/79/568438779.db2.gz HEBIHCHKHIQDDV-RBUKOAKNSA-N 1 0 359.311 5.345 20 0 FKADRO CC[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc(C)cc1 ZINC000556605764 568438743 /nfs/dbraw/zinc/43/87/43/568438743.db2.gz HEBIHCHKHIQDDV-RTBURBONSA-N 1 0 359.311 5.345 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccccc1 ZINC000556605766 568438794 /nfs/dbraw/zinc/43/87/94/568438794.db2.gz HGQLEWRTBCQBBT-FOIQADDNSA-N 1 0 363.423 5.524 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccccc1 ZINC000556605768 568438679 /nfs/dbraw/zinc/43/86/79/568438679.db2.gz HGQLEWRTBCQBBT-QRWLVFNGSA-N 1 0 363.423 5.524 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccccc1 ZINC000556605769 568438712 /nfs/dbraw/zinc/43/87/12/568438712.db2.gz HGQLEWRTBCQBBT-YWZLYKJASA-N 1 0 363.423 5.524 20 0 FKADRO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556605930 568438764 /nfs/dbraw/zinc/43/87/64/568438764.db2.gz NIWJMDPCHWHTHU-AUUYWEPGSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556605931 568438707 /nfs/dbraw/zinc/43/87/07/568438707.db2.gz NIWJMDPCHWHTHU-IFXJQAMLSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556605932 568438716 /nfs/dbraw/zinc/43/87/16/568438716.db2.gz NIWJMDPCHWHTHU-KUHUBIRLSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1cc(C)cc([C@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000556605933 568438766 /nfs/dbraw/zinc/43/87/66/568438766.db2.gz NIWJMDPCHWHTHU-LIRRHRJNSA-N 1 0 359.311 5.263 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556606248 568438940 /nfs/dbraw/zinc/43/89/40/568438940.db2.gz VDVGUOYFKQFJPF-ZDUSSCGKSA-N 1 0 357.910 5.272 20 0 FKADRO COCCC[C@@H]([NH2+]Cc1ccc(OC2CCCC2)cc1)c1ccc(F)cc1 ZINC000556606473 568438974 /nfs/dbraw/zinc/43/89/74/568438974.db2.gz XYHNOBWYKMTXTM-HSZRJFAPSA-N 1 0 371.496 5.405 20 0 FKADRO COCCC[C@H]([NH2+]Cc1ccc(OC2CCCC2)cc1)c1ccc(F)cc1 ZINC000556606474 568438931 /nfs/dbraw/zinc/43/89/31/568438931.db2.gz XYHNOBWYKMTXTM-QHCPKHFHSA-N 1 0 371.496 5.405 20 0 FKADRO CCC[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccccc1 ZINC000556606651 568438938 /nfs/dbraw/zinc/43/89/38/568438938.db2.gz ZZNIJVIGGOGHFB-MOPGFXCFSA-N 1 0 359.311 5.426 20 0 FKADRO CCC[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccccc1 ZINC000556606652 568438889 /nfs/dbraw/zinc/43/88/89/568438889.db2.gz ZZNIJVIGGOGHFB-OALUTQOASA-N 1 0 359.311 5.426 20 0 FKADRO CCC[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccccc1 ZINC000556606653 568438942 /nfs/dbraw/zinc/43/89/42/568438942.db2.gz ZZNIJVIGGOGHFB-RBUKOAKNSA-N 1 0 359.311 5.426 20 0 FKADRO CCC[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccccc1 ZINC000556606654 568438936 /nfs/dbraw/zinc/43/89/36/568438936.db2.gz ZZNIJVIGGOGHFB-RTBURBONSA-N 1 0 359.311 5.426 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)cc1Cl ZINC000556607224 568438920 /nfs/dbraw/zinc/43/89/20/568438920.db2.gz BKZHIUPUEKFDFK-IBGZPJMESA-N 1 0 374.868 5.072 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)cc1Cl ZINC000556607229 568438918 /nfs/dbraw/zinc/43/89/18/568438918.db2.gz BKZHIUPUEKFDFK-LJQANCHMSA-N 1 0 374.868 5.072 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(OC2CCCC2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000556607477 568438925 /nfs/dbraw/zinc/43/89/25/568438925.db2.gz DINJOCMDGOLWEW-GOSISDBHSA-N 1 0 361.489 5.045 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(OC2CCCC2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000556607479 568438958 /nfs/dbraw/zinc/43/89/58/568438958.db2.gz DINJOCMDGOLWEW-SFHVURJKSA-N 1 0 361.489 5.045 20 0 FKADRO Cc1oc2ccccc2c1C[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000556607835 568438872 /nfs/dbraw/zinc/43/88/72/568438872.db2.gz CNOSPEIWFJNHHE-IBGZPJMESA-N 1 0 371.278 5.140 20 0 FKADRO Cc1oc2ccccc2c1C[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000556607836 568438972 /nfs/dbraw/zinc/43/89/72/568438972.db2.gz CNOSPEIWFJNHHE-LJQANCHMSA-N 1 0 371.278 5.140 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@H](c3cccnc3)C3CCC3)s2)cc1 ZINC000556608164 568440220 /nfs/dbraw/zinc/44/02/20/568440220.db2.gz FWZOUTMEQNPHDH-IBGZPJMESA-N 1 0 369.921 5.490 20 0 FKADRO Clc1ccc(-c2ncc(C[NH2+][C@@H](c3cccnc3)C3CCC3)s2)cc1 ZINC000556608167 568440195 /nfs/dbraw/zinc/44/01/95/568440195.db2.gz FWZOUTMEQNPHDH-LJQANCHMSA-N 1 0 369.921 5.490 20 0 FKADRO Cc1ccsc1[C@@H](C)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000556608255 568429676 /nfs/dbraw/zinc/42/96/76/568429676.db2.gz LYETYLBTWJXEAB-ABAIWWIYSA-N 1 0 351.313 5.016 20 0 FKADRO Cc1ccsc1[C@@H](C)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000556608261 568429746 /nfs/dbraw/zinc/42/97/46/568429746.db2.gz LYETYLBTWJXEAB-IAQYHMDHSA-N 1 0 351.313 5.016 20 0 FKADRO Cc1ccsc1[C@H](C)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000556608262 568429682 /nfs/dbraw/zinc/42/96/82/568429682.db2.gz LYETYLBTWJXEAB-NHYWBVRUSA-N 1 0 351.313 5.016 20 0 FKADRO Cc1ccsc1[C@H](C)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000556608263 568429756 /nfs/dbraw/zinc/42/97/56/568429756.db2.gz LYETYLBTWJXEAB-XHDPSFHLSA-N 1 0 351.313 5.016 20 0 FKADRO C[C@H]([NH2+]C1(c2ccc(Cl)cc2)CCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000556608883 568430223 /nfs/dbraw/zinc/43/02/23/568430223.db2.gz KMGUBKJGCFUWIN-AWEZNQCLSA-N 1 0 368.908 5.300 20 0 FKADRO C[C@@H]([NH2+]C1(c2ccc(Cl)cc2)CCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000556608884 568430171 /nfs/dbraw/zinc/43/01/71/568430171.db2.gz KMGUBKJGCFUWIN-CQSZACIVSA-N 1 0 368.908 5.300 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](CCCOC)c2ccc(F)cc2)cc1Cl ZINC000556609305 568430761 /nfs/dbraw/zinc/43/07/61/568430761.db2.gz OLVFDIFVBZMRJK-IBGZPJMESA-N 1 0 365.876 5.135 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](CCCOC)c2ccc(F)cc2)cc1Cl ZINC000556609306 568430818 /nfs/dbraw/zinc/43/08/18/568430818.db2.gz OLVFDIFVBZMRJK-LJQANCHMSA-N 1 0 365.876 5.135 20 0 FKADRO CCc1ccc([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000556609502 568430912 /nfs/dbraw/zinc/43/09/12/568430912.db2.gz UJFVCARHFISXGX-ORAYPTAESA-N 1 0 359.311 5.208 20 0 FKADRO CCc1ccc([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000556609505 568430880 /nfs/dbraw/zinc/43/08/80/568430880.db2.gz UJFVCARHFISXGX-YJYMSZOUSA-N 1 0 359.311 5.208 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccsc1 ZINC000556609552 568430928 /nfs/dbraw/zinc/43/09/28/568430928.db2.gz PRBQVDWHECMAJQ-ACJLOTCBSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccsc1 ZINC000556609559 568430934 /nfs/dbraw/zinc/43/09/34/568430934.db2.gz PRBQVDWHECMAJQ-FZKQIMNGSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccsc1 ZINC000556609563 568430909 /nfs/dbraw/zinc/43/09/09/568430909.db2.gz PRBQVDWHECMAJQ-SCLBCKFNSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccsc1 ZINC000556609567 568430918 /nfs/dbraw/zinc/43/09/18/568430918.db2.gz PRBQVDWHECMAJQ-UGSOOPFHSA-N 1 0 369.452 5.585 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(Cl)c(Cl)c1 ZINC000556609648 568431059 /nfs/dbraw/zinc/43/10/59/568431059.db2.gz ZSUOLOQUSRLRME-GOSISDBHSA-N 1 0 352.309 5.013 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(Cl)c(Cl)c1 ZINC000556609651 568431048 /nfs/dbraw/zinc/43/10/48/568431048.db2.gz ZSUOLOQUSRLRME-SFHVURJKSA-N 1 0 352.309 5.013 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)cc1Cl ZINC000556609670 568431070 /nfs/dbraw/zinc/43/10/70/568431070.db2.gz ZUFFVWASWLBFGN-GOSISDBHSA-N 1 0 357.881 5.275 20 0 FKADRO CCOc1ccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cc1Cl ZINC000556609682 568430996 /nfs/dbraw/zinc/43/09/96/568430996.db2.gz ZUFFVWASWLBFGN-SFHVURJKSA-N 1 0 357.881 5.275 20 0 FKADRO Cc1c([C@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cnn1C(C)(C)C ZINC000556609851 568431144 /nfs/dbraw/zinc/43/11/44/568431144.db2.gz CGXHKYLZSLSKRG-INIZCTEOSA-N 1 0 355.526 5.119 20 0 FKADRO Cc1c([C@@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cnn1C(C)(C)C ZINC000556609855 568431166 /nfs/dbraw/zinc/43/11/66/568431166.db2.gz CGXHKYLZSLSKRG-MRXNPFEDSA-N 1 0 355.526 5.119 20 0 FKADRO FC(F)(F)c1cccc([C@@H]([NH2+][C@@H]2CCC23CCC3)C2CCOCC2)c1 ZINC000556610177 568431460 /nfs/dbraw/zinc/43/14/60/568431460.db2.gz UZTRTGUGIFVYLS-MSOLQXFVSA-N 1 0 353.428 5.095 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CCC23CCC3)C2CCOCC2)c1 ZINC000556610178 568431457 /nfs/dbraw/zinc/43/14/57/568431457.db2.gz UZTRTGUGIFVYLS-QZTJIDSGSA-N 1 0 353.428 5.095 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+][C@H]2CCC23CCC3)C2CCOCC2)c1 ZINC000556610180 568431381 /nfs/dbraw/zinc/43/13/81/568431381.db2.gz UZTRTGUGIFVYLS-ZWKOTPCHSA-N 1 0 353.428 5.095 20 0 FKADRO C[C@@H]1CC[C@H]([NH2+][C@@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000556610346 568431383 /nfs/dbraw/zinc/43/13/83/568431383.db2.gz FXKUYNYUMLFSKH-CAYVGHNUSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@@H]1CC[C@H]([NH2+][C@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000556610348 568431370 /nfs/dbraw/zinc/43/13/70/568431370.db2.gz FXKUYNYUMLFSKH-CWVNLOTRSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@@H]1CC[C@@H]([NH2+][C@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000556610349 568431496 /nfs/dbraw/zinc/43/14/96/568431496.db2.gz FXKUYNYUMLFSKH-GBLZOACLSA-N 1 0 371.322 5.523 20 0 FKADRO C[C@@H]1CC[C@@H]([NH2+][C@@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000556610350 568431536 /nfs/dbraw/zinc/43/15/36/568431536.db2.gz FXKUYNYUMLFSKH-SMHULIPUSA-N 1 0 371.322 5.523 20 0 FKADRO CC1(C)C[C@H]([NH2+][C@@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000556610794 568431612 /nfs/dbraw/zinc/43/16/12/568431612.db2.gz HYKRJCJFXFYRMV-RBUKOAKNSA-N 1 0 371.322 5.307 20 0 FKADRO C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(SC2CCCC2)cc1 ZINC000556611312 568432379 /nfs/dbraw/zinc/43/23/79/568432379.db2.gz ZFPOMOZLEWDMDY-INIZCTEOSA-N 1 0 355.551 5.105 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(SC2CCCC2)cc1 ZINC000556611313 568432369 /nfs/dbraw/zinc/43/23/69/568432369.db2.gz ZFPOMOZLEWDMDY-MRXNPFEDSA-N 1 0 355.551 5.105 20 0 FKADRO COc1cc(NC(C)=O)ccc1[C@H](C)[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000556611467 568432605 /nfs/dbraw/zinc/43/26/05/568432605.db2.gz XIRJYYNYLXEVDZ-AWEZNQCLSA-N 1 0 372.896 5.037 20 0 FKADRO COc1cc(NC(C)=O)ccc1[C@@H](C)[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000556611468 568432615 /nfs/dbraw/zinc/43/26/15/568432615.db2.gz XIRJYYNYLXEVDZ-CQSZACIVSA-N 1 0 372.896 5.037 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000556611776 568432783 /nfs/dbraw/zinc/43/27/83/568432783.db2.gz WTMZYADFEYCBAQ-KPZWWZAWSA-N 1 0 354.277 5.127 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000556611777 568432763 /nfs/dbraw/zinc/43/27/63/568432763.db2.gz WTMZYADFEYCBAQ-KZULUSFZSA-N 1 0 354.277 5.127 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000556611778 568432752 /nfs/dbraw/zinc/43/27/52/568432752.db2.gz WTMZYADFEYCBAQ-SGTLLEGYSA-N 1 0 354.277 5.127 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000556611779 568432765 /nfs/dbraw/zinc/43/27/65/568432765.db2.gz WTMZYADFEYCBAQ-XIKOKIGWSA-N 1 0 354.277 5.127 20 0 FKADRO CC[N@H+](Cc1cnn(CC(F)(F)F)c1)C(c1ccccc1)c1ccccc1 ZINC000556817920 568445065 /nfs/dbraw/zinc/44/50/65/568445065.db2.gz DCNMEJFOINWLER-UHFFFAOYSA-N 1 0 373.422 5.057 20 0 FKADRO Cc1cc(C)c(NC(=O)CCC[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000556830734 568445298 /nfs/dbraw/zinc/44/52/98/568445298.db2.gz QHIFWQYKJSGMKQ-FQEVSTJZSA-N 1 0 370.924 5.431 20 0 FKADRO Cc1cc(C)c(NC(=O)CCC[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000556830735 568445255 /nfs/dbraw/zinc/44/52/55/568445255.db2.gz QHIFWQYKJSGMKQ-HXUWFJFHSA-N 1 0 370.924 5.431 20 0 FKADRO Cc1cc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)sc1Br ZINC000556837290 568445246 /nfs/dbraw/zinc/44/52/46/568445246.db2.gz FPXAVYYVRLGWJF-NEPJUHHUSA-N 1 0 356.333 5.008 20 0 FKADRO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)sc1Br ZINC000556837291 568445287 /nfs/dbraw/zinc/44/52/87/568445287.db2.gz FPXAVYYVRLGWJF-NWDGAFQWSA-N 1 0 356.333 5.008 20 0 FKADRO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)sc1Br ZINC000556837292 568445251 /nfs/dbraw/zinc/44/52/51/568445251.db2.gz FPXAVYYVRLGWJF-RYUDHWBXSA-N 1 0 356.333 5.008 20 0 FKADRO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)sc1Br ZINC000556837293 568445290 /nfs/dbraw/zinc/44/52/90/568445290.db2.gz FPXAVYYVRLGWJF-VXGBXAGGSA-N 1 0 356.333 5.008 20 0 FKADRO Fc1ccc(/C=C\C[NH2+]Cc2cccc(COCc3ccco3)c2)cc1F ZINC000556837504 568445463 /nfs/dbraw/zinc/44/54/63/568445463.db2.gz KCHGYMDYWNEQBR-KXFIGUGUSA-N 1 0 369.411 5.078 20 0 FKADRO Fc1ccc(/C=C/C[NH2+]Cc2cccc(COCc3ccco3)c2)cc1F ZINC000556837508 568445480 /nfs/dbraw/zinc/44/54/80/568445480.db2.gz KCHGYMDYWNEQBR-QHHAFSJGSA-N 1 0 369.411 5.078 20 0 FKADRO OCc1ccc(C[NH2+]Cc2cccc(Oc3ccc4ccccc4c3)c2)o1 ZINC000556839943 568445444 /nfs/dbraw/zinc/44/54/44/568445444.db2.gz WRNWGCFWXARDRA-UHFFFAOYSA-N 1 0 359.425 5.007 20 0 FKADRO COc1ccc([C@@H](Cc2ccncc2)[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000556865761 568445843 /nfs/dbraw/zinc/44/58/43/568445843.db2.gz GGRNNQFHDGQABX-BJKOFHAPSA-N 1 0 358.485 5.041 20 0 FKADRO COc1ccc([C@@H](Cc2ccncc2)[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000556865762 568445796 /nfs/dbraw/zinc/44/57/96/568445796.db2.gz GGRNNQFHDGQABX-DNQXCXABSA-N 1 0 358.485 5.041 20 0 FKADRO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000556865763 568445725 /nfs/dbraw/zinc/44/57/25/568445725.db2.gz GGRNNQFHDGQABX-RPWUZVMVSA-N 1 0 358.485 5.041 20 0 FKADRO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000556865764 568445746 /nfs/dbraw/zinc/44/57/46/568445746.db2.gz GGRNNQFHDGQABX-ZEQRLZLVSA-N 1 0 358.485 5.041 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+]Cc2ccccc2COc2ccccc2Cl)c1 ZINC000556868135 568445833 /nfs/dbraw/zinc/44/58/33/568445833.db2.gz HRROUBKLNNZVBZ-KRWDZBQOSA-N 1 0 366.892 5.473 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccccc2COc2ccccc2Cl)c1 ZINC000556868141 568445774 /nfs/dbraw/zinc/44/57/74/568445774.db2.gz HRROUBKLNNZVBZ-QGZVFWFLSA-N 1 0 366.892 5.473 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)c1 ZINC000556869031 568445731 /nfs/dbraw/zinc/44/57/31/568445731.db2.gz DHVGWNQAEJASSA-UONOGXRCSA-N 1 0 363.548 5.447 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)c1 ZINC000556869032 568445756 /nfs/dbraw/zinc/44/57/56/568445756.db2.gz DHVGWNQAEJASSA-ZIAGYGMSSA-N 1 0 363.548 5.447 20 0 FKADRO CC(C)Sc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2-n2ccnn2)cc1 ZINC000556869919 568445738 /nfs/dbraw/zinc/44/57/38/568445738.db2.gz LLISMERYIRXBHP-DLBZAZTESA-N 1 0 366.534 5.180 20 0 FKADRO CC(C)Sc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2-n2ccnn2)cc1 ZINC000556869924 568445799 /nfs/dbraw/zinc/44/57/99/568445799.db2.gz LLISMERYIRXBHP-IAGOWNOFSA-N 1 0 366.534 5.180 20 0 FKADRO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2-n2ccnn2)cc1 ZINC000556869926 568445778 /nfs/dbraw/zinc/44/57/78/568445778.db2.gz LLISMERYIRXBHP-IRXDYDNUSA-N 1 0 366.534 5.180 20 0 FKADRO CC(C)Sc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2-n2ccnn2)cc1 ZINC000556869929 568445812 /nfs/dbraw/zinc/44/58/12/568445812.db2.gz LLISMERYIRXBHP-SJORKVTESA-N 1 0 366.534 5.180 20 0 FKADRO C[C@H](CCc1ccc(F)cc1F)[NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000556870391 568445850 /nfs/dbraw/zinc/44/58/50/568445850.db2.gz NVTRAWKVSYBKIK-GTCCEBARSA-N 1 0 359.460 5.043 20 0 FKADRO C[C@H](CCc1ccc(F)cc1F)[NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000556870412 568445766 /nfs/dbraw/zinc/44/57/66/568445766.db2.gz NVTRAWKVSYBKIK-ZWDAVXSWSA-N 1 0 359.460 5.043 20 0 FKADRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(OC(F)(F)F)cc1 ZINC000556870671 568445848 /nfs/dbraw/zinc/44/58/48/568445848.db2.gz PXQPQGYXZIOFHZ-DLBZAZTESA-N 1 0 351.368 5.019 20 0 FKADRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(OC(F)(F)F)cc1 ZINC000556870681 568445818 /nfs/dbraw/zinc/44/58/18/568445818.db2.gz PXQPQGYXZIOFHZ-IAGOWNOFSA-N 1 0 351.368 5.019 20 0 FKADRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(OC(F)(F)F)cc1 ZINC000556870685 568445782 /nfs/dbraw/zinc/44/57/82/568445782.db2.gz PXQPQGYXZIOFHZ-IRXDYDNUSA-N 1 0 351.368 5.019 20 0 FKADRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(OC(F)(F)F)cc1 ZINC000556870687 568445769 /nfs/dbraw/zinc/44/57/69/568445769.db2.gz PXQPQGYXZIOFHZ-SJORKVTESA-N 1 0 351.368 5.019 20 0 FKADRO CC[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(OC(F)(F)F)cc1 ZINC000556871598 568445751 /nfs/dbraw/zinc/44/57/51/568445751.db2.gz KQNJBUGWLWUVCG-MOPGFXCFSA-N 1 0 367.411 5.140 20 0 FKADRO CC[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(OC(F)(F)F)cc1 ZINC000556871604 568445824 /nfs/dbraw/zinc/44/58/24/568445824.db2.gz KQNJBUGWLWUVCG-OALUTQOASA-N 1 0 367.411 5.140 20 0 FKADRO CC[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(OC(F)(F)F)cc1 ZINC000556871607 568445854 /nfs/dbraw/zinc/44/58/54/568445854.db2.gz KQNJBUGWLWUVCG-RTBURBONSA-N 1 0 367.411 5.140 20 0 FKADRO CCCC[C@H]([NH2+][C@H](C)c1cc(C(=O)OC)cs1)c1ccc(OC)cc1 ZINC000556872672 568445803 /nfs/dbraw/zinc/44/58/03/568445803.db2.gz QNTSHCXPGKFJMV-KDOFPFPSSA-N 1 0 361.507 5.125 20 0 FKADRO CCCC[C@H]([NH2+][C@@H](C)c1cc(C(=O)OC)cs1)c1ccc(OC)cc1 ZINC000556872675 568445910 /nfs/dbraw/zinc/44/59/10/568445910.db2.gz QNTSHCXPGKFJMV-KSSFIOAISA-N 1 0 361.507 5.125 20 0 FKADRO CCCC[C@@H]([NH2+][C@H](C)c1cc(C(=O)OC)cs1)c1ccc(OC)cc1 ZINC000556872678 568445906 /nfs/dbraw/zinc/44/59/06/568445906.db2.gz QNTSHCXPGKFJMV-RDTXWAMCSA-N 1 0 361.507 5.125 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)c1 ZINC000556872876 568445983 /nfs/dbraw/zinc/44/59/83/568445983.db2.gz SAFFQCJTLJRVQJ-OLZOCXBDSA-N 1 0 373.474 5.010 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)c1 ZINC000556872878 568445959 /nfs/dbraw/zinc/44/59/59/568445959.db2.gz SAFFQCJTLJRVQJ-QWHCGFSZSA-N 1 0 373.474 5.010 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)c1 ZINC000556872880 568445977 /nfs/dbraw/zinc/44/59/77/568445977.db2.gz SAFFQCJTLJRVQJ-STQMWFEESA-N 1 0 373.474 5.010 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2oc3ccc(F)cc3c2C)c(C)c1OC ZINC000556873110 568445980 /nfs/dbraw/zinc/44/59/80/568445980.db2.gz UDDRIBJPHBVUDB-AWEZNQCLSA-N 1 0 357.425 5.057 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2oc3ccc(F)cc3c2C)c(C)c1OC ZINC000556873113 568445914 /nfs/dbraw/zinc/44/59/14/568445914.db2.gz UDDRIBJPHBVUDB-CQSZACIVSA-N 1 0 357.425 5.057 20 0 FKADRO CC[C@@H]([NH2+]Cc1cnc2ccccc2c1)c1ccc(OC(F)(F)F)cc1 ZINC000556873702 568445997 /nfs/dbraw/zinc/44/59/97/568445997.db2.gz SEJSXWJGZJYFQX-GOSISDBHSA-N 1 0 360.379 5.374 20 0 FKADRO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2cccc(CC(C)C)c2)c2ccccc2)n1 ZINC000556876375 568446120 /nfs/dbraw/zinc/44/61/20/568446120.db2.gz OXVQEKAFIUHWFJ-HTAPYJJXSA-N 1 0 363.505 5.211 20 0 FKADRO Cc1noc(C[C@H]([NH2+][C@@H](C)c2cccc(CC(C)C)c2)c2ccccc2)n1 ZINC000556876381 568446024 /nfs/dbraw/zinc/44/60/24/568446024.db2.gz OXVQEKAFIUHWFJ-JTSKRJEESA-N 1 0 363.505 5.211 20 0 FKADRO Cc1noc(C[C@@H]([NH2+][C@H](C)c2cccc(CC(C)C)c2)c2ccccc2)n1 ZINC000556876383 568446075 /nfs/dbraw/zinc/44/60/75/568446075.db2.gz OXVQEKAFIUHWFJ-VGOFRKELSA-N 1 0 363.505 5.211 20 0 FKADRO Cc1noc(C[C@H]([NH2+][C@H](C)c2cccc(CC(C)C)c2)c2ccccc2)n1 ZINC000556876386 568446052 /nfs/dbraw/zinc/44/60/52/568446052.db2.gz OXVQEKAFIUHWFJ-VGSWGCGISA-N 1 0 363.505 5.211 20 0 FKADRO CC[C@H]([NH2+]Cc1nc(COC)sc1-c1ccccc1)c1cccc(C)c1 ZINC000556878783 568446098 /nfs/dbraw/zinc/44/60/98/568446098.db2.gz LSOAPDWREKGVAZ-IBGZPJMESA-N 1 0 366.530 5.506 20 0 FKADRO CC[C@@H]([NH2+]Cc1nc(COC)sc1-c1ccccc1)c1cccc(C)c1 ZINC000556878784 568446029 /nfs/dbraw/zinc/44/60/29/568446029.db2.gz LSOAPDWREKGVAZ-LJQANCHMSA-N 1 0 366.530 5.506 20 0 FKADRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1c(OC(C)C)ccc2ccccc21 ZINC000556880147 568446105 /nfs/dbraw/zinc/44/61/05/568446105.db2.gz JOPYPEJJFFFGBF-UHFFFAOYSA-N 1 0 352.478 5.257 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1ncc[nH]1 ZINC000556881045 568446110 /nfs/dbraw/zinc/44/61/10/568446110.db2.gz ZULGNJUJROUKPD-CXAGYDPISA-N 1 0 351.416 5.401 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1ncc[nH]1 ZINC000556881046 568446037 /nfs/dbraw/zinc/44/60/37/568446037.db2.gz ZULGNJUJROUKPD-DYVFJYSZSA-N 1 0 351.416 5.401 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1ncc[nH]1 ZINC000556881047 568446114 /nfs/dbraw/zinc/44/61/14/568446114.db2.gz ZULGNJUJROUKPD-GUYCJALGSA-N 1 0 351.416 5.401 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1)c1ncc[nH]1 ZINC000556881048 568446237 /nfs/dbraw/zinc/44/62/37/568446237.db2.gz ZULGNJUJROUKPD-SUMWQHHRSA-N 1 0 351.416 5.401 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccn1 ZINC000556881418 568446252 /nfs/dbraw/zinc/44/62/52/568446252.db2.gz QRUQBEQQRWARDG-HZPDHXFCSA-N 1 0 351.519 5.542 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccn1 ZINC000556881419 568446186 /nfs/dbraw/zinc/44/61/86/568446186.db2.gz QRUQBEQQRWARDG-JKSUJKDBSA-N 1 0 351.519 5.542 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000556883112 568446181 /nfs/dbraw/zinc/44/61/81/568446181.db2.gz BQCFWTXDGXJXFB-CHWSQXEVSA-N 1 0 351.849 5.217 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000556883115 568446188 /nfs/dbraw/zinc/44/61/88/568446188.db2.gz BQCFWTXDGXJXFB-OLZOCXBDSA-N 1 0 351.849 5.217 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000556883116 568446209 /nfs/dbraw/zinc/44/62/09/568446209.db2.gz BQCFWTXDGXJXFB-QWHCGFSZSA-N 1 0 351.849 5.217 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)c(C)c1OC ZINC000556883117 568446249 /nfs/dbraw/zinc/44/62/49/568446249.db2.gz BQCFWTXDGXJXFB-STQMWFEESA-N 1 0 351.849 5.217 20 0 FKADRO c1nc([C@@H]2CCCO2)sc1C[NH2+]Cc1ccc(C2CCCCC2)cc1 ZINC000556883987 568446217 /nfs/dbraw/zinc/44/62/17/568446217.db2.gz LUZJPRSOKKPNFW-FQEVSTJZSA-N 1 0 356.535 5.332 20 0 FKADRO c1nc([C@H]2CCCO2)sc1C[NH2+]Cc1ccc(C2CCCCC2)cc1 ZINC000556883993 568446213 /nfs/dbraw/zinc/44/62/13/568446213.db2.gz LUZJPRSOKKPNFW-HXUWFJFHSA-N 1 0 356.535 5.332 20 0 FKADRO Cc1ccc(C[NH2+][C@H](CCC(C)C)c2ccoc2)c(OC[C@@H]2CCOC2)c1 ZINC000556884608 568446234 /nfs/dbraw/zinc/44/62/34/568446234.db2.gz LEOMUGXIXOXDAL-DENIHFKCSA-N 1 0 371.521 5.270 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)c(OC[C@@H]2CCOC2)c1 ZINC000556884611 568446190 /nfs/dbraw/zinc/44/61/90/568446190.db2.gz LEOMUGXIXOXDAL-KNQAVFIVSA-N 1 0 371.521 5.270 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)c(OC[C@H]2CCOC2)c1 ZINC000556884615 568446193 /nfs/dbraw/zinc/44/61/93/568446193.db2.gz LEOMUGXIXOXDAL-UGKGYDQZSA-N 1 0 371.521 5.270 20 0 FKADRO CCCCn1cc(C[NH2+][C@H](CC)c2ccc(OC(F)(F)F)cc2)c(C)n1 ZINC000556885983 568446223 /nfs/dbraw/zinc/44/62/23/568446223.db2.gz KDEXTMWJWQQXCT-GOSISDBHSA-N 1 0 369.431 5.131 20 0 FKADRO CCCCn1cc(C[NH2+][C@@H](CC)c2ccc(OC(F)(F)F)cc2)c(C)n1 ZINC000556885986 568446204 /nfs/dbraw/zinc/44/62/04/568446204.db2.gz KDEXTMWJWQQXCT-SFHVURJKSA-N 1 0 369.431 5.131 20 0 FKADRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cnc(-c2ccc(C(C)C)cc2)s1 ZINC000556886143 568446229 /nfs/dbraw/zinc/44/62/29/568446229.db2.gz TZALOZHEHQQFIN-UHFFFAOYSA-N 1 0 369.534 5.563 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000556886895 568446415 /nfs/dbraw/zinc/44/64/15/568446415.db2.gz XEXDUQFKCSPIMY-PBHICJAKSA-N 1 0 371.527 5.231 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)c1 ZINC000556886901 568446359 /nfs/dbraw/zinc/44/63/59/568446359.db2.gz XEXDUQFKCSPIMY-RHSMWYFYSA-N 1 0 371.527 5.231 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)c1 ZINC000556886904 568446428 /nfs/dbraw/zinc/44/64/28/568446428.db2.gz XEXDUQFKCSPIMY-WMLDXEAASA-N 1 0 371.527 5.231 20 0 FKADRO COC(=O)c1csc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000556886906 568446366 /nfs/dbraw/zinc/44/63/66/568446366.db2.gz XEXDUQFKCSPIMY-YOEHRIQHSA-N 1 0 371.527 5.231 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)c(C)c1OC ZINC000556886963 568446377 /nfs/dbraw/zinc/44/63/77/568446377.db2.gz YFZCPWPYVNHKNX-BTYIYWSLSA-N 1 0 357.469 5.262 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)c(C)c1OC ZINC000556886964 568446370 /nfs/dbraw/zinc/44/63/70/568446370.db2.gz YFZCPWPYVNHKNX-QVKFZJNVSA-N 1 0 357.469 5.262 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)c(C)c1OC ZINC000556886966 568446344 /nfs/dbraw/zinc/44/63/44/568446344.db2.gz YFZCPWPYVNHKNX-VFNWGFHPSA-N 1 0 357.469 5.262 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)c(C)c1OC ZINC000556886969 568446418 /nfs/dbraw/zinc/44/64/18/568446418.db2.gz YFZCPWPYVNHKNX-YCRPNKLZSA-N 1 0 357.469 5.262 20 0 FKADRO COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000556887053 568446350 /nfs/dbraw/zinc/44/63/50/568446350.db2.gz PULPSXGFYHWLNI-RUZDIDTESA-N 1 0 372.512 5.431 20 0 FKADRO COc1ccc([C@H](Cc2ccncc2)[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000556887054 568446406 /nfs/dbraw/zinc/44/64/06/568446406.db2.gz PULPSXGFYHWLNI-VWLOTQADSA-N 1 0 372.512 5.431 20 0 FKADRO C[C@H]([NH2+]C1CCC(O)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000556891863 568446533 /nfs/dbraw/zinc/44/65/33/568446533.db2.gz GXUVGXOYUSIWGU-JQRITLKVSA-N 1 0 369.452 5.388 20 0 FKADRO C[C@@H]([NH2+]C1CCC(O)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000556891869 568446556 /nfs/dbraw/zinc/44/65/56/568446556.db2.gz GXUVGXOYUSIWGU-UWTIGNOOSA-N 1 0 369.452 5.388 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@@H](c2cc(F)cc(Br)c2)C2CC2)c1 ZINC000556891923 568446525 /nfs/dbraw/zinc/44/65/25/568446525.db2.gz HWODVTLGEJCGBW-KPZWWZAWSA-N 1 0 363.274 5.094 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2cc(F)cc(Br)c2)C2CC2)c1 ZINC000556891929 568446477 /nfs/dbraw/zinc/44/64/77/568446477.db2.gz HWODVTLGEJCGBW-KZULUSFZSA-N 1 0 363.274 5.094 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@H](c2cc(F)cc(Br)c2)C2CC2)c1 ZINC000556891930 568446560 /nfs/dbraw/zinc/44/65/60/568446560.db2.gz HWODVTLGEJCGBW-SGTLLEGYSA-N 1 0 363.274 5.094 20 0 FKADRO COc1ccc2ccccc2c1-c1cc(C[NH2+][C@H]2CCC[C@@H]2CCF)on1 ZINC000556891945 568446582 /nfs/dbraw/zinc/44/65/82/568446582.db2.gz IQVFJFGMHKFJCO-APWZRJJASA-N 1 0 368.452 5.121 20 0 FKADRO COc1ccc2ccccc2c1-c1cc(C[NH2+][C@H]2CCC[C@H]2CCF)on1 ZINC000556891946 568446529 /nfs/dbraw/zinc/44/65/29/568446529.db2.gz IQVFJFGMHKFJCO-LPHOPBHVSA-N 1 0 368.452 5.121 20 0 FKADRO COc1ccc2ccccc2c1-c1cc(C[NH2+][C@@H]2CCC[C@H]2CCF)on1 ZINC000556891947 568446473 /nfs/dbraw/zinc/44/64/73/568446473.db2.gz IQVFJFGMHKFJCO-QFBILLFUSA-N 1 0 368.452 5.121 20 0 FKADRO COc1ccc2ccccc2c1-c1cc(C[NH2+][C@@H]2CCC[C@@H]2CCF)on1 ZINC000556891948 568446493 /nfs/dbraw/zinc/44/64/93/568446493.db2.gz IQVFJFGMHKFJCO-VQIMIIECSA-N 1 0 368.452 5.121 20 0 FKADRO CC(C)CC[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccoc1 ZINC000556895216 568446480 /nfs/dbraw/zinc/44/64/80/568446480.db2.gz KECJDIUQYIWXBD-HSZRJFAPSA-N 1 0 370.537 5.073 20 0 FKADRO Cc1oc(C2CC2)nc1C(=O)Nc1ccc2[nH]c(C3CCCCC3)nc2c1 ZINC000556895613 568446612 /nfs/dbraw/zinc/44/66/12/568446612.db2.gz QEJREBNIQDBBFC-UHFFFAOYSA-N 1 0 364.449 5.037 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)ccc1SC ZINC000556909345 568447059 /nfs/dbraw/zinc/44/70/59/568447059.db2.gz BYKBGLOEXJXNPX-HNNXBMFYSA-N 1 0 374.525 5.007 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)ccc1SC ZINC000556909346 568447049 /nfs/dbraw/zinc/44/70/49/568447049.db2.gz BYKBGLOEXJXNPX-OAHLLOKOSA-N 1 0 374.525 5.007 20 0 FKADRO CC[C@@H]([NH2+][C@@H]1C[C@H](C)Sc2sccc21)c1ccc(OC)c(OC)c1 ZINC000556910777 568447051 /nfs/dbraw/zinc/44/70/51/568447051.db2.gz GFUFTENTKZCWNM-APHBMKBZSA-N 1 0 363.548 5.432 20 0 FKADRO CC[C@@H]([NH2+][C@H]1C[C@H](C)Sc2sccc21)c1ccc(OC)c(OC)c1 ZINC000556910778 568447061 /nfs/dbraw/zinc/44/70/61/568447061.db2.gz GFUFTENTKZCWNM-MAZHCROVSA-N 1 0 363.548 5.432 20 0 FKADRO CC[C@H]([NH2+][C@H]1C[C@H](C)Sc2sccc21)c1ccc(OC)c(OC)c1 ZINC000556910779 568447018 /nfs/dbraw/zinc/44/70/18/568447018.db2.gz GFUFTENTKZCWNM-RCBQFDQVSA-N 1 0 363.548 5.432 20 0 FKADRO CC[C@H]([NH2+][C@@H]1C[C@H](C)Sc2sccc21)c1ccc(OC)c(OC)c1 ZINC000556910780 568447022 /nfs/dbraw/zinc/44/70/22/568447022.db2.gz GFUFTENTKZCWNM-VBNZEHGJSA-N 1 0 363.548 5.432 20 0 FKADRO CCc1cccnc1[C@@H](C)[NH2+]C[C@H](CCCOC)c1ccc(Cl)cc1 ZINC000556911594 568447147 /nfs/dbraw/zinc/44/71/47/568447147.db2.gz FAHOVXMIXFXVKP-APWZRJJASA-N 1 0 360.929 5.158 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+]C[C@H](CCCOC)c1ccc(Cl)cc1 ZINC000556911595 568447170 /nfs/dbraw/zinc/44/71/70/568447170.db2.gz FAHOVXMIXFXVKP-LPHOPBHVSA-N 1 0 360.929 5.158 20 0 FKADRO CCc1cccnc1[C@H](C)[NH2+]C[C@@H](CCCOC)c1ccc(Cl)cc1 ZINC000556911604 568447158 /nfs/dbraw/zinc/44/71/58/568447158.db2.gz FAHOVXMIXFXVKP-QFBILLFUSA-N 1 0 360.929 5.158 20 0 FKADRO CCc1cccnc1[C@@H](C)[NH2+]C[C@@H](CCCOC)c1ccc(Cl)cc1 ZINC000556911605 568447189 /nfs/dbraw/zinc/44/71/89/568447189.db2.gz FAHOVXMIXFXVKP-VQIMIIECSA-N 1 0 360.929 5.158 20 0 FKADRO Cc1ccccc1COc1ccc([C@H](C)[NH2+]Cc2cnn3ccccc23)cc1 ZINC000556911712 568447214 /nfs/dbraw/zinc/44/72/14/568447214.db2.gz NLNZLXXWNLNSKV-IBGZPJMESA-N 1 0 371.484 5.073 20 0 FKADRO Cc1ccccc1COc1ccc([C@@H](C)[NH2+]Cc2cnn3ccccc23)cc1 ZINC000556911713 568447180 /nfs/dbraw/zinc/44/71/80/568447180.db2.gz NLNZLXXWNLNSKV-LJQANCHMSA-N 1 0 371.484 5.073 20 0 FKADRO COc1cccc(C2([NH2+][C@H](C)c3csc(-c4csc(C)n4)c3)CC2)c1 ZINC000556913682 568447156 /nfs/dbraw/zinc/44/71/56/568447156.db2.gz UDYMPKPHTGWGCN-CYBMUJFWSA-N 1 0 370.543 5.529 20 0 FKADRO COc1cccc(C2([NH2+][C@@H](C)c3csc(-c4csc(C)n4)c3)CC2)c1 ZINC000556913689 568447230 /nfs/dbraw/zinc/44/72/30/568447230.db2.gz UDYMPKPHTGWGCN-ZDUSSCGKSA-N 1 0 370.543 5.529 20 0 FKADRO C[C@H]([NH2+]CCn1ccc2cc(Cl)ccc21)c1nc(C(F)(F)F)cs1 ZINC000556914032 568447206 /nfs/dbraw/zinc/44/72/06/568447206.db2.gz XGTGZJDBDKIGHK-JTQLQIEISA-N 1 0 373.831 5.121 20 0 FKADRO C[C@@H]([NH2+]CCn1ccc2cc(Cl)ccc21)c1nc(C(F)(F)F)cs1 ZINC000556914033 568447222 /nfs/dbraw/zinc/44/72/22/568447222.db2.gz XGTGZJDBDKIGHK-SNVBAGLBSA-N 1 0 373.831 5.121 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)c3ccc(F)c(Br)c3)ccc2[nH]1 ZINC000556914347 568447328 /nfs/dbraw/zinc/44/73/28/568447328.db2.gz ZNDGFWBIMTWCIF-GFCCVEGCSA-N 1 0 361.258 5.229 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)c3ccc(F)c(Br)c3)ccc2[nH]1 ZINC000556914348 568447335 /nfs/dbraw/zinc/44/73/35/568447335.db2.gz ZNDGFWBIMTWCIF-LBPRGKRZSA-N 1 0 361.258 5.229 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000556914442 568447297 /nfs/dbraw/zinc/44/72/97/568447297.db2.gz IOQAWBYDDIXFOI-HNNXBMFYSA-N 1 0 352.478 5.460 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000556914443 568447324 /nfs/dbraw/zinc/44/73/24/568447324.db2.gz IOQAWBYDDIXFOI-OAHLLOKOSA-N 1 0 352.478 5.460 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cn1 ZINC000556915359 568447338 /nfs/dbraw/zinc/44/73/38/568447338.db2.gz PDSSZABBSSPOEH-ACJLOTCBSA-N 1 0 367.415 5.165 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cn1 ZINC000556915360 568447349 /nfs/dbraw/zinc/44/73/49/568447349.db2.gz PDSSZABBSSPOEH-FZKQIMNGSA-N 1 0 367.415 5.165 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cn1 ZINC000556915361 568447326 /nfs/dbraw/zinc/44/73/26/568447326.db2.gz PDSSZABBSSPOEH-SCLBCKFNSA-N 1 0 367.415 5.165 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cn1 ZINC000556915362 568447286 /nfs/dbraw/zinc/44/72/86/568447286.db2.gz PDSSZABBSSPOEH-UGSOOPFHSA-N 1 0 367.415 5.165 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C ZINC000556915570 568447288 /nfs/dbraw/zinc/44/72/88/568447288.db2.gz KLXLPNLGIABCMQ-LLVKDONJSA-N 1 0 352.544 5.461 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C ZINC000556915571 568447340 /nfs/dbraw/zinc/44/73/40/568447340.db2.gz KLXLPNLGIABCMQ-NSHDSACASA-N 1 0 352.544 5.461 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+]CCCc3cccc(C)n3)cs2)cs1 ZINC000556916156 568447414 /nfs/dbraw/zinc/44/74/14/568447414.db2.gz XIOWQWYHZPJZFH-AWEZNQCLSA-N 1 0 357.548 5.167 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+]CCCc3cccc(C)n3)cs2)cs1 ZINC000556916158 568447456 /nfs/dbraw/zinc/44/74/56/568447456.db2.gz XIOWQWYHZPJZFH-CQSZACIVSA-N 1 0 357.548 5.167 20 0 FKADRO Cc1nc(C)c([C@@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)s1 ZINC000556916604 568447514 /nfs/dbraw/zinc/44/75/14/568447514.db2.gz YRCSVBYVNHJPBM-BDJLRTHQSA-N 1 0 370.440 5.460 20 0 FKADRO Cc1nc(C)c([C@@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)s1 ZINC000556916607 568447412 /nfs/dbraw/zinc/44/74/12/568447412.db2.gz YRCSVBYVNHJPBM-BZNIZROVSA-N 1 0 370.440 5.460 20 0 FKADRO Cc1nc(C)c([C@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)s1 ZINC000556916609 568447428 /nfs/dbraw/zinc/44/74/28/568447428.db2.gz YRCSVBYVNHJPBM-MEDUHNTESA-N 1 0 370.440 5.460 20 0 FKADRO Cc1nc(C)c([C@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)s1 ZINC000556916612 568447445 /nfs/dbraw/zinc/44/74/45/568447445.db2.gz YRCSVBYVNHJPBM-ZBEGNZNMSA-N 1 0 370.440 5.460 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2SC)ccc1SC ZINC000556916943 568447479 /nfs/dbraw/zinc/44/74/79/568447479.db2.gz XYWWBZFGZBMFON-GFCCVEGCSA-N 1 0 351.512 5.129 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2c(F)cccc2SC)ccc1SC ZINC000556916948 568447430 /nfs/dbraw/zinc/44/74/30/568447430.db2.gz XYWWBZFGZBMFON-LBPRGKRZSA-N 1 0 351.512 5.129 20 0 FKADRO CC(=O)NC1CCC([NH2+]C2CCC(c3ccc(C(C)(C)C)cc3)CC2)CC1 ZINC000556916966 568447492 /nfs/dbraw/zinc/44/74/92/568447492.db2.gz ZFGXKFHNWWFVCF-UHFFFAOYSA-N 1 0 370.581 5.047 20 0 FKADRO FC(F)(F)c1ccc(C2CC([NH2+]CC3(c4ccccn4)CCC3)C2)cc1 ZINC000556920491 568447620 /nfs/dbraw/zinc/44/76/20/568447620.db2.gz MIISZODEFONOKV-UHFFFAOYSA-N 1 0 360.423 5.058 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000556921715 568447610 /nfs/dbraw/zinc/44/76/10/568447610.db2.gz CFBVATBHKRULSB-HZMBPMFUSA-N 1 0 358.231 5.128 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000556921722 568447556 /nfs/dbraw/zinc/44/75/56/568447556.db2.gz CFBVATBHKRULSB-IINYFYTJSA-N 1 0 358.231 5.128 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000556921724 568447667 /nfs/dbraw/zinc/44/76/67/568447667.db2.gz CFBVATBHKRULSB-QMTHXVAHSA-N 1 0 358.231 5.128 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000556921726 568447632 /nfs/dbraw/zinc/44/76/32/568447632.db2.gz CFBVATBHKRULSB-YGRLFVJLSA-N 1 0 358.231 5.128 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000556922727 568447767 /nfs/dbraw/zinc/44/77/67/568447767.db2.gz KPKDJTGZLBYZFU-KZULUSFZSA-N 1 0 370.345 5.490 20 0 FKADRO CSc1ccc([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000556922728 568447818 /nfs/dbraw/zinc/44/78/18/568447818.db2.gz KPKDJTGZLBYZFU-SGTLLEGYSA-N 1 0 370.345 5.490 20 0 FKADRO CSc1ccc([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000556922730 568447728 /nfs/dbraw/zinc/44/77/28/568447728.db2.gz KPKDJTGZLBYZFU-XIKOKIGWSA-N 1 0 370.345 5.490 20 0 FKADRO OCC[C@@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(Cl)c(Cl)c1 ZINC000556923350 568447828 /nfs/dbraw/zinc/44/78/28/568447828.db2.gz BISBPWOVJOTLMA-CVEARBPZSA-N 1 0 356.318 5.146 20 0 FKADRO OCC[C@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(Cl)c(Cl)c1 ZINC000556923353 568447763 /nfs/dbraw/zinc/44/77/63/568447763.db2.gz BISBPWOVJOTLMA-HOTGVXAUSA-N 1 0 356.318 5.146 20 0 FKADRO OCC[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(Cl)c(Cl)c1 ZINC000556923354 568447756 /nfs/dbraw/zinc/44/77/56/568447756.db2.gz BISBPWOVJOTLMA-HZPDHXFCSA-N 1 0 356.318 5.146 20 0 FKADRO OCC[C@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(Cl)c(Cl)c1 ZINC000556923355 568447782 /nfs/dbraw/zinc/44/77/82/568447782.db2.gz BISBPWOVJOTLMA-JKSUJKDBSA-N 1 0 356.318 5.146 20 0 FKADRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(Cl)cc1 ZINC000556923461 568447812 /nfs/dbraw/zinc/44/78/12/568447812.db2.gz JPZVEXKPLYMZJM-CCQPRUGESA-N 1 0 363.954 5.168 20 0 FKADRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(Cl)cc1 ZINC000556923466 568447750 /nfs/dbraw/zinc/44/77/50/568447750.db2.gz JPZVEXKPLYMZJM-IJHUGTEESA-N 1 0 363.954 5.168 20 0 FKADRO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(Cl)cc1 ZINC000556923468 568447793 /nfs/dbraw/zinc/44/77/93/568447793.db2.gz JPZVEXKPLYMZJM-PFTWBPNJSA-N 1 0 363.954 5.168 20 0 FKADRO OCC[C@H]([NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 ZINC000556924502 568447827 /nfs/dbraw/zinc/44/78/27/568447827.db2.gz LGHJOGNUPFLAKK-HUBLWGQQSA-N 1 0 370.242 5.128 20 0 FKADRO OCC[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 ZINC000556924503 568447834 /nfs/dbraw/zinc/44/78/34/568447834.db2.gz LGHJOGNUPFLAKK-JMSVASOKSA-N 1 0 370.242 5.128 20 0 FKADRO OCC[C@H]([NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 ZINC000556924505 568447804 /nfs/dbraw/zinc/44/78/04/568447804.db2.gz LGHJOGNUPFLAKK-XUJVJEKNSA-N 1 0 370.242 5.128 20 0 FKADRO OCC[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 ZINC000556924506 568447833 /nfs/dbraw/zinc/44/78/33/568447833.db2.gz LGHJOGNUPFLAKK-ZOWXZIJZSA-N 1 0 370.242 5.128 20 0 FKADRO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2cnc(-c3ccncc3)s2)cc1 ZINC000556925986 568447837 /nfs/dbraw/zinc/44/78/37/568447837.db2.gz QSTYOHNSPJXDPI-LJQANCHMSA-N 1 0 353.466 5.071 20 0 FKADRO Cc1cccc(C(C)C)c1NC(=O)N[C@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000556958374 568448875 /nfs/dbraw/zinc/44/88/75/568448875.db2.gz LWZRXYIDNVTMOR-LJQANCHMSA-N 1 0 373.928 5.196 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(C)cc1 ZINC000556961427 568448839 /nfs/dbraw/zinc/44/88/39/568448839.db2.gz NHAGGFDJTPCTIB-GHTZIAJQSA-N 1 0 352.522 5.495 20 0 FKADRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(C)cc1 ZINC000556961430 568448869 /nfs/dbraw/zinc/44/88/69/568448869.db2.gz NHAGGFDJTPCTIB-NQIIRXRSSA-N 1 0 352.522 5.495 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(C)cc1 ZINC000556961431 568448843 /nfs/dbraw/zinc/44/88/43/568448843.db2.gz NHAGGFDJTPCTIB-RXVVDRJESA-N 1 0 352.522 5.495 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(C)cc1 ZINC000556961432 568448872 /nfs/dbraw/zinc/44/88/72/568448872.db2.gz NHAGGFDJTPCTIB-WIYYLYMNSA-N 1 0 352.522 5.495 20 0 FKADRO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000556991336 568449749 /nfs/dbraw/zinc/44/97/49/568449749.db2.gz UKIRYHUNROHIDK-GOSISDBHSA-N 1 0 360.910 5.852 20 0 FKADRO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000556991342 568449763 /nfs/dbraw/zinc/44/97/63/568449763.db2.gz UKIRYHUNROHIDK-SFHVURJKSA-N 1 0 360.910 5.852 20 0 FKADRO CC(C)(C)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000557022737 568440780 /nfs/dbraw/zinc/44/07/80/568440780.db2.gz DASNKIRASKGFBB-NRFANRHFSA-N 1 0 350.506 5.193 20 0 FKADRO CC(C)(C)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000557022738 568440728 /nfs/dbraw/zinc/44/07/28/568440728.db2.gz DASNKIRASKGFBB-OAQYLSRUSA-N 1 0 350.506 5.193 20 0 FKADRO Cc1cc(C)c(NC(=O)[C@H](C)[NH2+][C@@H](c2ccccc2)C2CCC2)c(C)c1 ZINC000557029010 568441123 /nfs/dbraw/zinc/44/11/23/568441123.db2.gz MDHUIQDKLJQFFA-AVRDEDQJSA-N 1 0 350.506 5.070 20 0 FKADRO Cc1cc(C)c(NC(=O)[C@@H](C)[NH2+][C@@H](c2ccccc2)C2CCC2)c(C)c1 ZINC000557029012 568441195 /nfs/dbraw/zinc/44/11/95/568441195.db2.gz MDHUIQDKLJQFFA-GCJKJVERSA-N 1 0 350.506 5.070 20 0 FKADRO Cc1cc(C)c(NC(=O)[C@H](C)[NH2+][C@H](c2ccccc2)C2CCC2)c(C)c1 ZINC000557029014 568441096 /nfs/dbraw/zinc/44/10/96/568441096.db2.gz MDHUIQDKLJQFFA-PGRDOPGGSA-N 1 0 350.506 5.070 20 0 FKADRO Cc1cc(C)c(NC(=O)[C@@H](C)[NH2+][C@H](c2ccccc2)C2CCC2)c(C)c1 ZINC000557029016 568441149 /nfs/dbraw/zinc/44/11/49/568441149.db2.gz MDHUIQDKLJQFFA-XMSQKQJNSA-N 1 0 350.506 5.070 20 0 FKADRO C[C@H](Nc1ccc(NC(=O)CCCC[NH+](C)C)cc1Cl)c1ccccc1 ZINC000557045353 568441565 /nfs/dbraw/zinc/44/15/65/568441565.db2.gz OZNVPLGXNNSLNL-INIZCTEOSA-N 1 0 373.928 5.184 20 0 FKADRO C[C@@H](Nc1ccc(NC(=O)CCCC[NH+](C)C)cc1Cl)c1ccccc1 ZINC000557045359 568441536 /nfs/dbraw/zinc/44/15/36/568441536.db2.gz OZNVPLGXNNSLNL-MRXNPFEDSA-N 1 0 373.928 5.184 20 0 FKADRO C[NH+](C)CCCCC(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000557045941 568441562 /nfs/dbraw/zinc/44/15/62/568441562.db2.gz WGXMQASMCOETSU-UHFFFAOYSA-N 1 0 362.926 5.162 20 0 FKADRO Cc1ccccc1-c1ccc(CN(C(=O)CCCC[NH+](C)C)C(C)C)s1 ZINC000557052788 568441644 /nfs/dbraw/zinc/44/16/44/568441644.db2.gz VTTBQLMPTIDZSC-UHFFFAOYSA-N 1 0 372.578 5.192 20 0 FKADRO CCOc1cc(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)cc2)ccc1O ZINC000557097169 568442475 /nfs/dbraw/zinc/44/24/75/568442475.db2.gz HYWSZMNXIAUJDF-UHFFFAOYSA-N 1 0 367.420 5.012 20 0 FKADRO CCC[N@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000557097604 568442533 /nfs/dbraw/zinc/44/25/33/568442533.db2.gz POUHLEWZWLUNIB-IBGZPJMESA-N 1 0 352.522 5.358 20 0 FKADRO CCC[N@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000557097608 568442513 /nfs/dbraw/zinc/44/25/13/568442513.db2.gz POUHLEWZWLUNIB-LJQANCHMSA-N 1 0 352.522 5.358 20 0 FKADRO Cc1ccc(C[NH2+][C@H]2CCSc3ccc(Br)cc32)s1 ZINC000557169166 568444390 /nfs/dbraw/zinc/44/43/90/568444390.db2.gz INALYHFEWFQODK-AWEZNQCLSA-N 1 0 354.338 5.146 20 0 FKADRO Cc1ccc(C[NH2+][C@@H]2CCSc3ccc(Br)cc32)s1 ZINC000557169169 568444423 /nfs/dbraw/zinc/44/44/23/568444423.db2.gz INALYHFEWFQODK-CQSZACIVSA-N 1 0 354.338 5.146 20 0 FKADRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccccc2Br)c1C ZINC000557169856 568444398 /nfs/dbraw/zinc/44/43/98/568444398.db2.gz MDQIIDPMRLIYQL-UHFFFAOYSA-N 1 0 357.295 5.145 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)cc1OCC ZINC000557170835 568444415 /nfs/dbraw/zinc/44/44/15/568444415.db2.gz WBVDUGFIUPJABX-UHFFFAOYSA-N 1 0 366.505 5.180 20 0 FKADRO CCC[N@H+](Cc1ccccc1)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000557186905 568449216 /nfs/dbraw/zinc/44/92/16/568449216.db2.gz JRQLDOUBBYKXDE-HNNXBMFYSA-N 1 0 355.869 5.363 20 0 FKADRO CCC[N@H+](Cc1ccccc1)[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000557186909 568449219 /nfs/dbraw/zinc/44/92/19/568449219.db2.gz JRQLDOUBBYKXDE-OAHLLOKOSA-N 1 0 355.869 5.363 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000557220358 568456175 /nfs/dbraw/zinc/45/61/75/568456175.db2.gz ZATRWWFHRGYIKH-QGZVFWFLSA-N 1 0 356.535 5.047 20 0 FKADRO C[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)[C@H]1CCc2ccccc21 ZINC000557227482 568456165 /nfs/dbraw/zinc/45/61/65/568456165.db2.gz XIRVFYICLSYZJO-DEOSSOPVSA-N 1 0 370.496 5.302 20 0 FKADRO C[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)[C@@H]1CCc2ccccc21 ZINC000557227486 568456133 /nfs/dbraw/zinc/45/61/33/568456133.db2.gz XIRVFYICLSYZJO-XMMPIXPASA-N 1 0 370.496 5.302 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1nc(-c2ccccc2)cs1 ZINC000557239220 568456268 /nfs/dbraw/zinc/45/62/68/568456268.db2.gz MBUMRIOTKPYNNO-LDQXTDLNSA-N 1 0 364.514 5.239 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1nc(-c2ccccc2)cs1 ZINC000557239222 568456275 /nfs/dbraw/zinc/45/62/75/568456275.db2.gz MBUMRIOTKPYNNO-LRQRDZAKSA-N 1 0 364.514 5.239 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1nc(-c2ccccc2)cs1 ZINC000557239223 568456316 /nfs/dbraw/zinc/45/63/16/568456316.db2.gz MBUMRIOTKPYNNO-NBHGPNQESA-N 1 0 364.514 5.239 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1nc(-c2ccccc2)cs1 ZINC000557239225 568456258 /nfs/dbraw/zinc/45/62/58/568456258.db2.gz MBUMRIOTKPYNNO-SCWSEQNSSA-N 1 0 364.514 5.239 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+]CCOc2ccccc2-c2ccccc2)c1 ZINC000557245875 568456561 /nfs/dbraw/zinc/45/65/61/568456561.db2.gz BYZXBERTZJSRKV-SFHVURJKSA-N 1 0 374.484 5.042 20 0 FKADRO COc1cc(C[NH2+][C@H]2CCCOc3ccccc32)ccc1OC1CCCC1 ZINC000557246699 568456573 /nfs/dbraw/zinc/45/65/73/568456573.db2.gz HPXYSJJKRWUTMM-FQEVSTJZSA-N 1 0 367.489 5.020 20 0 FKADRO COc1cc(C[NH2+][C@@H]2CCCOc3ccccc32)ccc1OC1CCCC1 ZINC000557246700 568456576 /nfs/dbraw/zinc/45/65/76/568456576.db2.gz HPXYSJJKRWUTMM-HXUWFJFHSA-N 1 0 367.489 5.020 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CCc2ccccc21 ZINC000557247316 568456524 /nfs/dbraw/zinc/45/65/24/568456524.db2.gz OKGXAMCRXJVXCS-BFUOFWGJSA-N 1 0 352.478 5.596 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCc2ccccc21 ZINC000557247322 568456527 /nfs/dbraw/zinc/45/65/27/568456527.db2.gz OKGXAMCRXJVXCS-DJJJIMSYSA-N 1 0 352.478 5.596 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCc2ccccc21 ZINC000557247323 568456496 /nfs/dbraw/zinc/45/64/96/568456496.db2.gz OKGXAMCRXJVXCS-ORAYPTAESA-N 1 0 352.478 5.596 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1CCc2ccccc21 ZINC000557247326 568456499 /nfs/dbraw/zinc/45/64/99/568456499.db2.gz OKGXAMCRXJVXCS-YJYMSZOUSA-N 1 0 352.478 5.596 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)C1CCCCC1)c1ccc([S@](C)=O)cc1 ZINC000557248279 568456684 /nfs/dbraw/zinc/45/66/84/568456684.db2.gz ZHRMUAXFXKDGDX-JCNMPKRYSA-N 1 0 355.547 5.396 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1ccc([S@@](C)=O)cc1 ZINC000557248280 568456633 /nfs/dbraw/zinc/45/66/33/568456633.db2.gz ZHRMUAXFXKDGDX-QOKIKDITSA-N 1 0 355.547 5.396 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1ccc([S@](C)=O)cc1 ZINC000557248281 568456662 /nfs/dbraw/zinc/45/66/62/568456662.db2.gz ZHRMUAXFXKDGDX-WVBBGBOVSA-N 1 0 355.547 5.396 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccc2)c1 ZINC000557253251 568456885 /nfs/dbraw/zinc/45/68/85/568456885.db2.gz BKNVLLSJINVOBA-CLOONOSVSA-N 1 0 372.512 5.670 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccc2)c1 ZINC000557253263 568456864 /nfs/dbraw/zinc/45/68/64/568456864.db2.gz BKNVLLSJINVOBA-DFBJGRDBSA-N 1 0 372.512 5.670 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccc2)c1 ZINC000557253267 568456858 /nfs/dbraw/zinc/45/68/58/568456858.db2.gz BKNVLLSJINVOBA-KBMIEXCESA-N 1 0 372.512 5.670 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccc2)c1 ZINC000557253270 568456873 /nfs/dbraw/zinc/45/68/73/568456873.db2.gz BKNVLLSJINVOBA-UQBPGWFLSA-N 1 0 372.512 5.670 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1ccc2ccccc2n1 ZINC000557254506 568456793 /nfs/dbraw/zinc/45/67/93/568456793.db2.gz CSRAFRXSLFIIEB-BFUOFWGJSA-N 1 0 354.906 5.776 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1ccc2ccccc2n1 ZINC000557254511 568456771 /nfs/dbraw/zinc/45/67/71/568456771.db2.gz CSRAFRXSLFIIEB-ORAYPTAESA-N 1 0 354.906 5.776 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1ccc2ccccc2n1 ZINC000557254512 568456768 /nfs/dbraw/zinc/45/67/68/568456768.db2.gz CSRAFRXSLFIIEB-YJYMSZOUSA-N 1 0 354.906 5.776 20 0 FKADRO Cc1nc(-c2ccc([C@@H](C)[NH2+]Cc3cc(C)c(O)c(C)c3)cc2)cs1 ZINC000557254843 568456889 /nfs/dbraw/zinc/45/68/89/568456889.db2.gz HDTNVSLQLASQAM-OAHLLOKOSA-N 1 0 352.503 5.292 20 0 FKADRO C[C@@H]([NH2+]CCCc1nccs1)c1ccc(SCC(F)(F)F)cc1 ZINC000557257426 568456814 /nfs/dbraw/zinc/45/68/14/568456814.db2.gz BSEKSSFAAOCYAL-GFCCVEGCSA-N 1 0 360.470 5.081 20 0 FKADRO C[C@H]([NH2+]CCCc1nccs1)c1ccc(SCC(F)(F)F)cc1 ZINC000557257434 568456871 /nfs/dbraw/zinc/45/68/71/568456871.db2.gz BSEKSSFAAOCYAL-LBPRGKRZSA-N 1 0 360.470 5.081 20 0 FKADRO COc1ccc(Cl)cc1[C@@H](C)NCc1sccc1Br ZINC000557258014 568456882 /nfs/dbraw/zinc/45/68/82/568456882.db2.gz ATCMXFQVPSNFOE-SECBINFHSA-N 1 0 360.704 5.023 20 0 FKADRO COc1ccc(Cl)cc1[C@H](C)NCc1sccc1Br ZINC000557258042 568456804 /nfs/dbraw/zinc/45/68/04/568456804.db2.gz ATCMXFQVPSNFOE-VIFPVBQESA-N 1 0 360.704 5.023 20 0 FKADRO Clc1cccc2c1OCCC[C@H]2NCc1sccc1Br ZINC000557259686 568456790 /nfs/dbraw/zinc/45/67/90/568456790.db2.gz IRMGQUOWOSXYCH-CYBMUJFWSA-N 1 0 372.715 5.168 20 0 FKADRO Clc1cccc2c1OCCC[C@@H]2NCc1sccc1Br ZINC000557259693 568456775 /nfs/dbraw/zinc/45/67/75/568456775.db2.gz IRMGQUOWOSXYCH-ZDUSSCGKSA-N 1 0 372.715 5.168 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCCc1nccs1 ZINC000557261291 568456862 /nfs/dbraw/zinc/45/68/62/568456862.db2.gz XRONALSIUCFEQD-AWEZNQCLSA-N 1 0 357.548 5.167 20 0 FKADRO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCCc1nccs1 ZINC000557261292 568456766 /nfs/dbraw/zinc/45/67/66/568456766.db2.gz XRONALSIUCFEQD-CQSZACIVSA-N 1 0 357.548 5.167 20 0 FKADRO CC[C@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 ZINC000557262317 568456830 /nfs/dbraw/zinc/45/68/30/568456830.db2.gz LNOJZADSEPIHAY-HNNXBMFYSA-N 1 0 369.258 5.061 20 0 FKADRO CC[C@@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 ZINC000557262320 568456757 /nfs/dbraw/zinc/45/67/57/568456757.db2.gz LNOJZADSEPIHAY-OAHLLOKOSA-N 1 0 369.258 5.061 20 0 FKADRO Cc1nc([C@@H](C)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)cs1 ZINC000557262741 568456843 /nfs/dbraw/zinc/45/68/43/568456843.db2.gz OGXLZRAYMDONKR-DLBZAZTESA-N 1 0 366.530 5.751 20 0 FKADRO Cc1nc([C@@H](C)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)cs1 ZINC000557262751 568456847 /nfs/dbraw/zinc/45/68/47/568456847.db2.gz OGXLZRAYMDONKR-IAGOWNOFSA-N 1 0 366.530 5.751 20 0 FKADRO Cc1nc([C@H](C)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)cs1 ZINC000557262755 568456879 /nfs/dbraw/zinc/45/68/79/568456879.db2.gz OGXLZRAYMDONKR-IRXDYDNUSA-N 1 0 366.530 5.751 20 0 FKADRO Cc1nc([C@H](C)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)cs1 ZINC000557262761 568456832 /nfs/dbraw/zinc/45/68/32/568456832.db2.gz OGXLZRAYMDONKR-SJORKVTESA-N 1 0 366.530 5.751 20 0 FKADRO C[C@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1cccc(-c2ccccc2)c1 ZINC000557263341 568456996 /nfs/dbraw/zinc/45/69/96/568456996.db2.gz UJQUHJMEPNEPRA-INIZCTEOSA-N 1 0 362.439 5.031 20 0 FKADRO C[C@@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1cccc(-c2ccccc2)c1 ZINC000557263353 568457001 /nfs/dbraw/zinc/45/70/01/568457001.db2.gz UJQUHJMEPNEPRA-MRXNPFEDSA-N 1 0 362.439 5.031 20 0 FKADRO Fc1cc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)ccc1Br ZINC000557269775 568457006 /nfs/dbraw/zinc/45/70/06/568457006.db2.gz HWVBXSDNQOVIFZ-GFCCVEGCSA-N 1 0 360.679 5.080 20 0 FKADRO Fc1cc(C[NH2+][C@H]2CCc3sc(Cl)cc32)ccc1Br ZINC000557269776 568456955 /nfs/dbraw/zinc/45/69/55/568456955.db2.gz HWVBXSDNQOVIFZ-LBPRGKRZSA-N 1 0 360.679 5.080 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)CCC2 ZINC000557276558 568457062 /nfs/dbraw/zinc/45/70/62/568457062.db2.gz JANRYOMVFWFJNG-DOMZBBRYSA-N 1 0 366.452 5.494 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)CCC2 ZINC000557276559 568457083 /nfs/dbraw/zinc/45/70/83/568457083.db2.gz JANRYOMVFWFJNG-IUODEOHRSA-N 1 0 366.452 5.494 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@H]1CCCC(F)(F)C1)CCC2 ZINC000557276560 568457070 /nfs/dbraw/zinc/45/70/70/568457070.db2.gz JANRYOMVFWFJNG-SWLSCSKDSA-N 1 0 366.452 5.494 20 0 FKADRO Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)CCC2 ZINC000557276561 568457064 /nfs/dbraw/zinc/45/70/64/568457064.db2.gz JANRYOMVFWFJNG-WFASDCNBSA-N 1 0 366.452 5.494 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1CCCC(F)(F)C1 ZINC000557277101 568457079 /nfs/dbraw/zinc/45/70/79/568457079.db2.gz PJOIQJGWLVRQNA-ABAIWWIYSA-N 1 0 354.441 5.486 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000557277105 568457130 /nfs/dbraw/zinc/45/71/30/568457130.db2.gz PJOIQJGWLVRQNA-IAQYHMDHSA-N 1 0 354.441 5.486 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCCC(F)(F)C1 ZINC000557277109 568457110 /nfs/dbraw/zinc/45/71/10/568457110.db2.gz PJOIQJGWLVRQNA-NHYWBVRUSA-N 1 0 354.441 5.486 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000557277110 568457068 /nfs/dbraw/zinc/45/70/68/568457068.db2.gz PJOIQJGWLVRQNA-XHDPSFHLSA-N 1 0 354.441 5.486 20 0 FKADRO FC(F)(F)c1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000557279242 568457121 /nfs/dbraw/zinc/45/71/21/568457121.db2.gz BVEDXCSUQYGBDK-HFTRVMKXSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1ccccc1[C@@H]1CCC[C@H]1[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000557279245 568457081 /nfs/dbraw/zinc/45/70/81/568457081.db2.gz BVEDXCSUQYGBDK-QILLFSRXSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1ccccc1[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000557279247 568457125 /nfs/dbraw/zinc/45/71/25/568457125.db2.gz BVEDXCSUQYGBDK-UWWQBHOKSA-N 1 0 353.428 5.033 20 0 FKADRO FC(F)(F)c1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000557279250 568457077 /nfs/dbraw/zinc/45/70/77/568457077.db2.gz BVEDXCSUQYGBDK-ZVZYQTTQSA-N 1 0 353.428 5.033 20 0 FKADRO CCCCCc1ccc([C@H](CC)[NH2+][C@H]2CCOC3(CCOCC3)C2)cc1 ZINC000557279946 568457050 /nfs/dbraw/zinc/45/70/50/568457050.db2.gz MRKNWGHPLDVIHR-VXKWHMMOSA-N 1 0 359.554 5.188 20 0 FKADRO CCCCCc1ccc([C@H](CC)[NH2+][C@@H]2CCOC3(CCOCC3)C2)cc1 ZINC000557279947 568457135 /nfs/dbraw/zinc/45/71/35/568457135.db2.gz MRKNWGHPLDVIHR-YADHBBJMSA-N 1 0 359.554 5.188 20 0 FKADRO CCC[C@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)cc1Cl ZINC000557280676 568457122 /nfs/dbraw/zinc/45/71/22/568457122.db2.gz VVBBDAUNEXPSTL-QAPCUYQASA-N 1 0 372.336 5.152 20 0 FKADRO CCC[C@H]([NH2+][C@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)cc1Cl ZINC000557280678 568457091 /nfs/dbraw/zinc/45/70/91/568457091.db2.gz VVBBDAUNEXPSTL-YJBOKZPZSA-N 1 0 372.336 5.152 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000557330217 568458050 /nfs/dbraw/zinc/45/80/50/568458050.db2.gz OZBPSWOCZQFXQA-DJJJIMSYSA-N 1 0 368.477 5.180 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000557330219 568458043 /nfs/dbraw/zinc/45/80/43/568458043.db2.gz OZBPSWOCZQFXQA-ORAYPTAESA-N 1 0 368.477 5.180 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000557330222 568457992 /nfs/dbraw/zinc/45/79/92/568457992.db2.gz OZBPSWOCZQFXQA-YJYMSZOUSA-N 1 0 368.477 5.180 20 0 FKADRO CC[N@H+](CC(=O)Nc1ccccc1C)C(c1ccccc1)c1ccccc1 ZINC000557374337 568450222 /nfs/dbraw/zinc/45/02/22/568450222.db2.gz IKUNAZGMNROPNB-UHFFFAOYSA-N 1 0 358.485 5.045 20 0 FKADRO COc1ccc([C@@H]([NH2+]Cc2cccc(COC(C)(C)C)c2)C2CC2)cc1 ZINC000557383048 568450412 /nfs/dbraw/zinc/45/04/12/568450412.db2.gz LFHRKTLPEAAQGR-QFIPXVFZSA-N 1 0 353.506 5.251 20 0 FKADRO CC(C)[C@@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000557384396 568450354 /nfs/dbraw/zinc/45/03/54/568450354.db2.gz JXYMBTJLBKQWOL-CRAIPNDOSA-N 1 0 372.336 5.008 20 0 FKADRO CC(C)[C@@H]([NH2+][C@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000557384397 568450342 /nfs/dbraw/zinc/45/03/42/568450342.db2.gz JXYMBTJLBKQWOL-MAUKXSAKSA-N 1 0 372.336 5.008 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000557384398 568450416 /nfs/dbraw/zinc/45/04/16/568450416.db2.gz JXYMBTJLBKQWOL-QAPCUYQASA-N 1 0 372.336 5.008 20 0 FKADRO CC(C)[C@H]([NH2+][C@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000557384399 568450369 /nfs/dbraw/zinc/45/03/69/568450369.db2.gz JXYMBTJLBKQWOL-YJBOKZPZSA-N 1 0 372.336 5.008 20 0 FKADRO CCCCCc1ccc([C@@H]([NH2+][C@@H]2CCOC3(CCOCC3)C2)C2CC2)cc1 ZINC000557384582 568450425 /nfs/dbraw/zinc/45/04/25/568450425.db2.gz YOJWFHYEMCASEA-DHIUTWEWSA-N 1 0 371.565 5.188 20 0 FKADRO CCCCCc1ccc([C@H]([NH2+][C@H]2CCOC3(CCOCC3)C2)C2CC2)cc1 ZINC000557384583 568450359 /nfs/dbraw/zinc/45/03/59/568450359.db2.gz YOJWFHYEMCASEA-GOTSBHOMSA-N 1 0 371.565 5.188 20 0 FKADRO CCCCCc1ccc([C@H]([NH2+][C@@H]2CCOC3(CCOCC3)C2)C2CC2)cc1 ZINC000557384584 568450331 /nfs/dbraw/zinc/45/03/31/568450331.db2.gz YOJWFHYEMCASEA-PKTZIBPZSA-N 1 0 371.565 5.188 20 0 FKADRO CCCCCc1ccc([C@@H]([NH2+][C@H]2CCOC3(CCOCC3)C2)C2CC2)cc1 ZINC000557384585 568450432 /nfs/dbraw/zinc/45/04/32/568450432.db2.gz YOJWFHYEMCASEA-XZOQPEGZSA-N 1 0 371.565 5.188 20 0 FKADRO C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384681 568450397 /nfs/dbraw/zinc/45/03/97/568450397.db2.gz CQSYPZCIXLVBGW-GHMZBOCLSA-N 1 0 367.802 5.636 20 0 FKADRO C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384683 568450407 /nfs/dbraw/zinc/45/04/07/568450407.db2.gz CQSYPZCIXLVBGW-QWRGUYRKSA-N 1 0 367.802 5.636 20 0 FKADRO C[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384684 568450361 /nfs/dbraw/zinc/45/03/61/568450361.db2.gz CQSYPZCIXLVBGW-WDEREUQCSA-N 1 0 367.802 5.636 20 0 FKADRO Cc1nccn1-c1ccc([C@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1 ZINC000557442133 568451738 /nfs/dbraw/zinc/45/17/38/568451738.db2.gz PFTRJMGIBMQAPI-HNNXBMFYSA-N 1 0 351.881 5.174 20 0 FKADRO Cc1nccn1-c1ccc([C@@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1 ZINC000557442137 568451760 /nfs/dbraw/zinc/45/17/60/568451760.db2.gz PFTRJMGIBMQAPI-OAHLLOKOSA-N 1 0 351.881 5.174 20 0 FKADRO CCc1cccc(CC)c1NC(=O)C[NH2+][C@@H](CC)c1cccc(Cl)c1 ZINC000557461411 568451981 /nfs/dbraw/zinc/45/19/81/568451981.db2.gz OJLOFTQYVOQFII-IBGZPJMESA-N 1 0 358.913 5.144 20 0 FKADRO CCc1cccc(CC)c1NC(=O)C[NH2+][C@H](CC)c1cccc(Cl)c1 ZINC000557461412 568451992 /nfs/dbraw/zinc/45/19/92/568451992.db2.gz OJLOFTQYVOQFII-LJQANCHMSA-N 1 0 358.913 5.144 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2cccc(F)c2F)ccc1OCCC(C)C ZINC000557465447 568452119 /nfs/dbraw/zinc/45/21/19/568452119.db2.gz BYJHSBTUXLXPDM-HNNXBMFYSA-N 1 0 363.448 5.249 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2cccc(F)c2F)ccc1OCCC(C)C ZINC000557465451 568452175 /nfs/dbraw/zinc/45/21/75/568452175.db2.gz BYJHSBTUXLXPDM-OAHLLOKOSA-N 1 0 363.448 5.249 20 0 FKADRO CN(C)C(=O)c1cccc(C[NH2+][C@H](CC2CCCCC2)c2ccccc2)c1 ZINC000557502476 568453192 /nfs/dbraw/zinc/45/31/92/568453192.db2.gz VPSUWHHCASQZTC-HSZRJFAPSA-N 1 0 364.533 5.190 20 0 FKADRO CN(C)C(=O)c1cccc(C[NH2+][C@@H](CC2CCCCC2)c2ccccc2)c1 ZINC000557502477 568453298 /nfs/dbraw/zinc/45/32/98/568453298.db2.gz VPSUWHHCASQZTC-QHCPKHFHSA-N 1 0 364.533 5.190 20 0 FKADRO CC(C)(C)c1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000557515670 568453641 /nfs/dbraw/zinc/45/36/41/568453641.db2.gz CWDSYBDDMNVEBN-UHFFFAOYSA-N 1 0 357.925 5.433 20 0 FKADRO FC(F)(F)Cn1ccnc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000557515723 568453735 /nfs/dbraw/zinc/45/37/35/568453735.db2.gz BHUFNGNAJZUMTQ-QGZVFWFLSA-N 1 0 371.834 5.120 20 0 FKADRO C[C@@H]([NH2+]C1CC(c2cc(F)cc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000557521418 568453929 /nfs/dbraw/zinc/45/39/29/568453929.db2.gz BKFJCQIXLQIDEL-QCGKTTIDSA-N 1 0 371.456 5.080 20 0 FKADRO C[C@H]([NH2+]C1CC(c2cc(F)cc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000557521421 568453934 /nfs/dbraw/zinc/45/39/34/568453934.db2.gz BKFJCQIXLQIDEL-RTYYOJRZSA-N 1 0 371.456 5.080 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2ccccc2F)cc1O ZINC000557528421 568454123 /nfs/dbraw/zinc/45/41/23/568454123.db2.gz BBCPGTRODNQOCG-HRAATJIYSA-N 1 0 365.448 5.175 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2ccccc2F)cc1O ZINC000557528422 568454120 /nfs/dbraw/zinc/45/41/20/568454120.db2.gz BBCPGTRODNQOCG-IERDGZPVSA-N 1 0 365.448 5.175 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2ccccc2F)cc1O ZINC000557528423 568454104 /nfs/dbraw/zinc/45/41/04/568454104.db2.gz BBCPGTRODNQOCG-IIBYNOLFSA-N 1 0 365.448 5.175 20 0 FKADRO Cc1cccc([C@@H]([NH2+]Cc2ccc(Oc3ccccc3)nn2)C(C)(C)C)c1 ZINC000557558787 568454660 /nfs/dbraw/zinc/45/46/60/568454660.db2.gz DZGYMUMAVAIYSQ-JOCHJYFZSA-N 1 0 361.489 5.454 20 0 FKADRO Cc1cccc([C@H]([NH2+]Cc2ccc(Oc3ccccc3)nn2)C(C)(C)C)c1 ZINC000557558792 568454745 /nfs/dbraw/zinc/45/47/45/568454745.db2.gz DZGYMUMAVAIYSQ-QFIPXVFZSA-N 1 0 361.489 5.454 20 0 FKADRO COC1(C)CCN([C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000557571400 568455060 /nfs/dbraw/zinc/45/50/60/568455060.db2.gz VVRRJHJYPLPMLU-LLVKDONJSA-N 1 0 369.349 5.286 20 0 FKADRO COC1(C)CCN([C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000557571413 568455119 /nfs/dbraw/zinc/45/51/19/568455119.db2.gz VVRRJHJYPLPMLU-NSHDSACASA-N 1 0 369.349 5.286 20 0 FKADRO O=C(CC[N@@H+]1CCC[C@H]1c1ccccc1)Nc1ccccc1-c1ccccc1 ZINC000557652953 568458847 /nfs/dbraw/zinc/45/88/47/568458847.db2.gz MMTRTOUSADEDPS-DEOSSOPVSA-N 1 0 370.496 5.519 20 0 FKADRO O=C(CC[N@@H+]1CCC[C@@H]1c1ccccc1)Nc1ccccc1-c1ccccc1 ZINC000557652955 568458933 /nfs/dbraw/zinc/45/89/33/568458933.db2.gz MMTRTOUSADEDPS-XMMPIXPASA-N 1 0 370.496 5.519 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3cnc(C4CCCC4)s3)CC2)c1 ZINC000557663764 568459050 /nfs/dbraw/zinc/45/90/50/568459050.db2.gz DMCLNIUDGBCDIV-UHFFFAOYSA-N 1 0 366.452 5.598 20 0 FKADRO Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000557664077 568459048 /nfs/dbraw/zinc/45/90/48/568459048.db2.gz IDNFDIHYNTZOGY-UHFFFAOYSA-N 1 0 365.443 5.053 20 0 FKADRO FC(F)(F)c1cccc(C2([NH2+]Cc3cccc(-c4ccncc4)c3)CC2)c1 ZINC000557665040 568458991 /nfs/dbraw/zinc/45/89/91/568458991.db2.gz QDEVMCCNHXCKGK-UHFFFAOYSA-N 1 0 368.402 5.546 20 0 FKADRO CCc1ccc(-c2ccc(C[NH2+]Cc3ccccc3Cn3ccnc3)o2)cc1 ZINC000557684591 568459407 /nfs/dbraw/zinc/45/94/07/568459407.db2.gz FVHCRFQDXNCEMH-UHFFFAOYSA-N 1 0 371.484 5.044 20 0 FKADRO CC(C)(C)C[C@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccccc1 ZINC000557699129 568459619 /nfs/dbraw/zinc/45/96/19/568459619.db2.gz KPUXLFKPKIVTFN-IBGZPJMESA-N 1 0 351.519 5.472 20 0 FKADRO CC(C)(C)C[C@@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccccc1 ZINC000557699130 568459643 /nfs/dbraw/zinc/45/96/43/568459643.db2.gz KPUXLFKPKIVTFN-LJQANCHMSA-N 1 0 351.519 5.472 20 0 FKADRO COc1ncc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1Cl ZINC000557709711 568459734 /nfs/dbraw/zinc/45/97/34/568459734.db2.gz QEYNPBXRCSJRNP-INIZCTEOSA-N 1 0 370.802 5.003 20 0 FKADRO Cc1cc([C@H](C)[NH2+]Cc2cccc(NC(=O)c3ccc(C)cc3)c2)c(C)o1 ZINC000557726381 568460018 /nfs/dbraw/zinc/46/00/18/568460018.db2.gz OSYMBCMPWYZNMO-KRWDZBQOSA-N 1 0 362.473 5.308 20 0 FKADRO Cc1cc([C@@H](C)[NH2+]Cc2cccc(NC(=O)c3ccc(C)cc3)c2)c(C)o1 ZINC000557726384 568460003 /nfs/dbraw/zinc/46/00/03/568460003.db2.gz OSYMBCMPWYZNMO-QGZVFWFLSA-N 1 0 362.473 5.308 20 0 FKADRO C[C@@H](Nc1cc[nH+]c2cc(C(F)(F)F)ccc12)c1c(F)cncc1F ZINC000557752464 568460420 /nfs/dbraw/zinc/46/04/20/568460420.db2.gz XHJLGAADSHNTLD-SECBINFHSA-N 1 0 353.294 5.100 20 0 FKADRO C[C@H](Nc1cc[nH+]c2cc(C(F)(F)F)ccc12)c1c(F)cncc1F ZINC000557752465 568460448 /nfs/dbraw/zinc/46/04/48/568460448.db2.gz XHJLGAADSHNTLD-VIFPVBQESA-N 1 0 353.294 5.100 20 0 FKADRO CCOc1cc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)cc(Cl)c1O ZINC000557755442 568460599 /nfs/dbraw/zinc/46/05/99/568460599.db2.gz DXIBJRAAJOIWIN-GOSISDBHSA-N 1 0 368.304 5.585 20 0 FKADRO CCOc1cc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)cc(Cl)c1O ZINC000557755447 568460541 /nfs/dbraw/zinc/46/05/41/568460541.db2.gz DXIBJRAAJOIWIN-SFHVURJKSA-N 1 0 368.304 5.585 20 0 FKADRO CC(C)(C)[C@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccc(F)cc1 ZINC000557757342 568460642 /nfs/dbraw/zinc/46/06/42/568460642.db2.gz WPIKJOCDZJSZDA-GOSISDBHSA-N 1 0 355.482 5.221 20 0 FKADRO CC(C)(C)[C@@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccc(F)cc1 ZINC000557757346 568460536 /nfs/dbraw/zinc/46/05/36/568460536.db2.gz WPIKJOCDZJSZDA-SFHVURJKSA-N 1 0 355.482 5.221 20 0 FKADRO CC(C)(C)C[C@@H]([NH2+]Cc1ccccc1Cn1ccnc1)c1ccc(F)cc1 ZINC000557767668 568460712 /nfs/dbraw/zinc/46/07/12/568460712.db2.gz FUCYAHDCECIZNR-JOCHJYFZSA-N 1 0 365.496 5.338 20 0 FKADRO CC(C)(C)C[C@H]([NH2+]Cc1ccccc1Cn1ccnc1)c1ccc(F)cc1 ZINC000557767677 568460767 /nfs/dbraw/zinc/46/07/67/568460767.db2.gz FUCYAHDCECIZNR-QFIPXVFZSA-N 1 0 365.496 5.338 20 0 FKADRO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000557770313 568460676 /nfs/dbraw/zinc/46/06/76/568460676.db2.gz YIQBWNJUSMMLIY-SFHVURJKSA-N 1 0 373.500 5.399 20 0 FKADRO FC(F)(F)c1ccc(C2([NH2+]Cc3ccc(Cl)cn3)CCCC2)cc1 ZINC000557772377 568460876 /nfs/dbraw/zinc/46/08/76/568460876.db2.gz NUTCGFJLTJMCBO-UHFFFAOYSA-N 1 0 354.803 5.313 20 0 FKADRO CCCC[C@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccc(OC)cc1 ZINC000557781596 568461091 /nfs/dbraw/zinc/46/10/91/568461091.db2.gz BYLGXXPKFZHSML-FQEVSTJZSA-N 1 0 367.518 5.235 20 0 FKADRO CCCC[C@@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1ccc(OC)cc1 ZINC000557781597 568461106 /nfs/dbraw/zinc/46/11/06/568461106.db2.gz BYLGXXPKFZHSML-HXUWFJFHSA-N 1 0 367.518 5.235 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1cc(F)cc(Br)c1 ZINC000557782974 568461139 /nfs/dbraw/zinc/46/11/39/568461139.db2.gz PJEGNPGMFOCBMR-APPDUMDISA-N 1 0 352.247 5.096 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cccc(O)c1)c1cc(F)cc(Br)c1 ZINC000557782976 568461095 /nfs/dbraw/zinc/46/10/95/568461095.db2.gz PJEGNPGMFOCBMR-DIFFPNOSSA-N 1 0 352.247 5.096 20 0 FKADRO CC(C)([NH2+]Cc1cc(-c2ccccc2)n[nH]1)c1cccc(C(F)(F)F)c1 ZINC000557789036 568461155 /nfs/dbraw/zinc/46/11/55/568461155.db2.gz ALVWRKLEPNJXKI-UHFFFAOYSA-N 1 0 359.395 5.120 20 0 FKADRO CC(C)(C)C[C@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)cc1 ZINC000557791472 568461233 /nfs/dbraw/zinc/46/12/33/568461233.db2.gz GFGJRYWSVAEJRI-MOPGFXCFSA-N 1 0 365.945 5.135 20 0 FKADRO CC(C)(C)C[C@@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccc(Cl)cc1 ZINC000557791481 568461292 /nfs/dbraw/zinc/46/12/92/568461292.db2.gz GFGJRYWSVAEJRI-RTBURBONSA-N 1 0 365.945 5.135 20 0 FKADRO Cc1cccc(COc2ccc([C@@H](C)[NH2+]Cc3ccc(Cl)cn3)cc2)c1 ZINC000557792519 568461280 /nfs/dbraw/zinc/46/12/80/568461280.db2.gz UGTBFHUWLLBPPU-QGZVFWFLSA-N 1 0 366.892 5.473 20 0 FKADRO Clc1ccc(C2([NH2+]Cc3cnc(-c4ccncc4)s3)CCCC2)cc1 ZINC000557799771 568461393 /nfs/dbraw/zinc/46/13/93/568461393.db2.gz CICDJYZDFRKXDE-UHFFFAOYSA-N 1 0 369.921 5.418 20 0 FKADRO CCc1ncc(C[NH2+]Cc2ccccc2COc2ccccc2Cl)s1 ZINC000557800226 568461403 /nfs/dbraw/zinc/46/14/03/568461403.db2.gz PPZAWSDDLCZHAG-UHFFFAOYSA-N 1 0 372.921 5.228 20 0 FKADRO CCn1ccnc1CN[C@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805996 568461363 /nfs/dbraw/zinc/46/13/63/568461363.db2.gz KDUJLRSGEVYJMH-NRFANRHFSA-N 1 0 353.897 5.052 20 0 FKADRO CCn1ccnc1CN[C@@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805997 568461316 /nfs/dbraw/zinc/46/13/16/568461316.db2.gz KDUJLRSGEVYJMH-OAQYLSRUSA-N 1 0 353.897 5.052 20 0 FKADRO FC(F)(F)CCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000557828240 568461918 /nfs/dbraw/zinc/46/19/18/568461918.db2.gz RNHBKRTUSYGMHN-UHFFFAOYSA-N 1 0 365.424 5.033 20 0 FKADRO C[C@H](Cc1ccoc1)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000557843894 568462039 /nfs/dbraw/zinc/46/20/39/568462039.db2.gz GXAIVNFGJVPFIF-GFCCVEGCSA-N 1 0 366.408 5.143 20 0 FKADRO C[C@@H](Cc1ccoc1)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000557843902 568462086 /nfs/dbraw/zinc/46/20/86/568462086.db2.gz GXAIVNFGJVPFIF-LBPRGKRZSA-N 1 0 366.408 5.143 20 0 FKADRO COc1ccc(C2([NH2+]Cc3ccc(-c4ccccc4Cl)o3)CC2)cc1 ZINC000557857914 568462251 /nfs/dbraw/zinc/46/22/51/568462251.db2.gz OSNMIUVRFCGVDY-UHFFFAOYSA-N 1 0 353.849 5.388 20 0 FKADRO CC(=O)N(c1nc(C[NH2+]CC2(C)CCCCC2)cs1)c1ccc(C)cc1 ZINC000557858281 568462296 /nfs/dbraw/zinc/46/22/96/568462296.db2.gz ZRRAGOVGLFPBAD-UHFFFAOYSA-N 1 0 371.550 5.196 20 0 FKADRO CC(C)[NH+]1CCC(Nc2cc(C(F)F)nc3ccc(Cl)cc32)CC1 ZINC000557997863 568465939 /nfs/dbraw/zinc/46/59/39/568465939.db2.gz KMIDHADNLSOLMT-UHFFFAOYSA-N 1 0 353.844 5.111 20 0 FKADRO FC(F)c1cccc(-c2nc(-c3cccc(C[NH+]4CCCCC4)c3)no2)c1 ZINC000558009803 568458657 /nfs/dbraw/zinc/45/86/57/568458657.db2.gz DHTICRDQDDOYAX-UHFFFAOYSA-N 1 0 369.415 5.327 20 0 FKADRO Cc1n[nH]cc1CCC[NH2+][C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000558071359 568463158 /nfs/dbraw/zinc/46/31/58/568463158.db2.gz CYTDKBDVISUHHI-CYBMUJFWSA-N 1 0 374.941 5.087 20 0 FKADRO Cc1n[nH]cc1CCC[NH2+][C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000558071360 568463155 /nfs/dbraw/zinc/46/31/55/568463155.db2.gz CYTDKBDVISUHHI-ZDUSSCGKSA-N 1 0 374.941 5.087 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000558079734 568464502 /nfs/dbraw/zinc/46/45/02/568464502.db2.gz CEIUAYASTUBDBS-AWEZNQCLSA-N 1 0 369.921 5.507 20 0 FKADRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000558079736 568464496 /nfs/dbraw/zinc/46/44/96/568464496.db2.gz CEIUAYASTUBDBS-CQSZACIVSA-N 1 0 369.921 5.507 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1nccn1-c1ccccc1 ZINC000558092047 568471499 /nfs/dbraw/zinc/47/14/99/568471499.db2.gz JYTMIPFVARPBDU-FOIQADDNSA-N 1 0 351.881 5.328 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1nccn1-c1ccccc1 ZINC000558092048 568471513 /nfs/dbraw/zinc/47/15/13/568471513.db2.gz JYTMIPFVARPBDU-MGPUTAFESA-N 1 0 351.881 5.328 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1nccn1-c1ccccc1 ZINC000558092049 568471567 /nfs/dbraw/zinc/47/15/67/568471567.db2.gz JYTMIPFVARPBDU-QRWLVFNGSA-N 1 0 351.881 5.328 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1nccn1-c1ccccc1 ZINC000558092050 568471522 /nfs/dbraw/zinc/47/15/22/568471522.db2.gz JYTMIPFVARPBDU-YWZLYKJASA-N 1 0 351.881 5.328 20 0 FKADRO c1ccc(CSc2cccc(C[NH2+][C@@H](c3cccnc3)C3CC3)c2)cc1 ZINC000558093613 568471572 /nfs/dbraw/zinc/47/15/72/568471572.db2.gz SDWKQJHFHAWJRZ-HSZRJFAPSA-N 1 0 360.526 5.615 20 0 FKADRO c1ccc(CSc2cccc(C[NH2+][C@H](c3cccnc3)C3CC3)c2)cc1 ZINC000558093614 568471560 /nfs/dbraw/zinc/47/15/60/568471560.db2.gz SDWKQJHFHAWJRZ-QHCPKHFHSA-N 1 0 360.526 5.615 20 0 FKADRO Cc1nc(CN2CCC[C@@H]2c2cccnc2)oc1-c1ccc(Cl)cc1 ZINC000558100187 568471709 /nfs/dbraw/zinc/47/17/09/568471709.db2.gz JALVMFRBHCNJDZ-GOSISDBHSA-N 1 0 353.853 5.036 20 0 FKADRO Cc1nc(CN2CCC[C@H]2c2cccnc2)oc1-c1ccc(Cl)cc1 ZINC000558100190 568471667 /nfs/dbraw/zinc/47/16/67/568471667.db2.gz JALVMFRBHCNJDZ-SFHVURJKSA-N 1 0 353.853 5.036 20 0 FKADRO Clc1ccc(-c2nc(CN3CCC[C@@H]3c3cccnc3)cs2)cc1 ZINC000558100849 568471712 /nfs/dbraw/zinc/47/17/12/568471712.db2.gz NUCISIYWBSFJSJ-GOSISDBHSA-N 1 0 355.894 5.196 20 0 FKADRO Clc1ccc(-c2nc(CN3CCC[C@H]3c3cccnc3)cs2)cc1 ZINC000558100850 568471682 /nfs/dbraw/zinc/47/16/82/568471682.db2.gz NUCISIYWBSFJSJ-SFHVURJKSA-N 1 0 355.894 5.196 20 0 FKADRO Clc1ccccc1-c1csc(CN2CCC[C@@H]2c2cccnc2)n1 ZINC000558102513 568471692 /nfs/dbraw/zinc/47/16/92/568471692.db2.gz DSNLPXRIQOCBTA-GOSISDBHSA-N 1 0 355.894 5.196 20 0 FKADRO Clc1ccccc1-c1csc(CN2CCC[C@H]2c2cccnc2)n1 ZINC000558102514 568471674 /nfs/dbraw/zinc/47/16/74/568471674.db2.gz DSNLPXRIQOCBTA-SFHVURJKSA-N 1 0 355.894 5.196 20 0 FKADRO Cc1nc(C(C)(C)NCc2cc(F)c(C(F)(F)F)cc2F)sc1C ZINC000558102650 568471705 /nfs/dbraw/zinc/47/17/05/568471705.db2.gz VWTYEEPZHGKURO-UHFFFAOYSA-N 1 0 364.383 5.082 20 0 FKADRO Cc1cccnc1[C@@H](NCc1cc(F)c(C(F)(F)F)cc1F)C(C)C ZINC000558102805 568471689 /nfs/dbraw/zinc/47/16/89/568471689.db2.gz JOOQTILDZVMOOB-INIZCTEOSA-N 1 0 358.354 5.174 20 0 FKADRO Cc1cccnc1[C@H](NCc1cc(F)c(C(F)(F)F)cc1F)C(C)C ZINC000558102806 568471646 /nfs/dbraw/zinc/47/16/46/568471646.db2.gz JOOQTILDZVMOOB-MRXNPFEDSA-N 1 0 358.354 5.174 20 0 FKADRO COc1ccc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)c(C)c1OC ZINC000558103940 568471733 /nfs/dbraw/zinc/47/17/33/568471733.db2.gz KEQFREDXPUDMKT-JOCHJYFZSA-N 1 0 365.448 5.031 20 0 FKADRO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)c(C)c1OC ZINC000558103949 568471837 /nfs/dbraw/zinc/47/18/37/568471837.db2.gz KEQFREDXPUDMKT-QFIPXVFZSA-N 1 0 365.448 5.031 20 0 FKADRO Fc1ccc(C[N@H+](CC2CCC(C(F)(F)F)CC2)C2CCOCC2)cc1 ZINC000558115626 568472008 /nfs/dbraw/zinc/47/20/08/568472008.db2.gz RIPMICFBOKTNCP-UHFFFAOYSA-N 1 0 373.434 5.175 20 0 FKADRO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000558116365 568472049 /nfs/dbraw/zinc/47/20/49/568472049.db2.gz IUFSQEIZSBRDSY-IFXJQAMLSA-N 1 0 362.876 5.101 20 0 FKADRO Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000558116366 568472062 /nfs/dbraw/zinc/47/20/62/568472062.db2.gz IUFSQEIZSBRDSY-KUHUBIRLSA-N 1 0 362.876 5.101 20 0 FKADRO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000558116368 568471974 /nfs/dbraw/zinc/47/19/74/568471974.db2.gz IUFSQEIZSBRDSY-LIRRHRJNSA-N 1 0 362.876 5.101 20 0 FKADRO Clc1ccc(Cl)c(-c2csc(C[NH2+]C[C@H]3CCCSC3)n2)c1 ZINC000558117972 568472080 /nfs/dbraw/zinc/47/20/80/568472080.db2.gz HXKCFYCEIYWXBN-LLVKDONJSA-N 1 0 373.374 5.350 20 0 FKADRO Clc1ccc(Cl)c(-c2csc(C[NH2+]C[C@@H]3CCCSC3)n2)c1 ZINC000558117973 568472022 /nfs/dbraw/zinc/47/20/22/568472022.db2.gz HXKCFYCEIYWXBN-NSHDSACASA-N 1 0 373.374 5.350 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(C(F)(F)F)c2)c(C)c1OC ZINC000558119295 568472109 /nfs/dbraw/zinc/47/21/09/568472109.db2.gz CQSFCCWPJGEYBS-GFCCVEGCSA-N 1 0 371.374 5.021 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(C(F)(F)F)c2)c(C)c1OC ZINC000558119298 568472026 /nfs/dbraw/zinc/47/20/26/568472026.db2.gz CQSFCCWPJGEYBS-LBPRGKRZSA-N 1 0 371.374 5.021 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccc(Oc2cccnc2)cc1 ZINC000558119397 568472030 /nfs/dbraw/zinc/47/20/30/568472030.db2.gz GARNZXJKADKNMC-CQSZACIVSA-N 1 0 351.475 5.059 20 0 FKADRO COC[C@@H]([NH2+]Cc1cnc(-c2ccc(C)cc2)s1)c1cccc(Cl)c1 ZINC000558123401 568472174 /nfs/dbraw/zinc/47/21/74/568472174.db2.gz ZWTCPVYKJFVNCH-LJQANCHMSA-N 1 0 372.921 5.249 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+]Cc2cccc(SCc3ccccc3)c2)cn1 ZINC000558124805 568472201 /nfs/dbraw/zinc/47/22/01/568472201.db2.gz SFSJKTUVEDSVPV-GOSISDBHSA-N 1 0 365.546 5.607 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+]Cc2cccc(SCc3ccccc3)c2)cn1 ZINC000558124806 568472232 /nfs/dbraw/zinc/47/22/32/568472232.db2.gz SFSJKTUVEDSVPV-SFHVURJKSA-N 1 0 365.546 5.607 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]Cc1cncc(F)c1 ZINC000558126067 568472227 /nfs/dbraw/zinc/47/22/27/568472227.db2.gz NGUGMQIHDFRYKS-LLVKDONJSA-N 1 0 361.873 5.157 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]Cc1cncc(F)c1 ZINC000558126069 568472255 /nfs/dbraw/zinc/47/22/55/568472255.db2.gz NGUGMQIHDFRYKS-NSHDSACASA-N 1 0 361.873 5.157 20 0 FKADRO FC(F)(F)C1CCC(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)CC1 ZINC000558127320 568472130 /nfs/dbraw/zinc/47/21/30/568472130.db2.gz PLSUXPOIOPZEML-AVVWSFFYSA-N 1 0 371.447 5.233 20 0 FKADRO FC(F)(F)C1CCC(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)CC1 ZINC000558127326 568472252 /nfs/dbraw/zinc/47/22/52/568472252.db2.gz PLSUXPOIOPZEML-BCLQGDPASA-N 1 0 371.447 5.233 20 0 FKADRO CC(C)Cc1ncc(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)s1 ZINC000558129595 568472153 /nfs/dbraw/zinc/47/21/53/568472153.db2.gz CFIFIFHCQUDGRG-MRXNPFEDSA-N 1 0 367.518 5.380 20 0 FKADRO COCCOCc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)cc1 ZINC000558132540 568472342 /nfs/dbraw/zinc/47/23/42/568472342.db2.gz RZNGIJUDXTZXBC-JOCHJYFZSA-N 1 0 373.924 5.134 20 0 FKADRO COCCOCc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)cc1 ZINC000558132541 568472295 /nfs/dbraw/zinc/47/22/95/568472295.db2.gz RZNGIJUDXTZXBC-QFIPXVFZSA-N 1 0 373.924 5.134 20 0 FKADRO Cc1[nH]c2ccccc2c1C1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000558150987 568472435 /nfs/dbraw/zinc/47/24/35/568472435.db2.gz VIYSWVPRDDSJBK-UHFFFAOYSA-N 1 0 351.519 5.190 20 0 FKADRO Cc1nn(-c2ccccc2)c(C)c1C[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000558152066 568472477 /nfs/dbraw/zinc/47/24/77/568472477.db2.gz JKSKZBFLRIEASX-HSZRJFAPSA-N 1 0 370.500 5.138 20 0 FKADRO Cc1nn(-c2ccccc2)c(C)c1C[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000558152068 568472484 /nfs/dbraw/zinc/47/24/84/568472484.db2.gz JKSKZBFLRIEASX-QHCPKHFHSA-N 1 0 370.500 5.138 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)c1cccc(OC(F)F)c1 ZINC000558152599 568472461 /nfs/dbraw/zinc/47/24/61/568472461.db2.gz TWXKHGWGJPGCSN-BFUOFWGJSA-N 1 0 356.416 5.498 20 0 FKADRO C[C@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)c1cccc(OC(F)F)c1 ZINC000558152600 568472456 /nfs/dbraw/zinc/47/24/56/568472456.db2.gz TWXKHGWGJPGCSN-DJJJIMSYSA-N 1 0 356.416 5.498 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)c1cccc(OC(F)F)c1 ZINC000558152601 568472468 /nfs/dbraw/zinc/47/24/68/568472468.db2.gz TWXKHGWGJPGCSN-ORAYPTAESA-N 1 0 356.416 5.498 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)c1cccc(OC(F)F)c1 ZINC000558152602 568472609 /nfs/dbraw/zinc/47/26/09/568472609.db2.gz TWXKHGWGJPGCSN-YJYMSZOUSA-N 1 0 356.416 5.498 20 0 FKADRO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H]3CCc4c3ccc(OC)c4F)oc21 ZINC000558152668 568472576 /nfs/dbraw/zinc/47/25/76/568472576.db2.gz VKVNNYRWFSEYBA-CXAGYDPISA-N 1 0 369.436 5.317 20 0 FKADRO CCOc1cccc2cc([C@@H](C)[NH2+][C@H]3CCc4c3ccc(OC)c4F)oc21 ZINC000558152672 568472558 /nfs/dbraw/zinc/47/25/58/568472558.db2.gz VKVNNYRWFSEYBA-DYVFJYSZSA-N 1 0 369.436 5.317 20 0 FKADRO CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CCc4c3ccc(OC)c4F)oc21 ZINC000558152675 568472546 /nfs/dbraw/zinc/47/25/46/568472546.db2.gz VKVNNYRWFSEYBA-GUYCJALGSA-N 1 0 369.436 5.317 20 0 FKADRO CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CCc4c3ccc(OC)c4F)oc21 ZINC000558152677 568472585 /nfs/dbraw/zinc/47/25/85/568472585.db2.gz VKVNNYRWFSEYBA-SUMWQHHRSA-N 1 0 369.436 5.317 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)cc3cccnc32)c(C)c1OC ZINC000558153783 568472567 /nfs/dbraw/zinc/47/25/67/568472567.db2.gz PDRIDIWGGFSAGX-AWEZNQCLSA-N 1 0 370.880 5.065 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)cc3cccnc32)c(C)c1OC ZINC000558153784 568472527 /nfs/dbraw/zinc/47/25/27/568472527.db2.gz PDRIDIWGGFSAGX-CQSZACIVSA-N 1 0 370.880 5.065 20 0 FKADRO Cc1ccn(-c2ccccc2C[NH2+][C@@H]2CCCc3c4cc(C)ccc4[nH]c32)n1 ZINC000558157784 568472729 /nfs/dbraw/zinc/47/27/29/568472729.db2.gz RMISZYLSIVAIJE-JOCHJYFZSA-N 1 0 370.500 5.138 20 0 FKADRO Cc1ccn(-c2ccccc2C[NH2+][C@H]2CCCc3c4cc(C)ccc4[nH]c32)n1 ZINC000558157787 568472677 /nfs/dbraw/zinc/47/26/77/568472677.db2.gz RMISZYLSIVAIJE-QFIPXVFZSA-N 1 0 370.500 5.138 20 0 FKADRO C[C@@H]1C[C@@H]([NH2+][C@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000558164289 568472846 /nfs/dbraw/zinc/47/28/46/568472846.db2.gz BFZAOKFNLCOZHJ-DPMMWBKBSA-N 1 0 357.295 5.133 20 0 FKADRO C[C@@H]1C[C@H]([NH2+][C@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000558164293 568472871 /nfs/dbraw/zinc/47/28/71/568472871.db2.gz BFZAOKFNLCOZHJ-HQOQDVMHSA-N 1 0 357.295 5.133 20 0 FKADRO C[C@@H]1C[C@@H]([NH2+][C@@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000558164295 568472797 /nfs/dbraw/zinc/47/27/97/568472797.db2.gz BFZAOKFNLCOZHJ-QQGDVQBRSA-N 1 0 357.295 5.133 20 0 FKADRO C[C@@H]1C[C@H]([NH2+][C@@H](c2cncc(Br)c2)C2CC2)c2ccccc21 ZINC000558164297 568472851 /nfs/dbraw/zinc/47/28/51/568472851.db2.gz BFZAOKFNLCOZHJ-ZUSMLRIVSA-N 1 0 357.295 5.133 20 0 FKADRO COc1cncc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCCCC2)c1 ZINC000558164835 568472823 /nfs/dbraw/zinc/47/28/23/568472823.db2.gz KNFHCIBGNNESGF-UHFFFAOYSA-N 1 0 364.411 5.058 20 0 FKADRO C[N@H+](Cc1coc(-c2ccc(Cl)cc2)n1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000558173755 568472972 /nfs/dbraw/zinc/47/29/72/568472972.db2.gz FVCUJICICUYQIC-AKAXFMLLSA-N 1 0 372.818 5.548 20 0 FKADRO C[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000558176365 568473117 /nfs/dbraw/zinc/47/31/17/568473117.db2.gz RHTJGVCBBUFCMU-OTVXOJSOSA-N 1 0 356.363 5.034 20 0 FKADRO C[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)C1CCC(F)(F)CC1 ZINC000558179382 568473111 /nfs/dbraw/zinc/47/31/11/568473111.db2.gz JGKSFBXHMFGTCI-UHFFFAOYSA-N 1 0 372.459 5.192 20 0 FKADRO C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000558179537 568473108 /nfs/dbraw/zinc/47/31/08/568473108.db2.gz DEBPMBMTUXYPSV-AWEZNQCLSA-N 1 0 369.484 5.533 20 0 FKADRO C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000558179538 568473132 /nfs/dbraw/zinc/47/31/32/568473132.db2.gz DEBPMBMTUXYPSV-CQSZACIVSA-N 1 0 369.484 5.533 20 0 FKADRO Cc1ccc(-c2cnc(C[N@@H+](C)[C@H]3CC[C@@H](C(F)(F)F)CC3)o2)cc1 ZINC000558179663 568473124 /nfs/dbraw/zinc/47/31/24/568473124.db2.gz ILSJMPJPBUFFDQ-IYBDPMFKSA-N 1 0 352.400 5.203 20 0 FKADRO Cc1nc(C[N@@H+](C)C2CCC(F)(F)CC2)oc1-c1ccc(Cl)cc1 ZINC000558185338 568473190 /nfs/dbraw/zinc/47/31/90/568473190.db2.gz WTDQJHYMDNVFBJ-UHFFFAOYSA-N 1 0 354.828 5.313 20 0 FKADRO c1sc(CC[NH2+]Cc2ccnc3ccccc23)nc1C1CCCCC1 ZINC000558193918 568473350 /nfs/dbraw/zinc/47/33/50/568473350.db2.gz ACJWICXRMFCUAO-UHFFFAOYSA-N 1 0 351.519 5.071 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000558217103 568473686 /nfs/dbraw/zinc/47/36/86/568473686.db2.gz MBEXAKMOLVGEHK-BZSNNMDCSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000558217125 568473677 /nfs/dbraw/zinc/47/36/77/568473677.db2.gz MBEXAKMOLVGEHK-FGTMMUONSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000558217127 568473703 /nfs/dbraw/zinc/47/37/03/568473703.db2.gz MBEXAKMOLVGEHK-OKZBNKHCSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000558217131 568473674 /nfs/dbraw/zinc/47/36/74/568473674.db2.gz MBEXAKMOLVGEHK-SQNIBIBYSA-N 1 0 369.814 5.129 20 0 FKADRO Cc1cccc(C([NH2+][C@@H]2CCO[C@H](C(F)(F)F)C2)c2cccc(C)c2)c1 ZINC000558220376 568473880 /nfs/dbraw/zinc/47/38/80/568473880.db2.gz OLQHWVIBSJYWPY-MOPGFXCFSA-N 1 0 363.423 5.092 20 0 FKADRO Cc1cccc(C([NH2+][C@H]2CCO[C@H](C(F)(F)F)C2)c2cccc(C)c2)c1 ZINC000558220380 568473894 /nfs/dbraw/zinc/47/38/94/568473894.db2.gz OLQHWVIBSJYWPY-OALUTQOASA-N 1 0 363.423 5.092 20 0 FKADRO Cc1cccc(C([NH2+][C@H]2CCO[C@@H](C(F)(F)F)C2)c2cccc(C)c2)c1 ZINC000558220383 568473864 /nfs/dbraw/zinc/47/38/64/568473864.db2.gz OLQHWVIBSJYWPY-RBUKOAKNSA-N 1 0 363.423 5.092 20 0 FKADRO Cc1cccc(C([NH2+][C@@H]2CCO[C@@H](C(F)(F)F)C2)c2cccc(C)c2)c1 ZINC000558220385 568473888 /nfs/dbraw/zinc/47/38/88/568473888.db2.gz OLQHWVIBSJYWPY-RTBURBONSA-N 1 0 363.423 5.092 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)CCO1 ZINC000558227818 568474097 /nfs/dbraw/zinc/47/40/97/568474097.db2.gz VDIQIUHLYDQTSS-BZSNNMDCSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc(Cl)c2)CCO1 ZINC000558227820 568474165 /nfs/dbraw/zinc/47/41/65/568474165.db2.gz VDIQIUHLYDQTSS-FGTMMUONSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc(Cl)c2)CCO1 ZINC000558227821 568474133 /nfs/dbraw/zinc/47/41/33/568474133.db2.gz VDIQIUHLYDQTSS-OKZBNKHCSA-N 1 0 369.814 5.129 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)CCO1 ZINC000558227822 568474128 /nfs/dbraw/zinc/47/41/28/568474128.db2.gz VDIQIUHLYDQTSS-SQNIBIBYSA-N 1 0 369.814 5.129 20 0 FKADRO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)oc21 ZINC000558235345 568474352 /nfs/dbraw/zinc/47/43/52/568474352.db2.gz IFJFQTUSOOOXCB-KDOFPFPSSA-N 1 0 373.880 5.259 20 0 FKADRO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)oc21 ZINC000558235348 568474393 /nfs/dbraw/zinc/47/43/93/568474393.db2.gz IFJFQTUSOOOXCB-KSSFIOAISA-N 1 0 373.880 5.259 20 0 FKADRO Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CCCSC2)CCC3)cc1 ZINC000558235999 568474371 /nfs/dbraw/zinc/47/43/71/568474371.db2.gz GNRJSLDBUGJPJF-BBRMVZONSA-N 1 0 362.539 5.059 20 0 FKADRO Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCCSC2)CCC3)cc1 ZINC000558236008 568474381 /nfs/dbraw/zinc/47/43/81/568474381.db2.gz GNRJSLDBUGJPJF-CZUORRHYSA-N 1 0 362.539 5.059 20 0 FKADRO Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCCSC2)CCC3)cc1 ZINC000558236009 568474358 /nfs/dbraw/zinc/47/43/58/568474358.db2.gz GNRJSLDBUGJPJF-XJKSGUPXSA-N 1 0 362.539 5.059 20 0 FKADRO COCCC[C@@H]([NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc(F)cc1 ZINC000558237042 568474378 /nfs/dbraw/zinc/47/43/78/568474378.db2.gz FIJKRYJMTGJVSP-KBAYOESNSA-N 1 0 361.423 5.252 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1 ZINC000558240346 568474506 /nfs/dbraw/zinc/47/45/06/568474506.db2.gz GGIYFFMVKXCLGB-IKGGRYGDSA-N 1 0 369.452 5.040 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000558240347 568474505 /nfs/dbraw/zinc/47/45/05/568474505.db2.gz GGIYFFMVKXCLGB-IXDOHACOSA-N 1 0 369.452 5.040 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CCO[C@H](C(F)(F)F)C1 ZINC000558240348 568474458 /nfs/dbraw/zinc/47/44/58/568474458.db2.gz GGIYFFMVKXCLGB-ULQDDVLXSA-N 1 0 369.452 5.040 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000558240349 568474482 /nfs/dbraw/zinc/47/44/82/568474482.db2.gz GGIYFFMVKXCLGB-YESZJQIVSA-N 1 0 369.452 5.040 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CCO1 ZINC000558242291 568474492 /nfs/dbraw/zinc/47/44/92/568474492.db2.gz WIVPAFODTYJDCJ-IKGGRYGDSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CCO1 ZINC000558242296 568474503 /nfs/dbraw/zinc/47/45/03/568474503.db2.gz WIVPAFODTYJDCJ-IXDOHACOSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CCO1 ZINC000558242297 568474491 /nfs/dbraw/zinc/47/44/91/568474491.db2.gz WIVPAFODTYJDCJ-ULQDDVLXSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CCO1 ZINC000558242299 568474464 /nfs/dbraw/zinc/47/44/64/568474464.db2.gz WIVPAFODTYJDCJ-YESZJQIVSA-N 1 0 361.835 5.271 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(Oc2ccccc2)cc1 ZINC000558242416 568474486 /nfs/dbraw/zinc/47/44/86/568474486.db2.gz XXUHKNQCCNULFD-GMBSWORKSA-N 1 0 365.395 5.239 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(Oc2ccccc2)cc1 ZINC000558242417 568474481 /nfs/dbraw/zinc/47/44/81/568474481.db2.gz XXUHKNQCCNULFD-QOKNQOGYSA-N 1 0 365.395 5.239 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(Oc2ccccc2)cc1 ZINC000558242418 568474658 /nfs/dbraw/zinc/47/46/58/568474658.db2.gz XXUHKNQCCNULFD-URLQWDBASA-N 1 0 365.395 5.239 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(Oc2ccccc2)cc1 ZINC000558242419 568474585 /nfs/dbraw/zinc/47/45/85/568474585.db2.gz XXUHKNQCCNULFD-ZSZQSSIHSA-N 1 0 365.395 5.239 20 0 FKADRO O=C(CC[N@@H+]1CCCC2(CCCCC2)C1)Nc1c(Cl)cccc1Cl ZINC000558245232 568474601 /nfs/dbraw/zinc/47/46/01/568474601.db2.gz JSKLHYZCTOSALQ-UHFFFAOYSA-N 1 0 369.336 5.368 20 0 FKADRO C[C@@H]([NH2+]CC1=CCCOC1)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000558245434 568474627 /nfs/dbraw/zinc/47/46/27/568474627.db2.gz HSPCGXJGWMOQDO-GFCCVEGCSA-N 1 0 351.874 5.205 20 0 FKADRO C[C@H]([NH2+]CC1=CCCOC1)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000558245435 568474677 /nfs/dbraw/zinc/47/46/77/568474677.db2.gz HSPCGXJGWMOQDO-LBPRGKRZSA-N 1 0 351.874 5.205 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000558246342 568474604 /nfs/dbraw/zinc/47/46/04/568474604.db2.gz OLAUHAYFNKLHPS-PXAZEXFGSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000558246348 568474636 /nfs/dbraw/zinc/47/46/36/568474636.db2.gz OLAUHAYFNKLHPS-SJCJKPOMSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000558246349 568474581 /nfs/dbraw/zinc/47/45/81/568474581.db2.gz OLAUHAYFNKLHPS-SJKOYZFVSA-N 1 0 373.802 5.013 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000558246350 568474633 /nfs/dbraw/zinc/47/46/33/568474633.db2.gz OLAUHAYFNKLHPS-YVEFUNNKSA-N 1 0 373.802 5.013 20 0 FKADRO FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000558246475 568474571 /nfs/dbraw/zinc/47/45/71/568474571.db2.gz PLJYWUGQGOCDCI-AITUJVMLSA-N 1 0 355.444 5.113 20 0 FKADRO FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000558246476 568474646 /nfs/dbraw/zinc/47/46/46/568474646.db2.gz PLJYWUGQGOCDCI-JCHJZTRSSA-N 1 0 355.444 5.113 20 0 FKADRO FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000558246480 568474625 /nfs/dbraw/zinc/47/46/25/568474625.db2.gz PLJYWUGQGOCDCI-OWYHZJEWSA-N 1 0 355.444 5.113 20 0 FKADRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000558247582 568474757 /nfs/dbraw/zinc/47/47/57/568474757.db2.gz QVUDZPLILXAPIV-HEAFNYJSSA-N 1 0 363.851 5.110 20 0 FKADRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000558247585 568474784 /nfs/dbraw/zinc/47/47/84/568474784.db2.gz QVUDZPLILXAPIV-JDDSVCBVSA-N 1 0 363.851 5.110 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000558247587 568474747 /nfs/dbraw/zinc/47/47/47/568474747.db2.gz QVUDZPLILXAPIV-PSQDLTRKSA-N 1 0 363.851 5.110 20 0 FKADRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000558247588 568474702 /nfs/dbraw/zinc/47/47/02/568474702.db2.gz QVUDZPLILXAPIV-ZHOLYQSMSA-N 1 0 363.851 5.110 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@H](CCO)c3ccc(Cl)cc3)c(C)c2c1 ZINC000558247999 568474980 /nfs/dbraw/zinc/47/49/80/568474980.db2.gz VNIGYPITAZPDMQ-AUUYWEPGSA-N 1 0 373.880 5.178 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@H](CCO)c3ccc(Cl)cc3)c(C)c2c1 ZINC000558248001 568475013 /nfs/dbraw/zinc/47/50/13/568475013.db2.gz VNIGYPITAZPDMQ-IFXJQAMLSA-N 1 0 373.880 5.178 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)c(C)c2c1 ZINC000558248005 568474942 /nfs/dbraw/zinc/47/49/42/568474942.db2.gz VNIGYPITAZPDMQ-KUHUBIRLSA-N 1 0 373.880 5.178 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@@H](CCO)c3ccc(Cl)cc3)c(C)c2c1 ZINC000558248008 568475033 /nfs/dbraw/zinc/47/50/33/568475033.db2.gz VNIGYPITAZPDMQ-LIRRHRJNSA-N 1 0 373.880 5.178 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CCCSC1 ZINC000558248772 568474932 /nfs/dbraw/zinc/47/49/32/568474932.db2.gz YWRZUZJGFMAGJJ-JSGCOSHPSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H]1CCCSC1 ZINC000558248774 568475064 /nfs/dbraw/zinc/47/50/64/568475064.db2.gz YWRZUZJGFMAGJJ-OCCSQVGLSA-N 1 0 350.528 5.051 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H]1CCCSC1 ZINC000558248776 568475005 /nfs/dbraw/zinc/47/50/05/568475005.db2.gz YWRZUZJGFMAGJJ-TZMCWYRMSA-N 1 0 350.528 5.051 20 0 FKADRO COc1cccc(Cl)c1CNCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000558250447 568466556 /nfs/dbraw/zinc/46/65/56/568466556.db2.gz ICJAUNGKTUJHBN-KRWDZBQOSA-N 1 0 372.940 5.013 20 0 FKADRO COc1cccc(Cl)c1CNCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000558250448 568466561 /nfs/dbraw/zinc/46/65/61/568466561.db2.gz ICJAUNGKTUJHBN-QGZVFWFLSA-N 1 0 372.940 5.013 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)CCO1 ZINC000558254203 568466907 /nfs/dbraw/zinc/46/69/07/568466907.db2.gz BFGAGZGHOAUJML-IKGGRYGDSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)CCO1 ZINC000558254206 568466934 /nfs/dbraw/zinc/46/69/34/568466934.db2.gz BFGAGZGHOAUJML-IXDOHACOSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)CCO1 ZINC000558254211 568466916 /nfs/dbraw/zinc/46/69/16/568466916.db2.gz BFGAGZGHOAUJML-ULQDDVLXSA-N 1 0 361.835 5.271 20 0 FKADRO FC(F)(F)[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)CCO1 ZINC000558254214 568466892 /nfs/dbraw/zinc/46/68/92/568466892.db2.gz BFGAGZGHOAUJML-YESZJQIVSA-N 1 0 361.835 5.271 20 0 FKADRO Fc1cncc([C@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C2CC2)c1 ZINC000558254914 568466897 /nfs/dbraw/zinc/46/68/97/568466897.db2.gz CGZJNNAUBCHAEX-HSZRJFAPSA-N 1 0 362.448 5.041 20 0 FKADRO Fc1cncc([C@@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C2CC2)c1 ZINC000558254918 568466935 /nfs/dbraw/zinc/46/69/35/568466935.db2.gz CGZJNNAUBCHAEX-QHCPKHFHSA-N 1 0 362.448 5.041 20 0 FKADRO C[C@@H](N[C@H]1CCCOc2cc(Cl)ccc21)c1nccn1-c1ccccc1 ZINC000558256072 568467057 /nfs/dbraw/zinc/46/70/57/568467057.db2.gz ICUMVLKWKJAAAZ-BEFAXECRSA-N 1 0 367.880 5.090 20 0 FKADRO C[C@@H](N[C@@H]1CCCOc2cc(Cl)ccc21)c1nccn1-c1ccccc1 ZINC000558256075 568467060 /nfs/dbraw/zinc/46/70/60/568467060.db2.gz ICUMVLKWKJAAAZ-DNVCBOLYSA-N 1 0 367.880 5.090 20 0 FKADRO C[C@H](N[C@@H]1CCCOc2cc(Cl)ccc21)c1nccn1-c1ccccc1 ZINC000558256078 568467039 /nfs/dbraw/zinc/46/70/39/568467039.db2.gz ICUMVLKWKJAAAZ-HNAYVOBHSA-N 1 0 367.880 5.090 20 0 FKADRO C[C@H](N[C@H]1CCCOc2cc(Cl)ccc21)c1nccn1-c1ccccc1 ZINC000558256482 568467026 /nfs/dbraw/zinc/46/70/26/568467026.db2.gz ICUMVLKWKJAAAZ-KXBFYZLASA-N 1 0 367.880 5.090 20 0 FKADRO Cc1nn(C)c2sc([C@@H](C)[NH2+][C@@H](C)c3ccc(C(F)(F)F)cc3)cc12 ZINC000558257123 568467138 /nfs/dbraw/zinc/46/71/38/568467138.db2.gz KWMQHGCNSUZRIO-CMPLNLGQSA-N 1 0 367.440 5.374 20 0 FKADRO Cc1nn(C)c2sc([C@H](C)[NH2+][C@@H](C)c3ccc(C(F)(F)F)cc3)cc12 ZINC000558257124 568467130 /nfs/dbraw/zinc/46/71/30/568467130.db2.gz KWMQHGCNSUZRIO-JQWIXIFHSA-N 1 0 367.440 5.374 20 0 FKADRO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@H]1CCCNc2ccccc21 ZINC000558257553 568467157 /nfs/dbraw/zinc/46/71/57/568467157.db2.gz MISWAQBCDHSMLQ-KRWDZBQOSA-N 1 0 356.338 5.020 20 0 FKADRO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000558257555 568467125 /nfs/dbraw/zinc/46/71/25/568467125.db2.gz MISWAQBCDHSMLQ-QGZVFWFLSA-N 1 0 356.338 5.020 20 0 FKADRO Fc1ccc([C@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(C(F)(F)F)cc2)cc1 ZINC000558259707 568467330 /nfs/dbraw/zinc/46/73/30/568467330.db2.gz TZACKOOHAKEUHH-HRCADAONSA-N 1 0 359.313 5.177 20 0 FKADRO Fc1ccc([C@@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2ccc(C(F)(F)F)cc2)cc1 ZINC000558259731 568467265 /nfs/dbraw/zinc/46/72/65/568467265.db2.gz TZACKOOHAKEUHH-JYJNAYRXSA-N 1 0 359.313 5.177 20 0 FKADRO Cc1ccccc1C([NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccccc1C ZINC000558260501 568467263 /nfs/dbraw/zinc/46/72/63/568467263.db2.gz WXAVQUCEWZTVJY-APWZRJJASA-N 1 0 363.423 5.092 20 0 FKADRO Cc1ccccc1C([NH2+][C@H]1CCO[C@H](C(F)(F)F)C1)c1ccccc1C ZINC000558260508 568467354 /nfs/dbraw/zinc/46/73/54/568467354.db2.gz WXAVQUCEWZTVJY-LPHOPBHVSA-N 1 0 363.423 5.092 20 0 FKADRO Cc1ccccc1C([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccccc1C ZINC000558260512 568467271 /nfs/dbraw/zinc/46/72/71/568467271.db2.gz WXAVQUCEWZTVJY-QFBILLFUSA-N 1 0 363.423 5.092 20 0 FKADRO c1sc(-c2ccccc2)nc1C[NH2+]CCCCCOC1CCCCC1 ZINC000558267129 568467442 /nfs/dbraw/zinc/46/74/42/568467442.db2.gz PFJVUHNNKIJPNC-UHFFFAOYSA-N 1 0 358.551 5.419 20 0 FKADRO Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CC(C(F)(F)F)C2)CCC3)cc1 ZINC000558276436 568467599 /nfs/dbraw/zinc/46/75/99/568467599.db2.gz BRGJXWDTHIPRMP-NRXISQOPSA-N 1 0 366.452 5.426 20 0 FKADRO Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC(C(F)(F)F)C2)CCC3)cc1 ZINC000558276440 568467580 /nfs/dbraw/zinc/46/75/80/568467580.db2.gz BRGJXWDTHIPRMP-YMAMQOFZSA-N 1 0 366.452 5.426 20 0 FKADRO FC(F)Oc1ccc([C@H]([NH2+]C2CC(C(F)(F)F)C2)c2ccccc2)cc1 ZINC000558278735 568467683 /nfs/dbraw/zinc/46/76/83/568467683.db2.gz RGGCGPTXABUCEL-VMBOVVBDSA-N 1 0 371.349 5.308 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cnc3ccsc3c2)c(C)c1OC ZINC000558291993 568468043 /nfs/dbraw/zinc/46/80/43/568468043.db2.gz CLZWHIBHOVSGAF-KBPBESRZSA-N 1 0 356.491 5.034 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cnc3ccsc3c2)c(C)c1OC ZINC000558291995 568468102 /nfs/dbraw/zinc/46/81/02/568468102.db2.gz CLZWHIBHOVSGAF-KGLIPLIRSA-N 1 0 356.491 5.034 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnc3ccsc3c2)c(C)c1OC ZINC000558291997 568468060 /nfs/dbraw/zinc/46/80/60/568468060.db2.gz CLZWHIBHOVSGAF-UONOGXRCSA-N 1 0 356.491 5.034 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cnc3ccsc3c2)c(C)c1OC ZINC000558291999 568468022 /nfs/dbraw/zinc/46/80/22/568468022.db2.gz CLZWHIBHOVSGAF-ZIAGYGMSSA-N 1 0 356.491 5.034 20 0 FKADRO CCC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(OC)c1C)c1ccc(OC)cc1 ZINC000558294790 568468192 /nfs/dbraw/zinc/46/81/92/568468192.db2.gz UNBIIROCPYHGPA-JXFKEZNVSA-N 1 0 357.494 5.213 20 0 FKADRO CCC[C@@H]([NH2+][C@@H](C)c1ccc(OC)c(OC)c1C)c1ccc(OC)cc1 ZINC000558294795 568468235 /nfs/dbraw/zinc/46/82/35/568468235.db2.gz UNBIIROCPYHGPA-OXJNMPFZSA-N 1 0 357.494 5.213 20 0 FKADRO CCC[C@@H]([NH2+][C@H](C)c1ccc(OC)c(OC)c1C)c1ccc(OC)cc1 ZINC000558294797 568468205 /nfs/dbraw/zinc/46/82/05/568468205.db2.gz UNBIIROCPYHGPA-OXQOHEQNSA-N 1 0 357.494 5.213 20 0 FKADRO CCC[C@H]([NH2+][C@H](C)c1ccc(OC)c(OC)c1C)c1ccc(OC)cc1 ZINC000558294799 568468250 /nfs/dbraw/zinc/46/82/50/568468250.db2.gz UNBIIROCPYHGPA-UZLBHIALSA-N 1 0 357.494 5.213 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(SC)c(F)c2)c(C)c1OC ZINC000558295726 568468241 /nfs/dbraw/zinc/46/82/41/568468241.db2.gz UNFXJFFGGXVQNZ-KBPBESRZSA-N 1 0 363.498 5.285 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(SC)c(F)c2)c(C)c1OC ZINC000558295729 568468210 /nfs/dbraw/zinc/46/82/10/568468210.db2.gz UNFXJFFGGXVQNZ-KGLIPLIRSA-N 1 0 363.498 5.285 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC)c(F)c2)c(C)c1OC ZINC000558295731 568468238 /nfs/dbraw/zinc/46/82/38/568468238.db2.gz UNFXJFFGGXVQNZ-UONOGXRCSA-N 1 0 363.498 5.285 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(SC)c(F)c2)c(C)c1OC ZINC000558295732 568468195 /nfs/dbraw/zinc/46/81/95/568468195.db2.gz UNFXJFFGGXVQNZ-ZIAGYGMSSA-N 1 0 363.498 5.285 20 0 FKADRO CC[N@H+](Cc1ccc(C(=O)Nc2cc(C)c(OC)cc2Cl)cc1)C(C)C ZINC000558305863 568468532 /nfs/dbraw/zinc/46/85/32/568468532.db2.gz BJMZKNOFRNILOX-UHFFFAOYSA-N 1 0 374.912 5.140 20 0 FKADRO Cc1cc(OCC(=O)Nc2c(C)cccc2C(C)C)c2cccc(C)c2n1 ZINC000558345067 568471326 /nfs/dbraw/zinc/47/13/26/568471326.db2.gz QGUDGKYWDQNSMF-UHFFFAOYSA-N 1 0 362.473 5.301 20 0 FKADRO CCC[N@H+](Cc1csc(-c2ccccn2)n1)[C@@H](CC)c1ccccc1 ZINC000558363939 568479129 /nfs/dbraw/zinc/47/91/29/568479129.db2.gz ZTPNGJDFHQDJJY-FQEVSTJZSA-N 1 0 351.519 5.568 20 0 FKADRO CCC[N@H+](Cc1csc(-c2ccccn2)n1)[C@H](CC)c1ccccc1 ZINC000558363942 568479148 /nfs/dbraw/zinc/47/91/48/568479148.db2.gz ZTPNGJDFHQDJJY-HXUWFJFHSA-N 1 0 351.519 5.568 20 0 FKADRO c1ccc(COCc2ccc(C[NH2+][C@@H]3CCCNc4ccccc43)cc2)cc1 ZINC000558403668 568479974 /nfs/dbraw/zinc/47/99/74/568479974.db2.gz FFKFBRNGTMICPU-RUZDIDTESA-N 1 0 372.512 5.440 20 0 FKADRO c1ccc(COCc2ccc(C[NH2+][C@H]3CCCNc4ccccc43)cc2)cc1 ZINC000558403669 568479980 /nfs/dbraw/zinc/47/99/80/568479980.db2.gz FFKFBRNGTMICPU-VWLOTQADSA-N 1 0 372.512 5.440 20 0 FKADRO Cc1nc(-c2ccc([C@H](C)[NH2+]CCCc3cnccc3C)cc2)cs1 ZINC000558403818 568480032 /nfs/dbraw/zinc/48/00/32/568480032.db2.gz LCZHEMKIRRPDEQ-INIZCTEOSA-N 1 0 351.519 5.105 20 0 FKADRO Cc1nc(-c2ccc([C@@H](C)[NH2+]CCCc3cnccc3C)cc2)cs1 ZINC000558403819 568479964 /nfs/dbraw/zinc/47/99/64/568479964.db2.gz LCZHEMKIRRPDEQ-MRXNPFEDSA-N 1 0 351.519 5.105 20 0 FKADRO C[C@H](C[NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000558405293 568480039 /nfs/dbraw/zinc/48/00/39/568480039.db2.gz SRDMGDKKFCKKMG-CRAIPNDOSA-N 1 0 355.444 5.280 20 0 FKADRO C[C@@H](C[NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000558405294 568480055 /nfs/dbraw/zinc/48/00/55/568480055.db2.gz SRDMGDKKFCKKMG-MAUKXSAKSA-N 1 0 355.444 5.280 20 0 FKADRO C[C@H](C[NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000558405295 568479984 /nfs/dbraw/zinc/47/99/84/568479984.db2.gz SRDMGDKKFCKKMG-QAPCUYQASA-N 1 0 355.444 5.280 20 0 FKADRO C[C@@H](C[NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000558405296 568479971 /nfs/dbraw/zinc/47/99/71/568479971.db2.gz SRDMGDKKFCKKMG-YJBOKZPZSA-N 1 0 355.444 5.280 20 0 FKADRO COc1cc(C[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)cc(OC)c1O ZINC000558406876 568479945 /nfs/dbraw/zinc/47/99/45/568479945.db2.gz SMPLUAHMEDEICJ-CYBMUJFWSA-N 1 0 371.864 5.067 20 0 FKADRO COc1cc(C[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)cc(OC)c1O ZINC000558406877 568479935 /nfs/dbraw/zinc/47/99/35/568479935.db2.gz SMPLUAHMEDEICJ-ZDUSSCGKSA-N 1 0 371.864 5.067 20 0 FKADRO COc1ccccc1CN(Cc1cccs1)Cc1ccc(Cl)cn1 ZINC000558408666 568480024 /nfs/dbraw/zinc/48/00/24/568480024.db2.gz PEFUHVOABKPGAK-UHFFFAOYSA-N 1 0 358.894 5.008 20 0 FKADRO CC[C@H]([NH2+]Cc1ccnc(Oc2ccccc2F)c1)c1ccccc1F ZINC000558409817 568480100 /nfs/dbraw/zinc/48/01/00/568480100.db2.gz WUOFINQVTBDITP-IBGZPJMESA-N 1 0 354.400 5.393 20 0 FKADRO CC[C@@H]([NH2+]Cc1ccnc(Oc2ccccc2F)c1)c1ccccc1F ZINC000558409818 568480172 /nfs/dbraw/zinc/48/01/72/568480172.db2.gz WUOFINQVTBDITP-LJQANCHMSA-N 1 0 354.400 5.393 20 0 FKADRO C[C@H]([NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1)c1ccc2n[nH]cc2c1 ZINC000558413601 568480069 /nfs/dbraw/zinc/48/00/69/568480069.db2.gz GTFIPGFKSKJCCY-IHRRRGAJSA-N 1 0 350.491 5.015 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)[C@@H](C)c1nc2ccccc2s1 ZINC000558413603 568480078 /nfs/dbraw/zinc/48/00/78/568480078.db2.gz GTFIPGFKSKJCCY-MCIONIFRSA-N 1 0 350.491 5.015 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)[C@H](C)c1nc2ccccc2s1 ZINC000558413604 568480139 /nfs/dbraw/zinc/48/01/39/568480139.db2.gz GTFIPGFKSKJCCY-MJBXVCDLSA-N 1 0 350.491 5.015 20 0 FKADRO C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000558413605 568480133 /nfs/dbraw/zinc/48/01/33/568480133.db2.gz GTFIPGFKSKJCCY-RDBSUJKOSA-N 1 0 350.491 5.015 20 0 FKADRO C[C@H](CCc1cccc(F)c1)[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000558416265 568480126 /nfs/dbraw/zinc/48/01/26/568480126.db2.gz QRLOXAQCGDYMEI-BEFAXECRSA-N 1 0 357.473 5.025 20 0 FKADRO C[C@H](CCc1cccc(F)c1)[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000558416266 568480141 /nfs/dbraw/zinc/48/01/41/568480141.db2.gz QRLOXAQCGDYMEI-DNVCBOLYSA-N 1 0 357.473 5.025 20 0 FKADRO C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000558416267 568480261 /nfs/dbraw/zinc/48/02/61/568480261.db2.gz QRLOXAQCGDYMEI-HNAYVOBHSA-N 1 0 357.473 5.025 20 0 FKADRO C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000558416268 568480284 /nfs/dbraw/zinc/48/02/84/568480284.db2.gz QRLOXAQCGDYMEI-KXBFYZLASA-N 1 0 357.473 5.025 20 0 FKADRO CCOc1ccc([C@@H]([NH2+]Cc2ccc(Cl)cn2)C(C)C)cc1OCC ZINC000558417314 568480289 /nfs/dbraw/zinc/48/02/89/568480289.db2.gz JAPLTASPXYEQQU-FQEVSTJZSA-N 1 0 362.901 5.019 20 0 FKADRO CCOc1ccc([C@H]([NH2+]Cc2ccc(Cl)cn2)C(C)C)cc1OCC ZINC000558417315 568480207 /nfs/dbraw/zinc/48/02/07/568480207.db2.gz JAPLTASPXYEQQU-HXUWFJFHSA-N 1 0 362.901 5.019 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1F)c1ccccc1 ZINC000558465445 568480792 /nfs/dbraw/zinc/48/07/92/568480792.db2.gz CCZRIWBMVQXCJJ-SCLBCKFNSA-N 1 0 366.274 5.017 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1ccc(Br)cc1F)c1ccccc1 ZINC000558465446 568480719 /nfs/dbraw/zinc/48/07/19/568480719.db2.gz CCZRIWBMVQXCJJ-UGSOOPFHSA-N 1 0 366.274 5.017 20 0 FKADRO Clc1cc2c(s1)CC[C@H]2[NH2+]Cc1cnc(-c2ccsc2)s1 ZINC000558480391 568481033 /nfs/dbraw/zinc/48/10/33/568481033.db2.gz RKSZVJIRUQCEHZ-GFCCVEGCSA-N 1 0 352.937 5.364 20 0 FKADRO Clc1cc2c(s1)CC[C@@H]2[NH2+]Cc1cnc(-c2ccsc2)s1 ZINC000558480392 568481022 /nfs/dbraw/zinc/48/10/22/568481022.db2.gz RKSZVJIRUQCEHZ-LBPRGKRZSA-N 1 0 352.937 5.364 20 0 FKADRO Cc1ccc(-c2ccc(C[NH2+][C@H]3c4ccccc4CC34CCOCC4)o2)cc1 ZINC000558492552 568481236 /nfs/dbraw/zinc/48/12/36/568481236.db2.gz JACPHIMARDFXQU-DEOSSOPVSA-N 1 0 373.496 5.439 20 0 FKADRO Cc1ccc(-c2ccc(C[NH2+][C@@H]3c4ccccc4CC34CCOCC4)o2)cc1 ZINC000558492553 568481208 /nfs/dbraw/zinc/48/12/08/568481208.db2.gz JACPHIMARDFXQU-XMMPIXPASA-N 1 0 373.496 5.439 20 0 FKADRO COc1ccc2cc(C[NH2+][C@@H]3c4ccccc4CC34CCOCC4)ccc2c1 ZINC000558494118 568481263 /nfs/dbraw/zinc/48/12/63/568481263.db2.gz ZCPAJWFHSJLYOE-XMMPIXPASA-N 1 0 373.496 5.032 20 0 FKADRO COc1ccc([C@@H]([NH2+]Cc2cccs2)C(C)C)c(Br)c1 ZINC000558497612 568481240 /nfs/dbraw/zinc/48/12/40/568481240.db2.gz QCCAHXWCDHAFPD-INIZCTEOSA-N 1 0 354.313 5.006 20 0 FKADRO COc1ccc([C@H]([NH2+]Cc2cccs2)C(C)C)c(Br)c1 ZINC000558497613 568481228 /nfs/dbraw/zinc/48/12/28/568481228.db2.gz QCCAHXWCDHAFPD-MRXNPFEDSA-N 1 0 354.313 5.006 20 0 FKADRO C[C@H]([NH2+]Cc1ccc2sccc2c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000558499837 568481398 /nfs/dbraw/zinc/48/13/98/568481398.db2.gz BVXDEOBIUFMPRN-AWEZNQCLSA-N 1 0 365.502 5.036 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc2sccc2c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000558499839 568481423 /nfs/dbraw/zinc/48/14/23/568481423.db2.gz BVXDEOBIUFMPRN-CQSZACIVSA-N 1 0 365.502 5.036 20 0 FKADRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1F)CCC2 ZINC000558500398 568481335 /nfs/dbraw/zinc/48/13/35/568481335.db2.gz IKGSKCSFXIHKJG-XPTSAGLGSA-N 1 0 369.303 5.081 20 0 FKADRO COc1ccc([C@H](C)N[C@H](c2cc3ccccc3o2)c2ccccc2)cc1O ZINC000558502236 568481539 /nfs/dbraw/zinc/48/15/39/568481539.db2.gz XPZIDLXKTLGFNN-FYSMJZIKSA-N 1 0 373.452 5.587 20 0 FKADRO COc1ccc([C@@H](C)N[C@H](c2cc3ccccc3o2)c2ccccc2)cc1O ZINC000558502242 568481535 /nfs/dbraw/zinc/48/15/35/568481535.db2.gz XPZIDLXKTLGFNN-GYCJOSAFSA-N 1 0 373.452 5.587 20 0 FKADRO COc1ccc([C@H](C)N[C@@H](c2cc3ccccc3o2)c2ccccc2)cc1O ZINC000558502402 568481460 /nfs/dbraw/zinc/48/14/60/568481460.db2.gz XPZIDLXKTLGFNN-UPCLLVRISA-N 1 0 373.452 5.587 20 0 FKADRO COc1ccc([C@@H](C)N[C@@H](c2cc3ccccc3o2)c2ccccc2)cc1O ZINC000558502404 568481563 /nfs/dbraw/zinc/48/15/63/568481563.db2.gz XPZIDLXKTLGFNN-VOIUYBSRSA-N 1 0 373.452 5.587 20 0 FKADRO Cc1cc(C[NH2+][C@H](c2cccs2)C2CCCC2)cc(N2CCCC2)n1 ZINC000558505068 568481706 /nfs/dbraw/zinc/48/17/06/568481706.db2.gz WLVJPZYWKCUHOZ-NRFANRHFSA-N 1 0 355.551 5.073 20 0 FKADRO Cc1cc(C[NH2+][C@@H](c2cccs2)C2CCCC2)cc(N2CCCC2)n1 ZINC000558505069 568481639 /nfs/dbraw/zinc/48/16/39/568481639.db2.gz WLVJPZYWKCUHOZ-OAQYLSRUSA-N 1 0 355.551 5.073 20 0 FKADRO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)cc(N2CCCC2)n1 ZINC000558505490 568481699 /nfs/dbraw/zinc/48/16/99/568481699.db2.gz JADLWEIZKRFXCW-AWEZNQCLSA-N 1 0 364.320 5.148 20 0 FKADRO Cc1cc2cc([C@@H](C)[NH2+]Cc3ccccc3Cn3ccnc3)oc2cc1C ZINC000558508173 568481712 /nfs/dbraw/zinc/48/17/12/568481712.db2.gz CUHQHMUMTFMMPF-GOSISDBHSA-N 1 0 359.473 5.145 20 0 FKADRO Cc1cc2cc([C@H](C)[NH2+]Cc3ccccc3Cn3ccnc3)oc2cc1C ZINC000558508174 568481724 /nfs/dbraw/zinc/48/17/24/568481724.db2.gz CUHQHMUMTFMMPF-SFHVURJKSA-N 1 0 359.473 5.145 20 0 FKADRO C[C@H]([NH2+]Cc1ncccc1N(C)C)c1ccc(-c2ccccc2Cl)s1 ZINC000558508654 568481684 /nfs/dbraw/zinc/48/16/84/568481684.db2.gz YJBPBWFKDDUHMH-AWEZNQCLSA-N 1 0 371.937 5.380 20 0 FKADRO C[C@@H]([NH2+]Cc1ncccc1N(C)C)c1ccc(-c2ccccc2Cl)s1 ZINC000558508661 568481643 /nfs/dbraw/zinc/48/16/43/568481643.db2.gz YJBPBWFKDDUHMH-CQSZACIVSA-N 1 0 371.937 5.380 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]Cc2sc3ccc(Cl)cc3c2C)cc1O ZINC000558509798 568481668 /nfs/dbraw/zinc/48/16/68/568481668.db2.gz RXSVHODKNSDISZ-GFCCVEGCSA-N 1 0 361.894 5.428 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2sc3ccc(Cl)cc3c2C)cc1O ZINC000558509800 568481720 /nfs/dbraw/zinc/48/17/20/568481720.db2.gz RXSVHODKNSDISZ-LBPRGKRZSA-N 1 0 361.894 5.428 20 0 FKADRO CC[N@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@H]1CCOC(C)(C)C1 ZINC000558571650 568482608 /nfs/dbraw/zinc/48/26/08/568482608.db2.gz JYWCCXSJCMRNRV-FQEVSTJZSA-N 1 0 353.506 5.142 20 0 FKADRO CC[N@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000558571652 568482571 /nfs/dbraw/zinc/48/25/71/568482571.db2.gz JYWCCXSJCMRNRV-HXUWFJFHSA-N 1 0 353.506 5.142 20 0 FKADRO C[N@H+](Cc1cscc1C(F)(F)F)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000558574799 568482703 /nfs/dbraw/zinc/48/27/03/568482703.db2.gz BCRHIENMNQZGOV-RDJZCZTQSA-N 1 0 373.415 5.258 20 0 FKADRO C[N@H+](Cc1cscc1C(F)(F)F)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000558574800 568482696 /nfs/dbraw/zinc/48/26/96/568482696.db2.gz BCRHIENMNQZGOV-WBVHZDCISA-N 1 0 373.415 5.258 20 0 FKADRO Fc1ccccc1-c1csc(C[NH2+]Cc2cc3ccccc3s2)n1 ZINC000558575785 568482681 /nfs/dbraw/zinc/48/26/81/568482681.db2.gz XFFPPBUBIKKEJC-UHFFFAOYSA-N 1 0 354.475 5.454 20 0 FKADRO C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000558611117 568483180 /nfs/dbraw/zinc/48/31/80/568483180.db2.gz DYWDJTZGCNZSBV-AAWPKVBNSA-N 1 0 351.416 5.237 20 0 FKADRO C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000558611118 568483234 /nfs/dbraw/zinc/48/32/34/568483234.db2.gz DYWDJTZGCNZSBV-HNRFISLBSA-N 1 0 351.416 5.237 20 0 FKADRO C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000558611119 568483230 /nfs/dbraw/zinc/48/32/30/568483230.db2.gz DYWDJTZGCNZSBV-KQGZCTBQSA-N 1 0 351.416 5.237 20 0 FKADRO C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000558611120 568483270 /nfs/dbraw/zinc/48/32/70/568483270.db2.gz DYWDJTZGCNZSBV-MZLJFPOFSA-N 1 0 351.416 5.237 20 0 FKADRO FC(F)(F)c1cc([C@H]([NH2+][C@@H]2CCC23CCOCC3)C2CC2)ccc1Cl ZINC000558621356 568483335 /nfs/dbraw/zinc/48/33/35/568483335.db2.gz VCUPVFNWDWJLKU-IAGOWNOFSA-N 1 0 373.846 5.359 20 0 FKADRO FC(F)(F)c1cc([C@@H]([NH2+][C@H]2CCC23CCOCC3)C2CC2)ccc1Cl ZINC000558621358 568483365 /nfs/dbraw/zinc/48/33/65/568483365.db2.gz VCUPVFNWDWJLKU-IRXDYDNUSA-N 1 0 373.846 5.359 20 0 FKADRO FC(F)(F)c1cc([C@@H]([NH2+][C@@H]2CCC23CCOCC3)C2CC2)ccc1Cl ZINC000558621359 568483371 /nfs/dbraw/zinc/48/33/71/568483371.db2.gz VCUPVFNWDWJLKU-SJORKVTESA-N 1 0 373.846 5.359 20 0 FKADRO C[C@H]1C[C@@]1(NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627943 568483586 /nfs/dbraw/zinc/48/35/86/568483586.db2.gz LNAXRYJSSFYYCK-RBZFPXEDSA-N 1 0 356.828 5.159 20 0 FKADRO C[C@H]1C[C@]1(NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627945 568483544 /nfs/dbraw/zinc/48/35/44/568483544.db2.gz LNAXRYJSSFYYCK-RNODOKPDSA-N 1 0 356.828 5.159 20 0 FKADRO C[C@@H]1C[C@@]1(NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627947 568483556 /nfs/dbraw/zinc/48/35/56/568483556.db2.gz LNAXRYJSSFYYCK-XCLFUZPHSA-N 1 0 356.828 5.159 20 0 FKADRO C[C@@H]1C[C@]1(NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627950 568483563 /nfs/dbraw/zinc/48/35/63/568483563.db2.gz LNAXRYJSSFYYCK-ZUOKHONESA-N 1 0 356.828 5.159 20 0 FKADRO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000558650864 568475320 /nfs/dbraw/zinc/47/53/20/568475320.db2.gz DJOXNUDRWCNHFI-FQEVSTJZSA-N 1 0 361.514 5.017 20 0 FKADRO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000558650865 568475283 /nfs/dbraw/zinc/47/52/83/568475283.db2.gz DJOXNUDRWCNHFI-HXUWFJFHSA-N 1 0 361.514 5.017 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccc(Cl)c(Cl)c1Cl ZINC000558650879 568475231 /nfs/dbraw/zinc/47/52/31/568475231.db2.gz GCXXGAVVCRFGPB-SNVBAGLBSA-N 1 0 368.695 5.384 20 0 FKADRO Cn1ncc2ccc(C[NH2+][C@H](CCc3ccccc3)c3ccccc3)cc21 ZINC000558650963 568475256 /nfs/dbraw/zinc/47/52/56/568475256.db2.gz XWQMNQHWCGISHE-HSZRJFAPSA-N 1 0 355.485 5.037 20 0 FKADRO Cn1ncc2ccc(C[NH2+][C@@H](CCc3ccccc3)c3ccccc3)cc21 ZINC000558650964 568475206 /nfs/dbraw/zinc/47/52/06/568475206.db2.gz XWQMNQHWCGISHE-QHCPKHFHSA-N 1 0 355.485 5.037 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccc(C(F)(F)F)cc1 ZINC000558651259 568475322 /nfs/dbraw/zinc/47/53/22/568475322.db2.gz YBGKNOKOZOUFQG-IBGZPJMESA-N 1 0 361.411 5.079 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccc(C(F)(F)F)cc1 ZINC000558651260 568475252 /nfs/dbraw/zinc/47/52/52/568475252.db2.gz YBGKNOKOZOUFQG-LJQANCHMSA-N 1 0 361.411 5.079 20 0 FKADRO COc1cc2c(cc1F)CC[C@H]2[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000558680929 568475498 /nfs/dbraw/zinc/47/54/98/568475498.db2.gz HTIUISQZZWRSNJ-GOSISDBHSA-N 1 0 360.498 5.116 20 0 FKADRO COc1cc2c(cc1F)CC[C@@H]2[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000558680930 568475552 /nfs/dbraw/zinc/47/55/52/568475552.db2.gz HTIUISQZZWRSNJ-SFHVURJKSA-N 1 0 360.498 5.116 20 0 FKADRO C[C@H](C[N@H+](C)[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 ZINC000558724350 568475833 /nfs/dbraw/zinc/47/58/33/568475833.db2.gz COBSFCFEMCEALD-CABCVRRESA-N 1 0 355.482 5.141 20 0 FKADRO C[C@@H](C[N@H+](C)[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 ZINC000558724353 568475965 /nfs/dbraw/zinc/47/59/65/568475965.db2.gz COBSFCFEMCEALD-GJZGRUSLSA-N 1 0 355.482 5.141 20 0 FKADRO C[C@H](c1nnc(-c2ccccc2F)s1)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000558724355 568475828 /nfs/dbraw/zinc/47/58/28/568475828.db2.gz COBSFCFEMCEALD-HUUCEWRRSA-N 1 0 355.482 5.141 20 0 FKADRO C[C@@H](C[N@H+](C)[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 ZINC000558724357 568475901 /nfs/dbraw/zinc/47/59/01/568475901.db2.gz COBSFCFEMCEALD-LSDHHAIUSA-N 1 0 355.482 5.141 20 0 FKADRO CCC(CC)[C@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1cccs1 ZINC000558728885 568476099 /nfs/dbraw/zinc/47/60/99/568476099.db2.gz JRDYDAHBJHIVQH-PXAZEXFGSA-N 1 0 367.356 5.734 20 0 FKADRO CCC(CC)[C@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1cccs1 ZINC000558728892 568476071 /nfs/dbraw/zinc/47/60/71/568476071.db2.gz JRDYDAHBJHIVQH-SJCJKPOMSA-N 1 0 367.356 5.734 20 0 FKADRO CCC(CC)[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1cccs1 ZINC000558728894 568476033 /nfs/dbraw/zinc/47/60/33/568476033.db2.gz JRDYDAHBJHIVQH-SJKOYZFVSA-N 1 0 367.356 5.734 20 0 FKADRO CCC(CC)[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1cccs1 ZINC000558728901 568475994 /nfs/dbraw/zinc/47/59/94/568475994.db2.gz JRDYDAHBJHIVQH-YVEFUNNKSA-N 1 0 367.356 5.734 20 0 FKADRO Cc1ccc(CN(C)C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)o1 ZINC000558732418 568476057 /nfs/dbraw/zinc/47/60/57/568476057.db2.gz HDDDIMIBMCMUHY-UHFFFAOYSA-N 1 0 369.509 5.016 20 0 FKADRO CC1=C(c2ccco2)C[N@H+]([C@@H](C)c2nnc(-c3cccc(Cl)c3)o2)CC1 ZINC000558732511 568476093 /nfs/dbraw/zinc/47/60/93/568476093.db2.gz NGBCZPXUZATBFV-AWEZNQCLSA-N 1 0 369.852 5.223 20 0 FKADRO CC1=C(c2ccco2)C[N@H+]([C@H](C)c2nnc(-c3cccc(Cl)c3)o2)CC1 ZINC000558732514 568476026 /nfs/dbraw/zinc/47/60/26/568476026.db2.gz NGBCZPXUZATBFV-CQSZACIVSA-N 1 0 369.852 5.223 20 0 FKADRO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3CCC(C)=C(c4ccco4)C3)o2)cc1C ZINC000558734058 568476191 /nfs/dbraw/zinc/47/61/91/568476191.db2.gz LXBDPLDVNDXOOQ-KRWDZBQOSA-N 1 0 363.461 5.187 20 0 FKADRO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3CCC(C)=C(c4ccco4)C3)o2)cc1C ZINC000558734062 568476142 /nfs/dbraw/zinc/47/61/42/568476142.db2.gz LXBDPLDVNDXOOQ-QGZVFWFLSA-N 1 0 363.461 5.187 20 0 FKADRO C[C@@H](c1nnc(-c2ccccc2F)s1)N(C)CC1(c2ccccc2)CC1 ZINC000558736058 568476302 /nfs/dbraw/zinc/47/63/02/568476302.db2.gz OGIFGPJFZNZSOI-HNNXBMFYSA-N 1 0 367.493 5.069 20 0 FKADRO C[C@H](c1nnc(-c2ccccc2F)s1)N(C)CC1(c2ccccc2)CC1 ZINC000558736059 568476235 /nfs/dbraw/zinc/47/62/35/568476235.db2.gz OGIFGPJFZNZSOI-OAHLLOKOSA-N 1 0 367.493 5.069 20 0 FKADRO C[C@H](c1ncc(-c2ccccc2)o1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000558739316 568476341 /nfs/dbraw/zinc/47/63/41/568476341.db2.gz HNVXGGHKRZGSFH-PBHICJAKSA-N 1 0 364.411 5.457 20 0 FKADRO C[C@H](c1ncc(-c2ccccc2)o1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000558739319 568476307 /nfs/dbraw/zinc/47/63/07/568476307.db2.gz HNVXGGHKRZGSFH-RHSMWYFYSA-N 1 0 364.411 5.457 20 0 FKADRO C[C@@H](c1ncc(-c2ccccc2)o1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000558739320 568476283 /nfs/dbraw/zinc/47/62/83/568476283.db2.gz HNVXGGHKRZGSFH-WMLDXEAASA-N 1 0 364.411 5.457 20 0 FKADRO C[C@@H](c1ncc(-c2ccccc2)o1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000558739322 568476325 /nfs/dbraw/zinc/47/63/25/568476325.db2.gz HNVXGGHKRZGSFH-YOEHRIQHSA-N 1 0 364.411 5.457 20 0 FKADRO FC(F)(F)[C@H]1CCN(Cc2csc(-c3ccsc3)n2)CC12CCC2 ZINC000558739776 568476227 /nfs/dbraw/zinc/47/62/27/568476227.db2.gz UUESYZWDBXYPQI-AWEZNQCLSA-N 1 0 372.481 5.426 20 0 FKADRO FC(F)(F)[C@@H]1CCN(Cc2csc(-c3ccsc3)n2)CC12CCC2 ZINC000558739777 568476347 /nfs/dbraw/zinc/47/63/47/568476347.db2.gz UUESYZWDBXYPQI-CQSZACIVSA-N 1 0 372.481 5.426 20 0 FKADRO Fc1ccc(-c2cnc(CN3CC[C@H](C(F)(F)F)C4(CCC4)C3)o2)cc1 ZINC000558740180 568476333 /nfs/dbraw/zinc/47/63/33/568476333.db2.gz WYROKEBUDPRKOR-INIZCTEOSA-N 1 0 368.374 5.035 20 0 FKADRO Fc1ccc(-c2cnc(CN3CC[C@@H](C(F)(F)F)C4(CCC4)C3)o2)cc1 ZINC000558740182 568476216 /nfs/dbraw/zinc/47/62/16/568476216.db2.gz WYROKEBUDPRKOR-MRXNPFEDSA-N 1 0 368.374 5.035 20 0 FKADRO C[C@H]([NH2+][C@H](CC1CCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000558741137 568476317 /nfs/dbraw/zinc/47/63/17/568476317.db2.gz ZLPACQRYCIBUFV-IFXJQAMLSA-N 1 0 359.311 5.426 20 0 FKADRO C[C@@H]([NH2+][C@@H](CC1CCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000558741138 568476221 /nfs/dbraw/zinc/47/62/21/568476221.db2.gz ZLPACQRYCIBUFV-KUHUBIRLSA-N 1 0 359.311 5.426 20 0 FKADRO C[C@H]([NH2+][C@@H](CC1CCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000558741140 568476419 /nfs/dbraw/zinc/47/64/19/568476419.db2.gz ZLPACQRYCIBUFV-LIRRHRJNSA-N 1 0 359.311 5.426 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cc2ccccc2[nH]c1=O)c1ccc(C(C)(C)C)cc1 ZINC000558747077 568476389 /nfs/dbraw/zinc/47/63/89/568476389.db2.gz DZTQVLPMWLPMDU-JOCHJYFZSA-N 1 0 362.517 5.725 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cc2ccccc2[nH]c1=O)c1ccc(C(C)(C)C)cc1 ZINC000558747080 568476406 /nfs/dbraw/zinc/47/64/06/568476406.db2.gz DZTQVLPMWLPMDU-QFIPXVFZSA-N 1 0 362.517 5.725 20 0 FKADRO O=C(Nc1cccc(NC2CCCC2)c1)c1ccccc1Oc1ccncc1 ZINC000558749741 568476468 /nfs/dbraw/zinc/47/64/68/568476468.db2.gz SPPHPKUVRJLEJW-UHFFFAOYSA-N 1 0 373.456 5.481 20 0 FKADRO Cc1cnc(N[C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)s1 ZINC000558764065 568476888 /nfs/dbraw/zinc/47/68/88/568476888.db2.gz HKLBHHYJODALSK-NXCDMZCRSA-N 1 0 361.942 5.131 20 0 FKADRO Cc1cnc(N[C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)s1 ZINC000558764075 568477039 /nfs/dbraw/zinc/47/70/39/568477039.db2.gz HKLBHHYJODALSK-ONQFOCNCSA-N 1 0 361.942 5.131 20 0 FKADRO C[C@H]([NH2+]Cc1ccsc1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000558765650 568477032 /nfs/dbraw/zinc/47/70/32/568477032.db2.gz WPDCTDLXEKHQDY-AWEZNQCLSA-N 1 0 358.894 5.226 20 0 FKADRO C[C@@H]([NH2+]Cc1ccsc1Cl)c1ccc(OCc2cccnc2)cc1 ZINC000558765652 568477021 /nfs/dbraw/zinc/47/70/21/568477021.db2.gz WPDCTDLXEKHQDY-CQSZACIVSA-N 1 0 358.894 5.226 20 0 FKADRO Cc1ccc(C[NH2+]CCCCCOC2CCCCC2)c(-c2cnn(C)c2)c1 ZINC000558777005 568477148 /nfs/dbraw/zinc/47/71/48/568477148.db2.gz NSSZWBPUWKUOBL-UHFFFAOYSA-N 1 0 369.553 5.005 20 0 FKADRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccc(C)cc2-c2cnn(C)c2)c1C ZINC000558778781 568477298 /nfs/dbraw/zinc/47/72/98/568477298.db2.gz JTTSJAZWYWLLRT-UHFFFAOYSA-N 1 0 372.516 5.092 20 0 FKADRO CCc1nc2cc(C[NH2+]Cc3ccc(Cl)c(F)c3)ccc2n1C1CC1 ZINC000558780224 568477260 /nfs/dbraw/zinc/47/72/60/568477260.db2.gz YRKIGKOIIUYIMD-UHFFFAOYSA-N 1 0 357.860 5.016 20 0 FKADRO CCCOc1ccc(C[NH2+]Cc2ccc3c(c2)nc(CC)n3C2CC2)cc1 ZINC000558782515 568477241 /nfs/dbraw/zinc/47/72/41/568477241.db2.gz LXIQAODOOAQTFS-UHFFFAOYSA-N 1 0 363.505 5.012 20 0 FKADRO Cc1nn(C)cc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000558790784 568477407 /nfs/dbraw/zinc/47/74/07/568477407.db2.gz JGZFHUIHGNNSNL-IBGZPJMESA-N 1 0 365.443 5.159 20 0 FKADRO Cc1nn(C)cc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000558790788 568477364 /nfs/dbraw/zinc/47/73/64/568477364.db2.gz JGZFHUIHGNNSNL-LJQANCHMSA-N 1 0 365.443 5.159 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cnn(-c3ccccc3)c2)C2CC2)c1 ZINC000558791186 568477499 /nfs/dbraw/zinc/47/74/99/568477499.db2.gz MJSZMDSQFCRJCF-HXUWFJFHSA-N 1 0 371.406 5.132 20 0 FKADRO FC(F)(F)c1cccc([C@H]([NH2+]Cc2cnc(C3CCC3)s2)C2CC2)c1 ZINC000558791936 568477527 /nfs/dbraw/zinc/47/75/27/568477527.db2.gz VHOIASIBMRXSTG-QGZVFWFLSA-N 1 0 366.452 5.670 20 0 FKADRO OCc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)o1 ZINC000558792086 568477506 /nfs/dbraw/zinc/47/75/06/568477506.db2.gz QBZHADQQQJXQRU-IBGZPJMESA-N 1 0 367.411 5.202 20 0 FKADRO OCc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)o1 ZINC000558792087 568477561 /nfs/dbraw/zinc/47/75/61/568477561.db2.gz QBZHADQQQJXQRU-LJQANCHMSA-N 1 0 367.411 5.202 20 0 FKADRO Cc1nc(C(C)C)ccc1CSc1nnc(-c2ccccc2Cl)n1C ZINC000558807260 568477708 /nfs/dbraw/zinc/47/77/08/568477708.db2.gz GNJYUEJVISQWFA-UHFFFAOYSA-N 1 0 372.925 5.255 20 0 FKADRO Cc1nc(C(C)C)ccc1CSc1nnc2sc3ccccc3n12 ZINC000558807441 568477710 /nfs/dbraw/zinc/47/77/10/568477710.db2.gz NJEMHTXYVAXXAW-UHFFFAOYSA-N 1 0 354.504 5.063 20 0 FKADRO CCn1c(SCc2ccc(C(C)C)nc2C)nnc1-c1ccccc1 ZINC000558807769 568477727 /nfs/dbraw/zinc/47/77/27/568477727.db2.gz NNCKUBCSTPIMFY-UHFFFAOYSA-N 1 0 352.507 5.084 20 0 FKADRO FC(F)(F)c1csc([C@@H]2CCC[N@H+](Cc3sccc3Cl)C2)n1 ZINC000558850533 568479060 /nfs/dbraw/zinc/47/90/60/568479060.db2.gz HOHWUPHTVYDFDY-SECBINFHSA-N 1 0 366.861 5.256 20 0 FKADRO FC(F)(F)c1csc([C@H]2CCC[N@H+](Cc3sccc3Cl)C2)n1 ZINC000558850534 568479030 /nfs/dbraw/zinc/47/90/30/568479030.db2.gz HOHWUPHTVYDFDY-VIFPVBQESA-N 1 0 366.861 5.256 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2sccc2Cl)ccc1OCC(C)C ZINC000558852970 568480659 /nfs/dbraw/zinc/48/06/59/568480659.db2.gz OQSXWSPDJXOOCC-CYBMUJFWSA-N 1 0 353.915 5.296 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2sccc2Cl)ccc1OCC(C)C ZINC000558852984 568480632 /nfs/dbraw/zinc/48/06/32/568480632.db2.gz OQSXWSPDJXOOCC-ZDUSSCGKSA-N 1 0 353.915 5.296 20 0 FKADRO Clc1ccsc1CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000558853665 568481567 /nfs/dbraw/zinc/48/15/67/568481567.db2.gz SAHHYOZYEXYBNT-KRWDZBQOSA-N 1 0 363.313 5.524 20 0 FKADRO Clc1ccsc1CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000558853670 568481468 /nfs/dbraw/zinc/48/14/68/568481468.db2.gz SAHHYOZYEXYBNT-QGZVFWFLSA-N 1 0 363.313 5.524 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)nc1 ZINC000558863480 568475213 /nfs/dbraw/zinc/47/52/13/568475213.db2.gz UYRRLWYBIRJUED-MRXNPFEDSA-N 1 0 374.328 5.360 20 0 FKADRO CCCC(C)(C)N(Cc1cccs1)Cc1nnc(C2CC2)n1C1CC1 ZINC000558863769 568475413 /nfs/dbraw/zinc/47/54/13/568475413.db2.gz FMWSACDFOBRLNU-UHFFFAOYSA-N 1 0 358.555 5.133 20 0 FKADRO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1cc2ccccc2[nH]c1=O ZINC000558863778 568475386 /nfs/dbraw/zinc/47/53/86/568475386.db2.gz FTRUEIIMYUNVLL-UHFFFAOYSA-N 1 0 354.519 5.583 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+]Cc2csc3ccccc23)c2ccccc21 ZINC000558918404 568488072 /nfs/dbraw/zinc/48/80/72/568488072.db2.gz FJBKBXLMSPIWIQ-PMACEKPBSA-N 1 0 365.498 5.173 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2csc3ccccc23)c2ccccc21 ZINC000558918405 568488139 /nfs/dbraw/zinc/48/81/39/568488139.db2.gz FJBKBXLMSPIWIQ-UXHICEINSA-N 1 0 365.498 5.173 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+]Cc2csc3ccccc23)c2ccccc21 ZINC000558918406 568488153 /nfs/dbraw/zinc/48/81/53/568488153.db2.gz FJBKBXLMSPIWIQ-VQTJNVASSA-N 1 0 365.498 5.173 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2csc3ccccc23)c2ccccc21 ZINC000558918407 568488159 /nfs/dbraw/zinc/48/81/59/568488159.db2.gz FJBKBXLMSPIWIQ-WOJBJXKFSA-N 1 0 365.498 5.173 20 0 FKADRO Fc1ccc([C@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)c2cccs2)cc1 ZINC000558945845 568488611 /nfs/dbraw/zinc/48/86/11/568488611.db2.gz YSHFCRDJAVIBGG-FQEVSTJZSA-N 1 0 354.425 5.387 20 0 FKADRO Fc1ccc([C@@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)c2cccs2)cc1 ZINC000558945846 568488618 /nfs/dbraw/zinc/48/86/18/568488618.db2.gz YSHFCRDJAVIBGG-HXUWFJFHSA-N 1 0 354.425 5.387 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000558968071 568488785 /nfs/dbraw/zinc/48/87/85/568488785.db2.gz IFMDYNCSKLMAHE-IWMITWMQSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000558968073 568489007 /nfs/dbraw/zinc/48/90/07/568489007.db2.gz IFMDYNCSKLMAHE-ONGXBYRLSA-N 1 0 369.530 5.241 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(SC)cc2)c2ccccc21 ZINC000558968074 568489065 /nfs/dbraw/zinc/48/90/65/568489065.db2.gz IFMDYNCSKLMAHE-RVHYNSKXSA-N 1 0 369.530 5.241 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](CC)c3ccccc3F)ccc2n1C1CC1 ZINC000558968214 568489029 /nfs/dbraw/zinc/48/90/29/568489029.db2.gz JKLMYKNVPPRLEM-IBGZPJMESA-N 1 0 351.469 5.314 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](CC)c3ccccc3F)ccc2n1C1CC1 ZINC000558968215 568488973 /nfs/dbraw/zinc/48/89/73/568488973.db2.gz JKLMYKNVPPRLEM-LJQANCHMSA-N 1 0 351.469 5.314 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](CC)c3cccc(F)c3)ccc2n1C1CC1 ZINC000558968577 568489034 /nfs/dbraw/zinc/48/90/34/568489034.db2.gz QUMMBGFYYYRLNT-IBGZPJMESA-N 1 0 351.469 5.314 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](CC)c3cccc(F)c3)ccc2n1C1CC1 ZINC000558968579 568489014 /nfs/dbraw/zinc/48/90/14/568489014.db2.gz QUMMBGFYYYRLNT-LJQANCHMSA-N 1 0 351.469 5.314 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2Cl)c2ccccc21 ZINC000558968901 568489020 /nfs/dbraw/zinc/48/90/20/568489020.db2.gz VSYRZYMWCLARMB-HEFCMCLBSA-N 1 0 357.881 5.172 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2Cl)c2ccccc21 ZINC000558968902 568489040 /nfs/dbraw/zinc/48/90/40/568489040.db2.gz VSYRZYMWCLARMB-LXGCGDOSSA-N 1 0 357.881 5.172 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2Cl)c2ccccc21 ZINC000558968903 568489011 /nfs/dbraw/zinc/48/90/11/568489011.db2.gz VSYRZYMWCLARMB-WNYOCNMUSA-N 1 0 357.881 5.172 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3csc(Cl)c3)ccc2n1C1CC1 ZINC000558969123 568489055 /nfs/dbraw/zinc/48/90/55/568489055.db2.gz YWQACGRMYSUFOA-GFCCVEGCSA-N 1 0 359.926 5.499 20 0 FKADRO CCc1nc2cc(C[NH2+][C@@H](C)c3csc(Cl)c3)ccc2n1C1CC1 ZINC000558969125 568489001 /nfs/dbraw/zinc/48/90/01/568489001.db2.gz YWQACGRMYSUFOA-LBPRGKRZSA-N 1 0 359.926 5.499 20 0 FKADRO CCc1nc(C)c([C@@H](C)[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)s1 ZINC000558969628 568488953 /nfs/dbraw/zinc/48/89/53/568488953.db2.gz CPDBFXPBNUNWLI-SJKOYZFVSA-N 1 0 368.468 5.835 20 0 FKADRO CCc1nc(C)c([C@H](C)[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)s1 ZINC000558969629 568488961 /nfs/dbraw/zinc/48/89/61/568488961.db2.gz CPDBFXPBNUNWLI-YVEFUNNKSA-N 1 0 368.468 5.835 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc2ccccc2n1 ZINC000558974116 568489261 /nfs/dbraw/zinc/48/92/61/568489261.db2.gz NTXMWVXPFCVAOV-LHSJRXKWSA-N 1 0 370.418 6.056 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc2ccccc2n1 ZINC000558974117 568489377 /nfs/dbraw/zinc/48/93/77/568489377.db2.gz NTXMWVXPFCVAOV-SPLOXXLWSA-N 1 0 370.418 6.056 20 0 FKADRO C[C@H]1C[C@H](N[C@H](C[NH+](C)C)c2ccc(Cl)cc2)c2ccsc2S1 ZINC000558974696 568489308 /nfs/dbraw/zinc/48/93/08/568489308.db2.gz FOLMDERCBICLBB-AFAVFJNCSA-N 1 0 366.983 5.219 20 0 FKADRO C[C@H]1C[C@@H](N[C@H](C[NH+](C)C)c2ccc(Cl)cc2)c2ccsc2S1 ZINC000558974701 568489303 /nfs/dbraw/zinc/48/93/03/568489303.db2.gz FOLMDERCBICLBB-JCURWCKSSA-N 1 0 366.983 5.219 20 0 FKADRO C[C@H]1C[C@@H](N[C@@H](C[NH+](C)C)c2ccc(Cl)cc2)c2ccsc2S1 ZINC000558974703 568489324 /nfs/dbraw/zinc/48/93/24/568489324.db2.gz FOLMDERCBICLBB-VUCTXSBTSA-N 1 0 366.983 5.219 20 0 FKADRO C[C@H]1C[C@H](N[C@@H](C[NH+](C)C)c2ccc(Cl)cc2)c2ccsc2S1 ZINC000558974705 568489252 /nfs/dbraw/zinc/48/92/52/568489252.db2.gz FOLMDERCBICLBB-ZLIFDBKOSA-N 1 0 366.983 5.219 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](CC)c2cc(F)ccc2F)c2ccccc21 ZINC000558974749 568489269 /nfs/dbraw/zinc/48/92/69/568489269.db2.gz VWUFVTUSXCZGIK-DUXKGJEZSA-N 1 0 373.443 5.187 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)c2ccccc21 ZINC000558974750 568489273 /nfs/dbraw/zinc/48/92/73/568489273.db2.gz VWUFVTUSXCZGIK-JRGCBEDISA-N 1 0 373.443 5.187 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)c2ccccc21 ZINC000558974751 568489355 /nfs/dbraw/zinc/48/93/55/568489355.db2.gz VWUFVTUSXCZGIK-QMMLZNLJSA-N 1 0 373.443 5.187 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](CC)c2cc(F)ccc2F)c2ccccc21 ZINC000558974752 568489343 /nfs/dbraw/zinc/48/93/43/568489343.db2.gz VWUFVTUSXCZGIK-UIFIKXQLSA-N 1 0 373.443 5.187 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558974846 568489353 /nfs/dbraw/zinc/48/93/53/568489353.db2.gz XTNSFDVACNMTCV-BEVDRBHNSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558974847 568489340 /nfs/dbraw/zinc/48/93/40/568489340.db2.gz XTNSFDVACNMTCV-CWFSZBLJSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558974848 568489281 /nfs/dbraw/zinc/48/92/81/568489281.db2.gz XTNSFDVACNMTCV-RYGJVYDSSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558974849 568489277 /nfs/dbraw/zinc/48/92/77/568489277.db2.gz XTNSFDVACNMTCV-YSSFQJQWSA-N 1 0 363.457 5.265 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cc(F)cc(F)c3)ccc2n1C1CC1 ZINC000558975411 568489294 /nfs/dbraw/zinc/48/92/94/568489294.db2.gz QPJHITJPGDASFW-CYBMUJFWSA-N 1 0 355.432 5.063 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558975610 568489336 /nfs/dbraw/zinc/48/93/36/568489336.db2.gz XTNSFDVACNMTCV-CDHQVMDDSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558975611 568489350 /nfs/dbraw/zinc/48/93/50/568489350.db2.gz XTNSFDVACNMTCV-UIAACRFSSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@H]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558975612 568489328 /nfs/dbraw/zinc/48/93/28/568489328.db2.gz XTNSFDVACNMTCV-XPGWFJOJSA-N 1 0 363.457 5.265 20 0 FKADRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)c2ccccc21 ZINC000558975613 568489507 /nfs/dbraw/zinc/48/95/07/568489507.db2.gz XTNSFDVACNMTCV-YSGRDPCXSA-N 1 0 363.457 5.265 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1nc2ccccc2n1C ZINC000558975964 568489516 /nfs/dbraw/zinc/48/95/16/568489516.db2.gz HUKYRCDRLRYNHG-BFUOFWGJSA-N 1 0 373.422 5.394 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1nc2ccccc2n1C ZINC000558975965 568489476 /nfs/dbraw/zinc/48/94/76/568489476.db2.gz HUKYRCDRLRYNHG-ORAYPTAESA-N 1 0 373.422 5.394 20 0 FKADRO CCc1nc2cc(C[NH2+][C@H](C)c3cc(F)ccc3F)ccc2n1C1CC1 ZINC000558976673 568489462 /nfs/dbraw/zinc/48/94/62/568489462.db2.gz UMVMSUBAFYXAEK-CYBMUJFWSA-N 1 0 355.432 5.063 20 0 FKADRO O=C(Nc1cccc(CSC2CCCCC2)c1)C1CC[NH+](C2CC2)CC1 ZINC000558990906 568489456 /nfs/dbraw/zinc/48/94/56/568489456.db2.gz AZDPWUSUKJUKDJ-UHFFFAOYSA-N 1 0 372.578 5.065 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ccc(-c2cnn(C)c2)s1 ZINC000559073631 568484205 /nfs/dbraw/zinc/48/42/05/568484205.db2.gz FWMOPDUWVONOGX-AWEZNQCLSA-N 1 0 374.579 5.230 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ccc(-c2cnn(C)c2)s1 ZINC000559073634 568484167 /nfs/dbraw/zinc/48/41/67/568484167.db2.gz FWMOPDUWVONOGX-CQSZACIVSA-N 1 0 374.579 5.230 20 0 FKADRO C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000559073652 568484256 /nfs/dbraw/zinc/48/42/56/568484256.db2.gz GGULDILGAYINTP-CHWSQXEVSA-N 1 0 369.431 5.058 20 0 FKADRO C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000559073654 568484197 /nfs/dbraw/zinc/48/41/97/568484197.db2.gz GGULDILGAYINTP-OLZOCXBDSA-N 1 0 369.431 5.058 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1)c1nc(C(C)(C)C)no1 ZINC000559073656 568484181 /nfs/dbraw/zinc/48/41/81/568484181.db2.gz GGULDILGAYINTP-QWHCGFSZSA-N 1 0 369.431 5.058 20 0 FKADRO C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000559073657 568484163 /nfs/dbraw/zinc/48/41/63/568484163.db2.gz GGULDILGAYINTP-STQMWFEESA-N 1 0 369.431 5.058 20 0 FKADRO COC[C@@H]([NH2+]Cc1ccc(-c2csc(C)n2)cc1)c1ccc(Cl)cc1 ZINC000559087095 568484809 /nfs/dbraw/zinc/48/48/09/568484809.db2.gz SDWFLUCHPBTVCF-LJQANCHMSA-N 1 0 372.921 5.249 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(OC(C)C)c(OC)c1 ZINC000559146765 568486019 /nfs/dbraw/zinc/48/60/19/568486019.db2.gz CYLTWFJCOGRCIM-KRWDZBQOSA-N 1 0 370.537 5.414 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000559147142 568486009 /nfs/dbraw/zinc/48/60/09/568486009.db2.gz MNJGLEDPAAUZBH-GRXQJBFDSA-N 1 0 357.469 5.011 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000559147146 568486066 /nfs/dbraw/zinc/48/60/66/568486066.db2.gz MNJGLEDPAAUZBH-WOYCLPQFSA-N 1 0 357.469 5.011 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000559147301 568486103 /nfs/dbraw/zinc/48/61/03/568486103.db2.gz QXXMCYPNBMOZEH-SFHVURJKSA-N 1 0 359.517 5.680 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(SCCOC)cc1 ZINC000559147311 568486107 /nfs/dbraw/zinc/48/61/07/568486107.db2.gz RNNSUONGDWDRKM-KRWDZBQOSA-N 1 0 372.578 5.357 20 0 FKADRO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(SCCOC)cc1 ZINC000559147312 568486095 /nfs/dbraw/zinc/48/60/95/568486095.db2.gz RNNSUONGDWDRKM-QGZVFWFLSA-N 1 0 372.578 5.357 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1ccc(C(C)C)nc1C ZINC000559150946 568486054 /nfs/dbraw/zinc/48/60/54/568486054.db2.gz GYTKXFATUCTCKH-INIZCTEOSA-N 1 0 365.546 5.796 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccc(C(C)C)nc1C ZINC000559150947 568486070 /nfs/dbraw/zinc/48/60/70/568486070.db2.gz GYTKXFATUCTCKH-MRXNPFEDSA-N 1 0 365.546 5.796 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000559151271 568486094 /nfs/dbraw/zinc/48/60/94/568486094.db2.gz FICAXWOUMZJBKV-PFHKOEEOSA-N 1 0 364.942 5.379 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000559151272 568486035 /nfs/dbraw/zinc/48/60/35/568486035.db2.gz FICAXWOUMZJBKV-ZHRONYKTSA-N 1 0 364.942 5.379 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+]CC(=O)Nc1c(C)cccc1C ZINC000559233181 568487448 /nfs/dbraw/zinc/48/74/48/568487448.db2.gz MRRZKEMGXOKKHU-UHFFFAOYSA-N 1 0 372.921 5.208 20 0 FKADRO CSCc1cnc(C[NH2+][C@@H](C)C(c2ccccc2)c2ccccc2)s1 ZINC000559244337 568488604 /nfs/dbraw/zinc/48/86/04/568488604.db2.gz NSLHJTGPTNLQGY-INIZCTEOSA-N 1 0 368.571 5.316 20 0 FKADRO CSCc1cnc(C[NH2+][C@H](C)C(c2ccccc2)c2ccccc2)s1 ZINC000559244340 568488599 /nfs/dbraw/zinc/48/85/99/568488599.db2.gz NSLHJTGPTNLQGY-MRXNPFEDSA-N 1 0 368.571 5.316 20 0 FKADRO Cc1sccc1C[NH2+][C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000559250879 568483978 /nfs/dbraw/zinc/48/39/78/568483978.db2.gz ZDCIWSSYCGFNNP-CQSZACIVSA-N 1 0 368.477 5.299 20 0 FKADRO COCCNc1ccc(C[NH2+]Cc2sc3c(cccc3Cl)c2C)cc1 ZINC000559259751 568485925 /nfs/dbraw/zinc/48/59/25/568485925.db2.gz BHVCSHJQWDVOST-UHFFFAOYSA-N 1 0 374.937 5.211 20 0 FKADRO CSCc1cnc(CNCc2ccccc2Oc2cccc(F)c2)s1 ZINC000559268754 568487142 /nfs/dbraw/zinc/48/71/42/568487142.db2.gz GNQBSWZINKNHCA-UHFFFAOYSA-N 1 0 374.506 5.227 20 0 FKADRO Cc1cnc(C(C)(C)[NH2+]Cc2sc3c(cccc3Cl)c2C)s1 ZINC000559282723 568495832 /nfs/dbraw/zinc/49/58/32/568495832.db2.gz UGSGGMFOYMYKIX-UHFFFAOYSA-N 1 0 350.940 5.653 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000559294388 568495912 /nfs/dbraw/zinc/49/59/12/568495912.db2.gz LVJBEAGUQCFKCC-CYBMUJFWSA-N 1 0 365.443 5.181 20 0 FKADRO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000559294390 568495958 /nfs/dbraw/zinc/49/59/58/568495958.db2.gz LVJBEAGUQCFKCC-ZDUSSCGKSA-N 1 0 365.443 5.181 20 0 FKADRO Cc1sccc1C[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000559294681 568496094 /nfs/dbraw/zinc/49/60/94/568496094.db2.gz HEXXGVHROKWFGU-INIZCTEOSA-N 1 0 358.507 5.486 20 0 FKADRO Cc1sccc1C[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000559294683 568496083 /nfs/dbraw/zinc/49/60/83/568496083.db2.gz HEXXGVHROKWFGU-MRXNPFEDSA-N 1 0 358.507 5.486 20 0 FKADRO CSCc1cnc(C[NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)s1 ZINC000559299533 568496000 /nfs/dbraw/zinc/49/60/00/568496000.db2.gz CUKXCOOXIUOZNC-UHFFFAOYSA-N 1 0 374.497 5.092 20 0 FKADRO CSCc1cnc(C[NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)s1 ZINC000559301766 568496089 /nfs/dbraw/zinc/49/60/89/568496089.db2.gz KETSSXXRHSGJSS-MQMHXKEQSA-N 1 0 372.481 5.061 20 0 FKADRO Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000559304228 568496217 /nfs/dbraw/zinc/49/62/17/568496217.db2.gz TWOGAJPKLZGFSS-UHFFFAOYSA-N 1 0 355.894 5.040 20 0 FKADRO Cc1nocc1C[NH2+]Cc1ccc(Oc2cc(Cl)cc(Cl)c2)cc1 ZINC000559304430 568496187 /nfs/dbraw/zinc/49/61/87/568496187.db2.gz XHISSHJWSGXDPO-UHFFFAOYSA-N 1 0 363.244 5.372 20 0 FKADRO Brc1ccc(C[NH2+]Cc2coc3ccccc23)c2ncccc12 ZINC000559306280 568496142 /nfs/dbraw/zinc/49/61/42/568496142.db2.gz DEGYMQSBEAMLLR-UHFFFAOYSA-N 1 0 367.246 5.033 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2ccccc2OCC(F)(F)F)cc1 ZINC000559307094 568496311 /nfs/dbraw/zinc/49/63/11/568496311.db2.gz NJTAVVSBQUYHNG-UHFFFAOYSA-N 1 0 359.338 5.029 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000559307526 568496266 /nfs/dbraw/zinc/49/62/66/568496266.db2.gz DVHWBXCTXALJBS-UHFFFAOYSA-N 1 0 359.338 5.029 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCc2ccc(Cl)cc21)c1ccc(-n2cccn2)c(F)c1 ZINC000559307765 568496361 /nfs/dbraw/zinc/49/63/61/568496361.db2.gz XLLDIQMKNJCSRR-BFUOFWGJSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCc2ccc(Cl)cc21)c1ccc(-n2cccn2)c(F)c1 ZINC000559307766 568496245 /nfs/dbraw/zinc/49/62/45/568496245.db2.gz XLLDIQMKNJCSRR-YJYMSZOUSA-N 1 0 355.844 5.003 20 0 FKADRO COc1cc(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)ccc1SC ZINC000559307880 568496282 /nfs/dbraw/zinc/49/62/82/568496282.db2.gz IYOJKJJSINLBTE-INIZCTEOSA-N 1 0 369.452 5.243 20 0 FKADRO COc1cc(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)ccc1SC ZINC000559307881 568496275 /nfs/dbraw/zinc/49/62/75/568496275.db2.gz IYOJKJJSINLBTE-MRXNPFEDSA-N 1 0 369.452 5.243 20 0 FKADRO c1cc(Sc2ccccn2)oc1C[NH2+]Cc1cc2ccccc2s1 ZINC000559308163 568496366 /nfs/dbraw/zinc/49/63/66/568496366.db2.gz QUKWVCWIZZHPDQ-UHFFFAOYSA-N 1 0 352.484 5.330 20 0 FKADRO FC(F)(F)[C@@H](CC[NH2+]Cc1cnc(C2CCC2)s1)c1ccccc1 ZINC000559308428 568496324 /nfs/dbraw/zinc/49/63/24/568496324.db2.gz LDBSBBZIZZUKTC-INIZCTEOSA-N 1 0 354.441 5.236 20 0 FKADRO FC(F)(F)[C@H](CC[NH2+]Cc1cnc(C2CCC2)s1)c1ccccc1 ZINC000559308429 568496360 /nfs/dbraw/zinc/49/63/60/568496360.db2.gz LDBSBBZIZZUKTC-MRXNPFEDSA-N 1 0 354.441 5.236 20 0 FKADRO CC(C)(C)c1nc(C[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cs1 ZINC000559309815 568489743 /nfs/dbraw/zinc/48/97/43/568489743.db2.gz GWBIPMCKWQJNQB-HNNXBMFYSA-N 1 0 356.457 5.266 20 0 FKADRO CC(C)(C)c1nc(C[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cs1 ZINC000559309818 568489829 /nfs/dbraw/zinc/48/98/29/568489829.db2.gz GWBIPMCKWQJNQB-OAHLLOKOSA-N 1 0 356.457 5.266 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000559310005 568489787 /nfs/dbraw/zinc/48/97/87/568489787.db2.gz HKJZMLDTHNTFQR-BFUOFWGJSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000559310008 568489761 /nfs/dbraw/zinc/48/97/61/568489761.db2.gz HKJZMLDTHNTFQR-YJYMSZOUSA-N 1 0 355.844 5.003 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1ccc(-n2cccn2)c(F)c1 ZINC000559310130 568489823 /nfs/dbraw/zinc/48/98/23/568489823.db2.gz LKQUWXDKAIAOKU-CHWSQXEVSA-N 1 0 361.823 5.216 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1ccc(-n2cccn2)c(F)c1 ZINC000559310131 568489790 /nfs/dbraw/zinc/48/97/90/568489790.db2.gz LKQUWXDKAIAOKU-QWHCGFSZSA-N 1 0 361.823 5.216 20 0 FKADRO Cc1cc(C)c(NC(=O)CCC[NH2+]C(C)(C)c2ccccc2C)c(C)c1 ZINC000559326379 568489959 /nfs/dbraw/zinc/48/99/59/568489959.db2.gz JJBBYTSAUSIPFL-UHFFFAOYSA-N 1 0 352.522 5.164 20 0 FKADRO Fc1cccc(CC2([NH2+]Cc3csc(Cl)c3Cl)CCOCC2)c1 ZINC000559333677 568489973 /nfs/dbraw/zinc/48/99/73/568489973.db2.gz RIBSMWJSAXAULE-UHFFFAOYSA-N 1 0 374.308 5.076 20 0 FKADRO COc1sc(C[NH2+][C@@H](C)c2ccccc2Cl)cc1Br ZINC000559340485 568490175 /nfs/dbraw/zinc/49/01/75/568490175.db2.gz IHZWFCASZFNJPI-VIFPVBQESA-N 1 0 360.704 5.023 20 0 FKADRO CC(=O)N(c1nc(C[NH2+]CCC(C)(C)C2CC2)cs1)c1ccc(C)cc1 ZINC000559351287 568490292 /nfs/dbraw/zinc/49/02/92/568490292.db2.gz HVWSNMOOQWWSHN-UHFFFAOYSA-N 1 0 371.550 5.052 20 0 FKADRO CC(=O)N(c1nc(C[NH2+]C[C@@H]2CCCC2(C)C)cs1)c1ccc(C)cc1 ZINC000559352158 568490298 /nfs/dbraw/zinc/49/02/98/568490298.db2.gz DPCDXAKJEJNUIY-KRWDZBQOSA-N 1 0 371.550 5.052 20 0 FKADRO CC(=O)N(c1nc(C[NH2+]C[C@H]2CCCC2(C)C)cs1)c1ccc(C)cc1 ZINC000559352159 568490295 /nfs/dbraw/zinc/49/02/95/568490295.db2.gz DPCDXAKJEJNUIY-QGZVFWFLSA-N 1 0 371.550 5.052 20 0 FKADRO Fc1ccc(CC2([NH2+]Cc3cc(Cl)cs3)CCOCC2)c(Cl)c1 ZINC000559352591 568490232 /nfs/dbraw/zinc/49/02/32/568490232.db2.gz REJANDZWPKPGOO-UHFFFAOYSA-N 1 0 374.308 5.076 20 0 FKADRO Cc1sc(C2(NCc3ccc(C)nc3)CCC2)nc1-c1ccccc1F ZINC000559359468 568490420 /nfs/dbraw/zinc/49/04/20/568490420.db2.gz JIWNQFNKPLNYNA-UHFFFAOYSA-N 1 0 367.493 5.130 20 0 FKADRO Cc1sc(C2(NCc3cnccc3C)CCC2)nc1-c1ccccc1F ZINC000559361019 568490468 /nfs/dbraw/zinc/49/04/68/568490468.db2.gz CQWPVIRTROJGBQ-UHFFFAOYSA-N 1 0 367.493 5.130 20 0 FKADRO Cc1ncsc1CNC1(c2nc(-c3ccccc3F)c(C)s2)CCC1 ZINC000559361863 568490519 /nfs/dbraw/zinc/49/05/19/568490519.db2.gz YMLGYDFSKUCRNZ-UHFFFAOYSA-N 1 0 373.522 5.192 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1coc(-c2ccccc2)n1 ZINC000559376059 568490885 /nfs/dbraw/zinc/49/08/85/568490885.db2.gz DPXWXDYGEMRORW-HNNXBMFYSA-N 1 0 355.507 5.423 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1coc(-c2ccccc2)n1 ZINC000559376060 568490867 /nfs/dbraw/zinc/49/08/67/568490867.db2.gz DPXWXDYGEMRORW-OAHLLOKOSA-N 1 0 355.507 5.423 20 0 FKADRO Cc1cc(C)c(NC(=O)CCC[NH2+][C@@H](C)c2ccccc2Cl)c(C)c1 ZINC000559400054 568491219 /nfs/dbraw/zinc/49/12/19/568491219.db2.gz BTLOPCPCTHMNEU-KRWDZBQOSA-N 1 0 358.913 5.335 20 0 FKADRO C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000559418757 568491477 /nfs/dbraw/zinc/49/14/77/568491477.db2.gz ARQSOKJOJJQZNB-DGCLKSJQSA-N 1 0 366.292 5.226 20 0 FKADRO C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000559418758 568491435 /nfs/dbraw/zinc/49/14/35/568491435.db2.gz ARQSOKJOJJQZNB-WCQYABFASA-N 1 0 366.292 5.226 20 0 FKADRO C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000559418759 568491461 /nfs/dbraw/zinc/49/14/61/568491461.db2.gz ARQSOKJOJJQZNB-YPMHNXCESA-N 1 0 366.292 5.226 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3Cl)o2)[C@@H]2CCC[C@@H]21 ZINC000559432641 568491733 /nfs/dbraw/zinc/49/17/33/568491733.db2.gz QLGOAGDGADUFPG-DZGCQCFKSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3Cl)o2)[C@H]2CCC[C@H]21 ZINC000559432644 568491713 /nfs/dbraw/zinc/49/17/13/568491713.db2.gz QLGOAGDGADUFPG-HIFRSBDPSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3Cl)o2)[C@@H]2CCC[C@H]21 ZINC000559432645 568491792 /nfs/dbraw/zinc/49/17/92/568491792.db2.gz QLGOAGDGADUFPG-UKRRQHHQSA-N 1 0 366.292 5.054 20 0 FKADRO CC1(C)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3Cl)o2)[C@H]2CCC[C@@H]21 ZINC000559432646 568491782 /nfs/dbraw/zinc/49/17/82/568491782.db2.gz QLGOAGDGADUFPG-ZFWWWQNUSA-N 1 0 366.292 5.054 20 0 FKADRO Cc1sc(C2([NH2+]CCOC(C)(C)C)CCC2)nc1-c1ccccc1F ZINC000559479174 568492252 /nfs/dbraw/zinc/49/22/52/568492252.db2.gz LGKQQLLXDUDRMK-UHFFFAOYSA-N 1 0 362.514 5.042 20 0 FKADRO COCCCCC[NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1 ZINC000559479457 568492256 /nfs/dbraw/zinc/49/22/56/568492256.db2.gz IVNFPQIPMJHEFY-UHFFFAOYSA-N 1 0 362.514 5.043 20 0 FKADRO CC(C)Oc1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000559732097 568494788 /nfs/dbraw/zinc/49/47/88/568494788.db2.gz JBOXTXWZELXUNZ-HNNXBMFYSA-N 1 0 366.324 5.075 20 0 FKADRO CC(C)Oc1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000559732100 568494856 /nfs/dbraw/zinc/49/48/56/568494856.db2.gz JBOXTXWZELXUNZ-OAHLLOKOSA-N 1 0 366.324 5.075 20 0 FKADRO CC(C)C(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559732955 568494791 /nfs/dbraw/zinc/49/47/91/568494791.db2.gz ZGVUFKMEUZYQFU-INIZCTEOSA-N 1 0 364.464 5.424 20 0 FKADRO CC(C)C(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559732958 568494845 /nfs/dbraw/zinc/49/48/45/568494845.db2.gz ZGVUFKMEUZYQFU-MRXNPFEDSA-N 1 0 364.464 5.424 20 0 FKADRO Cc1cc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)c(C)c1 ZINC000559733028 568494825 /nfs/dbraw/zinc/49/48/25/568494825.db2.gz KYAHWUCNMGNGBA-KRWDZBQOSA-N 1 0 364.464 5.193 20 0 FKADRO Cc1cc(C)c(NC(=O)C[NH2+][C@H](C)c2ccc(F)c3ccccc32)c(C)c1 ZINC000559733038 568494850 /nfs/dbraw/zinc/49/48/50/568494850.db2.gz KYAHWUCNMGNGBA-QGZVFWFLSA-N 1 0 364.464 5.193 20 0 FKADRO CC(C)c1ccc([C@@H]([NH2+]Cc2cnc3ccccc3c2)c2cccs2)cc1 ZINC000559737475 568495049 /nfs/dbraw/zinc/49/50/49/568495049.db2.gz JMUAVZCNWZCMFE-XMMPIXPASA-N 1 0 372.537 6.299 20 0 FKADRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc(F)c2ccccc21 ZINC000559738990 568495022 /nfs/dbraw/zinc/49/50/22/568495022.db2.gz MDCIGSLMIIUNCZ-BXKMTCNYSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc(F)c2ccccc21 ZINC000559738991 568495037 /nfs/dbraw/zinc/49/50/37/568495037.db2.gz MDCIGSLMIIUNCZ-MZNJEOGPSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc(F)c2ccccc21 ZINC000559738992 568495081 /nfs/dbraw/zinc/49/50/81/568495081.db2.gz MDCIGSLMIIUNCZ-OSPHWJPCSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc(F)c2ccccc21 ZINC000559738993 568495067 /nfs/dbraw/zinc/49/50/67/568495067.db2.gz MDCIGSLMIIUNCZ-XDHUDOTRSA-N 1 0 356.444 5.814 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1ccc(F)c2ccccc21 ZINC000559739479 568495056 /nfs/dbraw/zinc/49/50/56/568495056.db2.gz IZADOZMWMWPGGF-KRWDZBQOSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1ccc(F)c2ccccc21 ZINC000559739480 568495075 /nfs/dbraw/zinc/49/50/75/568495075.db2.gz IZADOZMWMWPGGF-QGZVFWFLSA-N 1 0 359.448 5.075 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(C(=O)Nc2ccccc2)c1)c1cccc(C2CC2)c1 ZINC000559740219 568495070 /nfs/dbraw/zinc/49/50/70/568495070.db2.gz UGGVMYQENPZDBH-GOSISDBHSA-N 1 0 370.496 5.667 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(C(=O)Nc2ccccc2)c1)c1cccc(C2CC2)c1 ZINC000559740222 568495084 /nfs/dbraw/zinc/49/50/84/568495084.db2.gz UGGVMYQENPZDBH-SFHVURJKSA-N 1 0 370.496 5.667 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@@H](C)c3cccc(C4CC4)c3)cn2)c1 ZINC000559740889 568495092 /nfs/dbraw/zinc/49/50/92/568495092.db2.gz HOPFYGRLRPTOJG-KRWDZBQOSA-N 1 0 374.484 5.611 20 0 FKADRO COc1cccc(Oc2ccc(C[NH2+][C@H](C)c3cccc(C4CC4)c3)cn2)c1 ZINC000559740892 568495090 /nfs/dbraw/zinc/49/50/90/568495090.db2.gz HOPFYGRLRPTOJG-QGZVFWFLSA-N 1 0 374.484 5.611 20 0 FKADRO COc1ccc(Oc2cc(C[NH2+][C@@H](C)c3cccc(C4CC4)c3)ccn2)cc1 ZINC000559741153 568494954 /nfs/dbraw/zinc/49/49/54/568494954.db2.gz ZJSARBABOIZMPH-KRWDZBQOSA-N 1 0 374.484 5.611 20 0 FKADRO COc1ccc(Oc2cc(C[NH2+][C@H](C)c3cccc(C4CC4)c3)ccn2)cc1 ZINC000559741156 568495063 /nfs/dbraw/zinc/49/50/63/568495063.db2.gz ZJSARBABOIZMPH-QGZVFWFLSA-N 1 0 374.484 5.611 20 0 FKADRO C[C@@H]([NH2+]Cc1cccc(C(=O)N2CCCCC2)c1)c1cccc(C2CC2)c1 ZINC000559742632 568494963 /nfs/dbraw/zinc/49/49/63/568494963.db2.gz AZDULTRWGOXSJU-GOSISDBHSA-N 1 0 362.517 5.041 20 0 FKADRO C[C@H]([NH2+]Cc1cccc(C(=O)N2CCCCC2)c1)c1cccc(C2CC2)c1 ZINC000559742634 568495078 /nfs/dbraw/zinc/49/50/78/568495078.db2.gz AZDULTRWGOXSJU-SFHVURJKSA-N 1 0 362.517 5.041 20 0 FKADRO C[C@H]([NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccncc1F ZINC000559743955 568494958 /nfs/dbraw/zinc/49/49/58/568494958.db2.gz TXYXRWZTPAHPIM-BTYIYWSLSA-N 1 0 354.856 5.509 20 0 FKADRO C[C@@H]([NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccncc1F ZINC000559743957 568494970 /nfs/dbraw/zinc/49/49/70/568494970.db2.gz TXYXRWZTPAHPIM-QVKFZJNVSA-N 1 0 354.856 5.509 20 0 FKADRO C[C@@H]([NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccncc1F ZINC000559743960 568495029 /nfs/dbraw/zinc/49/50/29/568495029.db2.gz TXYXRWZTPAHPIM-VFNWGFHPSA-N 1 0 354.856 5.509 20 0 FKADRO C[C@H]([NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccncc1F ZINC000559743963 568495133 /nfs/dbraw/zinc/49/51/33/568495133.db2.gz TXYXRWZTPAHPIM-YCRPNKLZSA-N 1 0 354.856 5.509 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1cccc(C2CC2)c1 ZINC000559744087 568495188 /nfs/dbraw/zinc/49/51/88/568495188.db2.gz VOBVXMYLPQEEMT-INIZCTEOSA-N 1 0 360.457 5.260 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1cccc(C2CC2)c1 ZINC000559744088 568495179 /nfs/dbraw/zinc/49/51/79/568495179.db2.gz VOBVXMYLPQEEMT-MRXNPFEDSA-N 1 0 360.457 5.260 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(C2CC2)c1 ZINC000559753378 568495143 /nfs/dbraw/zinc/49/51/43/568495143.db2.gz LPYAGVCZHDVDKQ-KRWDZBQOSA-N 1 0 371.484 5.062 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(C2CC2)c1 ZINC000559753379 568495195 /nfs/dbraw/zinc/49/51/95/568495195.db2.gz LPYAGVCZHDVDKQ-QGZVFWFLSA-N 1 0 371.484 5.062 20 0 FKADRO C[C@H]([NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccncc1F ZINC000559753455 568495185 /nfs/dbraw/zinc/49/51/85/568495185.db2.gz NTOQQMMLGXYIQH-QKKBWIMNSA-N 1 0 356.391 5.134 20 0 FKADRO C[C@@H]([NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccncc1F ZINC000559753456 568495225 /nfs/dbraw/zinc/49/52/25/568495225.db2.gz NTOQQMMLGXYIQH-SPLOXXLWSA-N 1 0 356.391 5.134 20 0 FKADRO C[C@@H]([NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccncc1F ZINC000559753457 568495200 /nfs/dbraw/zinc/49/52/00/568495200.db2.gz NTOQQMMLGXYIQH-SZNDQCEHSA-N 1 0 356.391 5.134 20 0 FKADRO CCOc1cc(C[NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)ccc1OC ZINC000559765220 568489864 /nfs/dbraw/zinc/48/98/64/568489864.db2.gz IAUHDWLEHAAVSS-UHFFFAOYSA-N 1 0 367.411 5.138 20 0 FKADRO CC(C)([NH2+]Cc1ccc(OCc2cccnc2)cc1)c1ccc(Cl)cc1 ZINC000559765362 568490013 /nfs/dbraw/zinc/49/00/13/568490013.db2.gz PKLUNHACPCIMPB-UHFFFAOYSA-N 1 0 366.892 5.339 20 0 FKADRO Cc1ccc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)c(OC[C@H]2CCOC2)c1 ZINC000559774231 568491277 /nfs/dbraw/zinc/49/12/77/568491277.db2.gz OBFSYGFRYZNWBG-MOPGFXCFSA-N 1 0 365.517 5.139 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)c(OC[C@H]2CCOC2)c1 ZINC000559774232 568491237 /nfs/dbraw/zinc/49/12/37/568491237.db2.gz OBFSYGFRYZNWBG-OALUTQOASA-N 1 0 365.517 5.139 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)c(OC[C@@H]2CCOC2)c1 ZINC000559774233 568491248 /nfs/dbraw/zinc/49/12/48/568491248.db2.gz OBFSYGFRYZNWBG-RBUKOAKNSA-N 1 0 365.517 5.139 20 0 FKADRO Cc1ccc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)c(OC[C@@H]2CCOC2)c1 ZINC000559774234 568491257 /nfs/dbraw/zinc/49/12/57/568491257.db2.gz OBFSYGFRYZNWBG-RTBURBONSA-N 1 0 365.517 5.139 20 0 FKADRO COCCC[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(F)cc1 ZINC000559775640 568491194 /nfs/dbraw/zinc/49/11/94/568491194.db2.gz XYQSVTZSGJOIHA-KRWDZBQOSA-N 1 0 356.268 5.390 20 0 FKADRO COCCC[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(F)cc1 ZINC000559775644 568491192 /nfs/dbraw/zinc/49/11/92/568491192.db2.gz XYQSVTZSGJOIHA-QGZVFWFLSA-N 1 0 356.268 5.390 20 0 FKADRO C[C@H]([NH2+][C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)c1ccncc1F ZINC000559786039 568491774 /nfs/dbraw/zinc/49/17/74/568491774.db2.gz GKUPEDSPTBSAFS-DYZYQPBXSA-N 1 0 372.793 5.695 20 0 FKADRO C[C@@H]([NH2+][C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)c1ccncc1F ZINC000559786040 568491767 /nfs/dbraw/zinc/49/17/67/568491767.db2.gz GKUPEDSPTBSAFS-QGHHPUGFSA-N 1 0 372.793 5.695 20 0 FKADRO c1sc(CCC[NH2+][C@H]2CCCCC23CCCC3)nc1-c1ccncc1 ZINC000559787337 568491914 /nfs/dbraw/zinc/49/19/14/568491914.db2.gz NMPHURMLHUABTL-IBGZPJMESA-N 1 0 355.551 5.230 20 0 FKADRO c1sc(CCC[NH2+][C@@H]2CCCCC23CCCC3)nc1-c1ccncc1 ZINC000559787338 568491864 /nfs/dbraw/zinc/49/18/64/568491864.db2.gz NMPHURMLHUABTL-LJQANCHMSA-N 1 0 355.551 5.230 20 0 FKADRO Cc1noc(C2CCC([NH2+][C@H](C)c3ccc(F)c4ccccc43)CC2)n1 ZINC000559790617 568492949 /nfs/dbraw/zinc/49/29/49/568492949.db2.gz ZUHMWYGHWLDNFA-IUDNXUCKSA-N 1 0 353.441 5.047 20 0 FKADRO Cc1noc(C2CCC([NH2+][C@@H](C)c3ccc(F)c4ccccc43)CC2)n1 ZINC000559790618 568492924 /nfs/dbraw/zinc/49/29/24/568492924.db2.gz ZUHMWYGHWLDNFA-JEYLPNPQSA-N 1 0 353.441 5.047 20 0 FKADRO CC(C)n1ncc2cc(C[NH2+][C@@H](C)c3ccc(F)c4ccccc43)cnc21 ZINC000559808797 568494610 /nfs/dbraw/zinc/49/46/10/568494610.db2.gz PUXKJPZTDMNCLB-HNNXBMFYSA-N 1 0 362.452 5.155 20 0 FKADRO CC(C)n1ncc2cc(C[NH2+][C@H](C)c3ccc(F)c4ccccc43)cnc21 ZINC000559808798 568494502 /nfs/dbraw/zinc/49/45/02/568494502.db2.gz PUXKJPZTDMNCLB-OAHLLOKOSA-N 1 0 362.452 5.155 20 0 FKADRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(OCc3cccnc3)cc2)cc1Cl ZINC000559817096 568495088 /nfs/dbraw/zinc/49/50/88/568495088.db2.gz VNNHRULZHSPELU-KRWDZBQOSA-N 1 0 366.892 5.473 20 0 FKADRO Cc1ccc(C[NH2+][C@H](C)c2ccc(OCc3cccnc3)cc2)cc1Cl ZINC000559817097 568495003 /nfs/dbraw/zinc/49/50/03/568495003.db2.gz VNNHRULZHSPELU-QGZVFWFLSA-N 1 0 366.892 5.473 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(F)c2ccccc21 ZINC000559835034 568497448 /nfs/dbraw/zinc/49/74/48/568497448.db2.gz APPIQEUFDIMOQR-FMKFIRIRSA-N 1 0 367.439 5.689 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(F)c2ccccc21 ZINC000559835035 568497508 /nfs/dbraw/zinc/49/75/08/568497508.db2.gz APPIQEUFDIMOQR-HOSQHVHZSA-N 1 0 367.439 5.689 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(F)c2ccccc21 ZINC000559835036 568497441 /nfs/dbraw/zinc/49/74/41/568497441.db2.gz APPIQEUFDIMOQR-TUVUNVSASA-N 1 0 367.439 5.689 20 0 FKADRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(F)c2ccccc21 ZINC000559835037 568497446 /nfs/dbraw/zinc/49/74/46/568497446.db2.gz APPIQEUFDIMOQR-WIRVKHDMSA-N 1 0 367.439 5.689 20 0 FKADRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000559841545 568497867 /nfs/dbraw/zinc/49/78/67/568497867.db2.gz CIIIORWAFAKHDG-NXEZZACHSA-N 1 0 356.251 5.065 20 0 FKADRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559841546 568497877 /nfs/dbraw/zinc/49/78/77/568497877.db2.gz CIIIORWAFAKHDG-UWVGGRQHSA-N 1 0 356.251 5.065 20 0 FKADRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559841547 568498013 /nfs/dbraw/zinc/49/80/13/568498013.db2.gz CIIIORWAFAKHDG-VHSXEESVSA-N 1 0 356.251 5.065 20 0 FKADRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000559841548 568497913 /nfs/dbraw/zinc/49/79/13/568497913.db2.gz CIIIORWAFAKHDG-ZJUUUORDSA-N 1 0 356.251 5.065 20 0 FKADRO CC(C)(C)OC1CC(CC[NH2+][C@@H]2CCc3sc(Br)cc32)C1 ZINC000559841946 568498019 /nfs/dbraw/zinc/49/80/19/568498019.db2.gz CQUVQHMLVYTOBD-ORHYLEIMSA-N 1 0 372.372 5.071 20 0 FKADRO CC(C)(C)OC1CC(CC[NH2+][C@H]2CCc3sc(Br)cc32)C1 ZINC000559841951 568497967 /nfs/dbraw/zinc/49/79/67/568497967.db2.gz CQUVQHMLVYTOBD-YIZWMMSDSA-N 1 0 372.372 5.071 20 0 FKADRO C[C@H](CCCC(F)(F)F)[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559842380 568498175 /nfs/dbraw/zinc/49/81/75/568498175.db2.gz NELXLWJZDGWXFA-SCZZXKLOSA-N 1 0 356.251 5.209 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000559842381 568498118 /nfs/dbraw/zinc/49/81/18/568498118.db2.gz NELXLWJZDGWXFA-WCBMZHEXSA-N 1 0 356.251 5.209 20 0 FKADRO C[C@@H](CCCC(F)(F)F)[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559842382 568498145 /nfs/dbraw/zinc/49/81/45/568498145.db2.gz NELXLWJZDGWXFA-WPRPVWTQSA-N 1 0 356.251 5.209 20 0 FKADRO C[C@@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc(F)c2ccccc21 ZINC000559842769 568498116 /nfs/dbraw/zinc/49/81/16/568498116.db2.gz QCHFADDXSXHSKE-CYBMUJFWSA-N 1 0 367.855 5.370 20 0 FKADRO C[C@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc(F)c2ccccc21 ZINC000559842770 568498119 /nfs/dbraw/zinc/49/81/19/568498119.db2.gz QCHFADDXSXHSKE-ZDUSSCGKSA-N 1 0 367.855 5.370 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)c1cc2cccc(F)c2o1 ZINC000559842828 568498121 /nfs/dbraw/zinc/49/81/21/568498121.db2.gz JSJPMKUMWWELHF-CVAIRZPRSA-N 1 0 352.453 5.058 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cc2cccc(F)c2o1 ZINC000559842829 568498098 /nfs/dbraw/zinc/49/80/98/568498098.db2.gz JSJPMKUMWWELHF-QKYXUNIQSA-N 1 0 352.453 5.058 20 0 FKADRO C[C@H]([NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1cc2cccc(F)c2o1 ZINC000559842830 568498111 /nfs/dbraw/zinc/49/81/11/568498111.db2.gz JSJPMKUMWWELHF-QSFXBCCZSA-N 1 0 352.453 5.058 20 0 FKADRO C[C@H]([NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cc2cccc(F)c2o1 ZINC000559842831 568498156 /nfs/dbraw/zinc/49/81/56/568498156.db2.gz JSJPMKUMWWELHF-ZAAXVRCTSA-N 1 0 352.453 5.058 20 0 FKADRO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2n1C)c1ccc(F)c2ccccc21 ZINC000559843084 568498149 /nfs/dbraw/zinc/49/81/49/568498149.db2.gz OOMCCXHNVHITGN-CYBMUJFWSA-N 1 0 367.855 5.370 20 0 FKADRO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2n1C)c1ccc(F)c2ccccc21 ZINC000559843087 568498166 /nfs/dbraw/zinc/49/81/66/568498166.db2.gz OOMCCXHNVHITGN-ZDUSSCGKSA-N 1 0 367.855 5.370 20 0 FKADRO Clc1ccccc1C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)C1CC1 ZINC000559843400 568498246 /nfs/dbraw/zinc/49/82/46/568498246.db2.gz LZZWWEURXQKNMV-BVSLBCMMSA-N 1 0 355.909 5.029 20 0 FKADRO Clc1ccccc1C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)C1CC1 ZINC000559843401 568498236 /nfs/dbraw/zinc/49/82/36/568498236.db2.gz LZZWWEURXQKNMV-NNWRFLSQSA-N 1 0 355.909 5.029 20 0 FKADRO CCCNc1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000559844375 568498377 /nfs/dbraw/zinc/49/83/77/568498377.db2.gz QAGFYWQDANMOMC-HNNXBMFYSA-N 1 0 365.340 5.110 20 0 FKADRO CCCNc1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000559844392 568498407 /nfs/dbraw/zinc/49/84/07/568498407.db2.gz QAGFYWQDANMOMC-OAHLLOKOSA-N 1 0 365.340 5.110 20 0 FKADRO C[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccc(F)c2ccccc21 ZINC000559845829 568498360 /nfs/dbraw/zinc/49/83/60/568498360.db2.gz VQOLARCPLUHCHM-BLVKFPJESA-N 1 0 361.819 5.156 20 0 FKADRO C[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccc(F)c2ccccc21 ZINC000559845830 568498402 /nfs/dbraw/zinc/49/84/02/568498402.db2.gz VQOLARCPLUHCHM-BUXKBTBVSA-N 1 0 361.819 5.156 20 0 FKADRO C[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccc(F)c2ccccc21 ZINC000559845831 568498410 /nfs/dbraw/zinc/49/84/10/568498410.db2.gz VQOLARCPLUHCHM-CWTRNNRKSA-N 1 0 361.819 5.156 20 0 FKADRO C[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccc(F)c2ccccc21 ZINC000559845832 568498374 /nfs/dbraw/zinc/49/83/74/568498374.db2.gz VQOLARCPLUHCHM-HXPMCKFVSA-N 1 0 361.819 5.156 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559854251 568498798 /nfs/dbraw/zinc/49/87/98/568498798.db2.gz JHQAIOVNIMDXFK-KRWDZBQOSA-N 1 0 367.464 5.245 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559854265 568498757 /nfs/dbraw/zinc/49/87/57/568498757.db2.gz JHQAIOVNIMDXFK-QGZVFWFLSA-N 1 0 367.464 5.245 20 0 FKADRO Clc1cc2c(s1)CC[C@H]2[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000559855134 568498764 /nfs/dbraw/zinc/49/87/64/568498764.db2.gz LQAHBWPBAVJQMC-NXEZZACHSA-N 1 0 374.756 5.490 20 0 FKADRO Clc1cc2c(s1)CC[C@@H]2[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559855136 568498800 /nfs/dbraw/zinc/49/88/00/568498800.db2.gz LQAHBWPBAVJQMC-UWVGGRQHSA-N 1 0 374.756 5.490 20 0 FKADRO Clc1cc2c(s1)CC[C@H]2[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000559855137 568498783 /nfs/dbraw/zinc/49/87/83/568498783.db2.gz LQAHBWPBAVJQMC-VHSXEESVSA-N 1 0 374.756 5.490 20 0 FKADRO Clc1cc2c(s1)CC[C@@H]2[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000559855138 568498717 /nfs/dbraw/zinc/49/87/17/568498717.db2.gz LQAHBWPBAVJQMC-ZJUUUORDSA-N 1 0 374.756 5.490 20 0 FKADRO CN1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C[C@@H]1c1ccccc1 ZINC000559860049 568499184 /nfs/dbraw/zinc/49/91/84/568499184.db2.gz YDNIKQCEZZIZJQ-CGTJXYLNSA-N 1 0 360.954 5.204 20 0 FKADRO CN1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C[C@H]1c1ccccc1 ZINC000559860050 568499204 /nfs/dbraw/zinc/49/92/04/568499204.db2.gz YDNIKQCEZZIZJQ-JQHSSLGASA-N 1 0 360.954 5.204 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)C[C@@H]1c1ccccc1 ZINC000559860200 568499117 /nfs/dbraw/zinc/49/91/17/568499117.db2.gz YDNIKQCEZZIZJQ-RYQLBKOJSA-N 1 0 360.954 5.204 20 0 FKADRO CN1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)C[C@H]1c1ccccc1 ZINC000559860203 568499108 /nfs/dbraw/zinc/49/91/08/568499108.db2.gz YDNIKQCEZZIZJQ-SZMVWBNQSA-N 1 0 360.954 5.204 20 0 FKADRO c1[nH]nc(-c2ccccc2)c1C[NH2+]Cc1cccc(Oc2ccccc2)c1 ZINC000559868015 568500476 /nfs/dbraw/zinc/50/04/76/568500476.db2.gz NDERYHMMHLJHJA-UHFFFAOYSA-N 1 0 355.441 5.159 20 0 FKADRO COc1ccncc1C[NH2+][C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000559869659 568500636 /nfs/dbraw/zinc/50/06/36/568500636.db2.gz AXEGLGWWNVNEMS-ZDUSSCGKSA-N 1 0 358.894 5.323 20 0 FKADRO CSc1ccc(C[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)cc1 ZINC000559869935 568500588 /nfs/dbraw/zinc/50/05/88/568500588.db2.gz CVUJOGWXRSFTJY-UHFFFAOYSA-N 1 0 366.511 5.568 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cc2)ccc1OC1CCCC1 ZINC000559871756 568500807 /nfs/dbraw/zinc/50/08/07/568500807.db2.gz XBTOURUKNOWFEN-HNNXBMFYSA-N 1 0 359.897 5.521 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000559876040 568500904 /nfs/dbraw/zinc/50/09/04/568500904.db2.gz DDTJCNOYVVUHDX-CYBMUJFWSA-N 1 0 373.365 5.590 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000559876056 568501027 /nfs/dbraw/zinc/50/10/27/568501027.db2.gz DDTJCNOYVVUHDX-ZDUSSCGKSA-N 1 0 373.365 5.590 20 0 FKADRO FC(F)(F)c1cccc(CC[NH2+]C2c3ccccc3-c3ccccc32)n1 ZINC000559876249 568501083 /nfs/dbraw/zinc/50/10/83/568501083.db2.gz DYDFCQSPDAZTEI-UHFFFAOYSA-N 1 0 354.375 5.003 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C)c1cc[nH]c(=O)c1 ZINC000559876445 568500995 /nfs/dbraw/zinc/50/09/95/568500995.db2.gz HBKFERYOYKDZSS-NEPJUHHUSA-N 1 0 373.909 5.284 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]Cc1coc2ccccc12 ZINC000559876457 568500993 /nfs/dbraw/zinc/50/09/93/568500993.db2.gz HDLHZIVKXYLOPU-HNNXBMFYSA-N 1 0 362.498 5.639 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@@H](C)c1cc[nH]c(=O)c1 ZINC000559876458 568500999 /nfs/dbraw/zinc/50/09/99/568500999.db2.gz HBKFERYOYKDZSS-NWDGAFQWSA-N 1 0 373.909 5.284 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C)c1cc[nH]c(=O)c1 ZINC000559876459 568501059 /nfs/dbraw/zinc/50/10/59/568501059.db2.gz HBKFERYOYKDZSS-RYUDHWBXSA-N 1 0 373.909 5.284 20 0 FKADRO Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@H](C)c1cc[nH]c(=O)c1 ZINC000559876461 568501031 /nfs/dbraw/zinc/50/10/31/568501031.db2.gz HBKFERYOYKDZSS-VXGBXAGGSA-N 1 0 373.909 5.284 20 0 FKADRO Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1coc2ccccc12 ZINC000559876463 568501064 /nfs/dbraw/zinc/50/10/64/568501064.db2.gz HDLHZIVKXYLOPU-OAHLLOKOSA-N 1 0 362.498 5.639 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000559877446 568501007 /nfs/dbraw/zinc/50/10/07/568501007.db2.gz LRJPMULPGDGGPQ-GOSISDBHSA-N 1 0 360.404 5.132 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000559877453 568501051 /nfs/dbraw/zinc/50/10/51/568501051.db2.gz LRJPMULPGDGGPQ-SFHVURJKSA-N 1 0 360.404 5.132 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1OC ZINC000559878490 568501164 /nfs/dbraw/zinc/50/11/64/568501164.db2.gz SOUPTKJADGEEIP-PBHICJAKSA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1OC ZINC000559878495 568501144 /nfs/dbraw/zinc/50/11/44/568501144.db2.gz SOUPTKJADGEEIP-RHSMWYFYSA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1OC ZINC000559878496 568501193 /nfs/dbraw/zinc/50/11/93/568501193.db2.gz SOUPTKJADGEEIP-WMLDXEAASA-N 1 0 367.411 5.091 20 0 FKADRO COc1ccc([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1OC ZINC000559878499 568501138 /nfs/dbraw/zinc/50/11/38/568501138.db2.gz SOUPTKJADGEEIP-YOEHRIQHSA-N 1 0 367.411 5.091 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1cccc(-c2ccncc2)c1 ZINC000559878573 568501160 /nfs/dbraw/zinc/50/11/60/568501160.db2.gz RDKZYNVVVIRDSX-HNNXBMFYSA-N 1 0 371.406 5.056 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1cccc(-c2ccncc2)c1 ZINC000559878574 568501158 /nfs/dbraw/zinc/50/11/58/568501158.db2.gz RDKZYNVVVIRDSX-OAHLLOKOSA-N 1 0 371.406 5.056 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)s1 ZINC000559878728 568501290 /nfs/dbraw/zinc/50/12/90/568501290.db2.gz QVTMNIUODMOKJC-DOMZBBRYSA-N 1 0 363.889 5.528 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)s1 ZINC000559878735 568501277 /nfs/dbraw/zinc/50/12/77/568501277.db2.gz QVTMNIUODMOKJC-IUODEOHRSA-N 1 0 363.889 5.528 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000559878859 568501294 /nfs/dbraw/zinc/50/12/94/568501294.db2.gz RGUNJZSYHYMUJL-KBPBESRZSA-N 1 0 354.400 5.144 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000559878867 568501281 /nfs/dbraw/zinc/50/12/81/568501281.db2.gz RGUNJZSYHYMUJL-KGLIPLIRSA-N 1 0 354.400 5.144 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2c(F)cccc2F)cc1)c1cc[nH]c(=O)c1 ZINC000559878870 568501323 /nfs/dbraw/zinc/50/13/23/568501323.db2.gz RGUNJZSYHYMUJL-UONOGXRCSA-N 1 0 354.400 5.144 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1cc[nH]c(=O)c1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000559878872 568501275 /nfs/dbraw/zinc/50/12/75/568501275.db2.gz RGUNJZSYHYMUJL-ZIAGYGMSSA-N 1 0 354.400 5.144 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1Cl ZINC000559879026 568501263 /nfs/dbraw/zinc/50/12/63/568501263.db2.gz XIAREYKAYJUTIW-DOMZBBRYSA-N 1 0 372.818 5.130 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1Cl ZINC000559879029 568501258 /nfs/dbraw/zinc/50/12/58/568501258.db2.gz XIAREYKAYJUTIW-IUODEOHRSA-N 1 0 372.818 5.130 20 0 FKADRO COc1ncc([C@H](C)[NH2+]CC[C@H](c2ccccc2)C(F)(F)F)cc1Cl ZINC000559879030 568501267 /nfs/dbraw/zinc/50/12/67/568501267.db2.gz XIAREYKAYJUTIW-SWLSCSKDSA-N 1 0 372.818 5.130 20 0 FKADRO COc1ncc([C@H](C)[NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)cc1Cl ZINC000559879031 568501326 /nfs/dbraw/zinc/50/13/26/568501326.db2.gz XIAREYKAYJUTIW-WFASDCNBSA-N 1 0 372.818 5.130 20 0 FKADRO COCCC[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(F)cc1 ZINC000559879266 568501330 /nfs/dbraw/zinc/50/13/30/568501330.db2.gz ZYCNZBROJWSEGM-IBGZPJMESA-N 1 0 351.412 5.195 20 0 FKADRO COCCC[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(F)cc1 ZINC000559879280 568501259 /nfs/dbraw/zinc/50/12/59/568501259.db2.gz ZYCNZBROJWSEGM-LJQANCHMSA-N 1 0 351.412 5.195 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000559879306 568501346 /nfs/dbraw/zinc/50/13/46/568501346.db2.gz QYEZOWDXPHRCPN-CABCVRRESA-N 1 0 352.409 5.130 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1cc[nH]c(=O)c1 ZINC000559879309 568501264 /nfs/dbraw/zinc/50/12/64/568501264.db2.gz QYEZOWDXPHRCPN-GJZGRUSLSA-N 1 0 352.409 5.130 20 0 FKADRO C[C@@H]([NH2+][C@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1cc[nH]c(=O)c1 ZINC000559879312 568501320 /nfs/dbraw/zinc/50/13/20/568501320.db2.gz QYEZOWDXPHRCPN-HUUCEWRRSA-N 1 0 352.409 5.130 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1cc[nH]c(=O)c1 ZINC000559879316 568501261 /nfs/dbraw/zinc/50/12/61/568501261.db2.gz QYEZOWDXPHRCPN-LSDHHAIUSA-N 1 0 352.409 5.130 20 0 FKADRO C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1C(F)(F)F ZINC000559879336 568501248 /nfs/dbraw/zinc/50/12/48/568501248.db2.gz WEKVYGXZRRRGOI-LLVKDONJSA-N 1 0 362.317 5.013 20 0 FKADRO C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1C(F)(F)F ZINC000559879345 568501268 /nfs/dbraw/zinc/50/12/68/568501268.db2.gz WEKVYGXZRRRGOI-NSHDSACASA-N 1 0 362.317 5.013 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000559879610 568501301 /nfs/dbraw/zinc/50/13/01/568501301.db2.gz XZLYNRNGAFZPGG-CYBMUJFWSA-N 1 0 372.278 5.399 20 0 FKADRO CC(F)(F)c1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000559879612 568501306 /nfs/dbraw/zinc/50/13/06/568501306.db2.gz XZLYNRNGAFZPGG-ZDUSSCGKSA-N 1 0 372.278 5.399 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc(OCc2ccccc2C)cc1 ZINC000559880249 568501313 /nfs/dbraw/zinc/50/13/13/568501313.db2.gz HHBHSXQOLOINMP-KRWDZBQOSA-N 1 0 364.489 5.284 20 0 FKADRO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc(OCc2ccccc2C)cc1 ZINC000559880250 568501337 /nfs/dbraw/zinc/50/13/37/568501337.db2.gz HHBHSXQOLOINMP-QGZVFWFLSA-N 1 0 364.489 5.284 20 0 FKADRO Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]CC[C@@H](C)F ZINC000559891107 568496760 /nfs/dbraw/zinc/49/67/60/568496760.db2.gz OADHVYGPWWYDNF-MNOVXSKESA-N 1 0 371.319 5.280 20 0 FKADRO Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]CC[C@H](C)F ZINC000559891108 568496736 /nfs/dbraw/zinc/49/67/36/568496736.db2.gz OADHVYGPWWYDNF-QWRGUYRKSA-N 1 0 371.319 5.280 20 0 FKADRO Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]CC[C@H](C)F ZINC000559891109 568496729 /nfs/dbraw/zinc/49/67/29/568496729.db2.gz OADHVYGPWWYDNF-WDEREUQCSA-N 1 0 371.319 5.280 20 0 FKADRO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCc1cc(C(F)(F)F)ccn1 ZINC000559891540 568496668 /nfs/dbraw/zinc/49/66/68/568496668.db2.gz BBHIWWWYGJHABW-LLVKDONJSA-N 1 0 371.472 5.056 20 0 FKADRO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCc1cc(C(F)(F)F)ccn1 ZINC000559891541 568496756 /nfs/dbraw/zinc/49/67/56/568496756.db2.gz BBHIWWWYGJHABW-NSHDSACASA-N 1 0 371.472 5.056 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2sccc2C)ccn1 ZINC000559893052 568496882 /nfs/dbraw/zinc/49/68/82/568496882.db2.gz FLKSTTJPXRXIHY-APWZRJJASA-N 1 0 352.503 5.095 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2sccc2C)ccn1 ZINC000559893058 568496805 /nfs/dbraw/zinc/49/68/05/568496805.db2.gz FLKSTTJPXRXIHY-LPHOPBHVSA-N 1 0 352.503 5.095 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2sccc2C)ccn1 ZINC000559893061 568496845 /nfs/dbraw/zinc/49/68/45/568496845.db2.gz FLKSTTJPXRXIHY-QFBILLFUSA-N 1 0 352.503 5.095 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2sccc2C)ccn1 ZINC000559893063 568496799 /nfs/dbraw/zinc/49/67/99/568496799.db2.gz FLKSTTJPXRXIHY-VQIMIIECSA-N 1 0 352.503 5.095 20 0 FKADRO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1COCc1ccccc1)CCC2 ZINC000559893718 568496854 /nfs/dbraw/zinc/49/68/54/568496854.db2.gz MVZGWUPSDUZETG-VWLOTQADSA-N 1 0 373.496 5.276 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@@H]3CCCc4c(O)cccc43)c(C)c2c1 ZINC000559893835 568496778 /nfs/dbraw/zinc/49/67/78/568496778.db2.gz OAZLIZZHVIYFHR-AUUYWEPGSA-N 1 0 351.446 5.184 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@@H]3CCCc4c(O)cccc43)c(C)c2c1 ZINC000559893836 568496782 /nfs/dbraw/zinc/49/67/82/568496782.db2.gz OAZLIZZHVIYFHR-IFXJQAMLSA-N 1 0 351.446 5.184 20 0 FKADRO COc1ccc2oc([C@@H](C)[NH2+][C@H]3CCCc4c(O)cccc43)c(C)c2c1 ZINC000559893838 568496892 /nfs/dbraw/zinc/49/68/92/568496892.db2.gz OAZLIZZHVIYFHR-KUHUBIRLSA-N 1 0 351.446 5.184 20 0 FKADRO COc1ccc2oc([C@H](C)[NH2+][C@H]3CCCc4c(O)cccc43)c(C)c2c1 ZINC000559893842 568496890 /nfs/dbraw/zinc/49/68/90/568496890.db2.gz OAZLIZZHVIYFHR-LIRRHRJNSA-N 1 0 351.446 5.184 20 0 FKADRO CC(C)C[C@H]([NH2+][C@H](C)c1ccncc1F)c1cccc(C(F)(F)F)c1 ZINC000559894357 568496826 /nfs/dbraw/zinc/49/68/26/568496826.db2.gz MAPJMBNLSWBWLB-ACJLOTCBSA-N 1 0 354.391 5.678 20 0 FKADRO CC(C)C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1cccc(C(F)(F)F)c1 ZINC000559894362 568496769 /nfs/dbraw/zinc/49/67/69/568496769.db2.gz MAPJMBNLSWBWLB-FZKQIMNGSA-N 1 0 354.391 5.678 20 0 FKADRO CC(C)C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1cccc(C(F)(F)F)c1 ZINC000559894363 568496839 /nfs/dbraw/zinc/49/68/39/568496839.db2.gz MAPJMBNLSWBWLB-SCLBCKFNSA-N 1 0 354.391 5.678 20 0 FKADRO CCCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1OC ZINC000559894964 568496828 /nfs/dbraw/zinc/49/68/28/568496828.db2.gz PHVJVBQASCFQEG-CVEARBPZSA-N 1 0 360.473 5.210 20 0 FKADRO CCCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1OC ZINC000559894967 568496887 /nfs/dbraw/zinc/49/68/87/568496887.db2.gz PHVJVBQASCFQEG-HOTGVXAUSA-N 1 0 360.473 5.210 20 0 FKADRO CCCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2F)cc1OC ZINC000559894969 568496815 /nfs/dbraw/zinc/49/68/15/568496815.db2.gz PHVJVBQASCFQEG-HZPDHXFCSA-N 1 0 360.473 5.210 20 0 FKADRO CCCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2F)cc1OC ZINC000559894971 568496956 /nfs/dbraw/zinc/49/69/56/568496956.db2.gz PHVJVBQASCFQEG-JKSUJKDBSA-N 1 0 360.473 5.210 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@@H]2CCCc3c(O)cccc32)c2ccccn2)cc1 ZINC000559895512 568496935 /nfs/dbraw/zinc/49/69/35/568496935.db2.gz XGKDJENPMDMHAJ-FYYLOGMGSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@@H]2CCCc3c(O)cccc32)c2ccccn2)cc1 ZINC000559895517 568496989 /nfs/dbraw/zinc/49/69/89/568496989.db2.gz XGKDJENPMDMHAJ-GGAORHGYSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@H]2CCCc3c(O)cccc32)c2ccccn2)cc1 ZINC000559895519 568496969 /nfs/dbraw/zinc/49/69/69/568496969.db2.gz XGKDJENPMDMHAJ-GMAHTHKFSA-N 1 0 358.485 5.047 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@H]2CCCc3c(O)cccc32)c2ccccn2)cc1 ZINC000559895522 568496986 /nfs/dbraw/zinc/49/69/86/568496986.db2.gz XGKDJENPMDMHAJ-JTHBVZDNSA-N 1 0 358.485 5.047 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000559895652 568496926 /nfs/dbraw/zinc/49/69/26/568496926.db2.gz YVJBHZXEQYAGEX-DEOSSOPVSA-N 1 0 373.496 5.276 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000559895653 568496946 /nfs/dbraw/zinc/49/69/46/568496946.db2.gz YVJBHZXEQYAGEX-XMMPIXPASA-N 1 0 373.496 5.276 20 0 FKADRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000559896772 568498168 /nfs/dbraw/zinc/49/81/68/568498168.db2.gz AKKBADYVMSLFJU-JTQLQIEISA-N 1 0 358.429 5.166 20 0 FKADRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000559896773 568498172 /nfs/dbraw/zinc/49/81/72/568498172.db2.gz AKKBADYVMSLFJU-SNVBAGLBSA-N 1 0 358.429 5.166 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000559897290 568500818 /nfs/dbraw/zinc/50/08/18/568500818.db2.gz IDRVEHMGQXTNSH-MOPGFXCFSA-N 1 0 359.416 5.038 20 0 FKADRO Oc1cccc2c1CCC[C@@H]2[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000559897291 568500813 /nfs/dbraw/zinc/50/08/13/568500813.db2.gz IDRVEHMGQXTNSH-OALUTQOASA-N 1 0 359.416 5.038 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000559897292 568500893 /nfs/dbraw/zinc/50/08/93/568500893.db2.gz IDRVEHMGQXTNSH-RBUKOAKNSA-N 1 0 359.416 5.038 20 0 FKADRO Oc1cccc2c1CCC[C@H]2[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000559897293 568500888 /nfs/dbraw/zinc/50/08/88/568500888.db2.gz IDRVEHMGQXTNSH-RTBURBONSA-N 1 0 359.416 5.038 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)c(F)c1 ZINC000559897794 568496639 /nfs/dbraw/zinc/49/66/39/568496639.db2.gz QRMURIBLRHAMRS-OLZOCXBDSA-N 1 0 361.823 5.216 20 0 FKADRO C[C@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)c(F)c1 ZINC000559897795 568496575 /nfs/dbraw/zinc/49/65/75/568496575.db2.gz QRMURIBLRHAMRS-STQMWFEESA-N 1 0 361.823 5.216 20 0 FKADRO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000559898233 568496754 /nfs/dbraw/zinc/49/67/54/568496754.db2.gz ZJJZNECXSNSALK-KBPBESRZSA-N 1 0 373.859 5.085 20 0 FKADRO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000559898234 568496649 /nfs/dbraw/zinc/49/66/49/568496649.db2.gz ZJJZNECXSNSALK-UONOGXRCSA-N 1 0 373.859 5.085 20 0 FKADRO CCC[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccc(OC)cc1 ZINC000559900037 568504282 /nfs/dbraw/zinc/50/42/82/568504282.db2.gz RJAALWUPKPYDOP-KRWDZBQOSA-N 1 0 353.384 5.067 20 0 FKADRO CCC[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccc(OC)cc1 ZINC000559900043 568504208 /nfs/dbraw/zinc/50/42/08/568504208.db2.gz RJAALWUPKPYDOP-QGZVFWFLSA-N 1 0 353.384 5.067 20 0 FKADRO Cc1nccnc1CC[NH2+][C@@H](C)c1ccc(-c2ccccc2Cl)s1 ZINC000559900058 568504200 /nfs/dbraw/zinc/50/42/00/568504200.db2.gz RTBPCAKHVIDUGU-AWEZNQCLSA-N 1 0 357.910 5.060 20 0 FKADRO Cc1nccnc1CC[NH2+][C@H](C)c1ccc(-c2ccccc2Cl)s1 ZINC000559900061 568504259 /nfs/dbraw/zinc/50/42/59/568504259.db2.gz RTBPCAKHVIDUGU-CQSZACIVSA-N 1 0 357.910 5.060 20 0 FKADRO Cc1cc([C@@H](C)NCc2ccc(OC(C)(C)C)cc2C(F)(F)F)no1 ZINC000559902412 568501399 /nfs/dbraw/zinc/50/13/99/568501399.db2.gz SMBVAFFSYRAIDE-GFCCVEGCSA-N 1 0 356.388 5.030 20 0 FKADRO Cc1cc([C@H](C)NCc2ccc(OC(C)(C)C)cc2C(F)(F)F)no1 ZINC000559902417 568501510 /nfs/dbraw/zinc/50/15/10/568501510.db2.gz SMBVAFFSYRAIDE-LBPRGKRZSA-N 1 0 356.388 5.030 20 0 FKADRO Cc1ccccc1C(N[C@@H](C)c1cn2ccccc2n1)c1ccccc1C ZINC000559902728 568501442 /nfs/dbraw/zinc/50/14/42/568501442.db2.gz VDTIRFHKHCTFQQ-IBGZPJMESA-N 1 0 355.485 5.391 20 0 FKADRO Cc1ccccc1C(N[C@H](C)c1cn2ccccc2n1)c1ccccc1C ZINC000559902734 568501506 /nfs/dbraw/zinc/50/15/06/568501506.db2.gz VDTIRFHKHCTFQQ-LJQANCHMSA-N 1 0 355.485 5.391 20 0 FKADRO C[C@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1cn2ccccc2n1 ZINC000559905740 568501437 /nfs/dbraw/zinc/50/14/37/568501437.db2.gz ZEDVOOBGHHRDDY-AWEZNQCLSA-N 1 0 374.469 5.055 20 0 FKADRO C[C@@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1cn2ccccc2n1 ZINC000559905741 568501501 /nfs/dbraw/zinc/50/15/01/568501501.db2.gz ZEDVOOBGHHRDDY-CQSZACIVSA-N 1 0 374.469 5.055 20 0 FKADRO Cc1cc([C@@H](C)[NH2+]CC2(c3cc(C(F)(F)F)ccc3Cl)CC2)no1 ZINC000559907039 568501913 /nfs/dbraw/zinc/50/19/13/568501913.db2.gz MKDDTFVHHVHSQN-LLVKDONJSA-N 1 0 358.791 5.038 20 0 FKADRO Cc1cc([C@H](C)[NH2+]CC2(c3cc(C(F)(F)F)ccc3Cl)CC2)no1 ZINC000559907040 568501900 /nfs/dbraw/zinc/50/19/00/568501900.db2.gz MKDDTFVHHVHSQN-NSHDSACASA-N 1 0 358.791 5.038 20 0 FKADRO COc1ccc([C@@H](N[C@@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915067 568502281 /nfs/dbraw/zinc/50/22/81/568502281.db2.gz DCTDPZYDWUWZCD-LHSJRXKWSA-N 1 0 370.855 5.323 20 0 FKADRO COc1ccc([C@H](N[C@@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915073 568502172 /nfs/dbraw/zinc/50/21/72/568502172.db2.gz DCTDPZYDWUWZCD-QKKBWIMNSA-N 1 0 370.855 5.323 20 0 FKADRO COc1ccc([C@@H](N[C@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915075 568502279 /nfs/dbraw/zinc/50/22/79/568502279.db2.gz DCTDPZYDWUWZCD-SPLOXXLWSA-N 1 0 370.855 5.323 20 0 FKADRO COc1ccc([C@H](N[C@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915077 568502211 /nfs/dbraw/zinc/50/22/11/568502211.db2.gz DCTDPZYDWUWZCD-SZNDQCEHSA-N 1 0 370.855 5.323 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1cn2ccccc2n1 ZINC000559915145 568502376 /nfs/dbraw/zinc/50/23/76/568502376.db2.gz INUXANZTUDQYOV-ORAYPTAESA-N 1 0 359.395 5.155 20 0 FKADRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ccc(Br)cn1 ZINC000559917903 568502686 /nfs/dbraw/zinc/50/26/86/568502686.db2.gz CQVPPBAHJICDRK-OBJOEFQTSA-N 1 0 365.702 5.094 20 0 FKADRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2Cl)C1)c1ccc(Br)cn1 ZINC000559917915 568502651 /nfs/dbraw/zinc/50/26/51/568502651.db2.gz CQVPPBAHJICDRK-YRGRVCCFSA-N 1 0 365.702 5.094 20 0 FKADRO C[NH+](C)Cc1ccccc1NC(=O)CCCc1cc(Cl)sc1Cl ZINC000559919480 568502661 /nfs/dbraw/zinc/50/26/61/568502661.db2.gz HTCHBTYLFBRERW-UHFFFAOYSA-N 1 0 371.333 5.078 20 0 FKADRO C[C@@H]([NH2+][C@H](CCc1ccccc1)c1ccccc1)c1cn2ccccc2n1 ZINC000559920324 568502812 /nfs/dbraw/zinc/50/28/12/568502812.db2.gz VAOPPJUWNMOZSO-DENIHFKCSA-N 1 0 355.485 5.359 20 0 FKADRO C[C@@H]([NH2+][C@@H](CCc1ccccc1)c1ccccc1)c1cn2ccccc2n1 ZINC000559920325 568502784 /nfs/dbraw/zinc/50/27/84/568502784.db2.gz VAOPPJUWNMOZSO-KNQAVFIVSA-N 1 0 355.485 5.359 20 0 FKADRO C[C@H]([NH2+][C@H](CCc1ccccc1)c1ccccc1)c1cn2ccccc2n1 ZINC000559920326 568502722 /nfs/dbraw/zinc/50/27/22/568502722.db2.gz VAOPPJUWNMOZSO-SIKLNZKXSA-N 1 0 355.485 5.359 20 0 FKADRO C[C@H]([NH2+][C@@H](CCc1ccccc1)c1ccccc1)c1cn2ccccc2n1 ZINC000559920327 568502761 /nfs/dbraw/zinc/50/27/61/568502761.db2.gz VAOPPJUWNMOZSO-UGKGYDQZSA-N 1 0 355.485 5.359 20 0 FKADRO CC(C)[C@@H]([NH2+][C@H](C)c1cn2ccccc2n1)c1ccc(C(F)(F)F)cc1 ZINC000559923016 568502910 /nfs/dbraw/zinc/50/29/10/568502910.db2.gz ZKTXULMRGWVLED-AUUYWEPGSA-N 1 0 361.411 5.401 20 0 FKADRO CC(C)[C@@H]([NH2+][C@@H](C)c1cn2ccccc2n1)c1ccc(C(F)(F)F)cc1 ZINC000559923017 568502949 /nfs/dbraw/zinc/50/29/49/568502949.db2.gz ZKTXULMRGWVLED-IFXJQAMLSA-N 1 0 361.411 5.401 20 0 FKADRO CC(C)[C@H]([NH2+][C@H](C)c1cn2ccccc2n1)c1ccc(C(F)(F)F)cc1 ZINC000559923018 568502945 /nfs/dbraw/zinc/50/29/45/568502945.db2.gz ZKTXULMRGWVLED-KUHUBIRLSA-N 1 0 361.411 5.401 20 0 FKADRO CC(C)[C@H]([NH2+][C@@H](C)c1cn2ccccc2n1)c1ccc(C(F)(F)F)cc1 ZINC000559923019 568502922 /nfs/dbraw/zinc/50/29/22/568502922.db2.gz ZKTXULMRGWVLED-LIRRHRJNSA-N 1 0 361.411 5.401 20 0 FKADRO CCc1ccccc1NC(=O)CN(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000559933640 568503326 /nfs/dbraw/zinc/50/33/26/568503326.db2.gz FFKVEONGYYPUBU-CYBMUJFWSA-N 1 0 365.304 5.187 20 0 FKADRO CCc1ccccc1NC(=O)CN(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000559933641 568503397 /nfs/dbraw/zinc/50/33/97/568503397.db2.gz FFKVEONGYYPUBU-ZDUSSCGKSA-N 1 0 365.304 5.187 20 0 FKADRO Fc1cccc2c1CC[C@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000559954337 568503742 /nfs/dbraw/zinc/50/37/42/568503742.db2.gz KPGFXCLDMMDTOV-GOSISDBHSA-N 1 0 358.869 5.380 20 0 FKADRO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000559954338 568503779 /nfs/dbraw/zinc/50/37/79/568503779.db2.gz KPGFXCLDMMDTOV-SFHVURJKSA-N 1 0 358.869 5.380 20 0 FKADRO CCCNc1ccc(C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000560003080 568509116 /nfs/dbraw/zinc/50/91/16/568509116.db2.gz XDAWSDSJKGOROZ-HNNXBMFYSA-N 1 0 366.427 5.300 20 0 FKADRO CCCNc1ccc(C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000560003081 568509126 /nfs/dbraw/zinc/50/91/26/568509126.db2.gz XDAWSDSJKGOROZ-OAHLLOKOSA-N 1 0 366.427 5.300 20 0 FKADRO Fc1cc2cccnc2c(C[NH2+]Cc2ccc(-c3ccco3)cc2F)c1 ZINC000560024844 568504880 /nfs/dbraw/zinc/50/48/80/568504880.db2.gz KDCNTYKUTIWAEF-UHFFFAOYSA-N 1 0 350.368 5.063 20 0 FKADRO O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000560047809 568513575 /nfs/dbraw/zinc/51/35/75/568513575.db2.gz CYHFJTMMANEFEH-FQEVSTJZSA-N 1 0 364.876 5.275 20 0 FKADRO O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000560047816 568513506 /nfs/dbraw/zinc/51/35/06/568513506.db2.gz CYHFJTMMANEFEH-HXUWFJFHSA-N 1 0 364.876 5.275 20 0 FKADRO CSc1ccc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000560048104 568513517 /nfs/dbraw/zinc/51/35/17/568513517.db2.gz JKEFATYZWWNTLI-UHFFFAOYSA-N 1 0 360.935 5.475 20 0 FKADRO CCC[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccn1 ZINC000560050127 568514021 /nfs/dbraw/zinc/51/40/21/568514021.db2.gz ADVYXLUPDCQMJP-KRWDZBQOSA-N 1 0 357.910 5.490 20 0 FKADRO CCC[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccn1 ZINC000560050128 568513972 /nfs/dbraw/zinc/51/39/72/568513972.db2.gz ADVYXLUPDCQMJP-QGZVFWFLSA-N 1 0 357.910 5.490 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccc2c(c1)OCO2 ZINC000560051593 568514103 /nfs/dbraw/zinc/51/41/03/568514103.db2.gz NSSQUDMRNHNJIE-GFCCVEGCSA-N 1 0 372.877 5.043 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccc2c(c1)OCO2 ZINC000560051594 568514140 /nfs/dbraw/zinc/51/41/40/568514140.db2.gz NSSQUDMRNHNJIE-LBPRGKRZSA-N 1 0 372.877 5.043 20 0 FKADRO COc1cccc([C@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000560061316 568514390 /nfs/dbraw/zinc/51/43/90/568514390.db2.gz VXSPLTSROCGJGY-ZDUSSCGKSA-N 1 0 358.894 5.323 20 0 FKADRO OCc1ccc(C[NH2+]Cc2cccc(Oc3cccc4ccccc43)c2)o1 ZINC000560064855 568514885 /nfs/dbraw/zinc/51/48/85/568514885.db2.gz HENRQMPUIASYAP-UHFFFAOYSA-N 1 0 359.425 5.007 20 0 FKADRO Clc1ccsc1C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560064983 568514911 /nfs/dbraw/zinc/51/49/11/568514911.db2.gz ISEXWQCOOBWWQO-UHFFFAOYSA-N 1 0 355.315 5.468 20 0 FKADRO CCCn1ccc(C[NH2+][C@H](CCOC)c2ccc(Cl)c(Cl)c2)c1 ZINC000560069337 568515073 /nfs/dbraw/zinc/51/50/73/568515073.db2.gz CPUQEBLNUDTTSL-GOSISDBHSA-N 1 0 355.309 5.072 20 0 FKADRO Brc1cncc([C@H]([NH2+]Cc2csc3ccccc23)C2CC2)c1 ZINC000560069419 568515123 /nfs/dbraw/zinc/51/51/23/568515123.db2.gz FELBJEKZFJUUQF-GOSISDBHSA-N 1 0 373.319 5.300 20 0 FKADRO Brc1cncc([C@@H]([NH2+]Cc2csc3ccccc23)C2CC2)c1 ZINC000560069420 568515077 /nfs/dbraw/zinc/51/50/77/568515077.db2.gz FELBJEKZFJUUQF-SFHVURJKSA-N 1 0 373.319 5.300 20 0 FKADRO Brc1cncc([C@@H]([NH2+]Cc2ccc3ccccc3c2)C2CC2)c1 ZINC000560069829 568515092 /nfs/dbraw/zinc/51/50/92/568515092.db2.gz HRYCZJAQDSIVBK-FQEVSTJZSA-N 1 0 367.290 5.238 20 0 FKADRO Brc1cncc([C@H]([NH2+]Cc2ccc3ccccc3c2)C2CC2)c1 ZINC000560069830 568515132 /nfs/dbraw/zinc/51/51/32/568515132.db2.gz HRYCZJAQDSIVBK-HXUWFJFHSA-N 1 0 367.290 5.238 20 0 FKADRO FC(F)c1ccc(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560073208 568515453 /nfs/dbraw/zinc/51/54/53/568515453.db2.gz QRBNRVDMALDZEY-INIZCTEOSA-N 1 0 367.237 5.023 20 0 FKADRO FC(F)c1ccc(C[NH2+][C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560073212 568515473 /nfs/dbraw/zinc/51/54/73/568515473.db2.gz QRBNRVDMALDZEY-MRXNPFEDSA-N 1 0 367.237 5.023 20 0 FKADRO Cc1cc(Cl)ccc1C[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000560073234 568515503 /nfs/dbraw/zinc/51/55/03/568515503.db2.gz RCTAMHIVZOKKJO-KRWDZBQOSA-N 1 0 365.702 5.047 20 0 FKADRO Cc1cc(Cl)ccc1C[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000560073235 568515492 /nfs/dbraw/zinc/51/54/92/568515492.db2.gz RCTAMHIVZOKKJO-QGZVFWFLSA-N 1 0 365.702 5.047 20 0 FKADRO Brc1cncc([C@H]([NH2+]Cc2cc3ccccc3s2)C2CC2)c1 ZINC000560073236 568515431 /nfs/dbraw/zinc/51/54/31/568515431.db2.gz RFIIYSCFFYRWKQ-GOSISDBHSA-N 1 0 373.319 5.300 20 0 FKADRO Brc1cncc([C@@H]([NH2+]Cc2cc3ccccc3s2)C2CC2)c1 ZINC000560073239 568515480 /nfs/dbraw/zinc/51/54/80/568515480.db2.gz RFIIYSCFFYRWKQ-SFHVURJKSA-N 1 0 373.319 5.300 20 0 FKADRO c1coc(-c2ncc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)s2)c1 ZINC000560073641 568515467 /nfs/dbraw/zinc/51/54/67/568515467.db2.gz YAZXLIRKHSBBLA-UHFFFAOYSA-N 1 0 354.475 5.014 20 0 FKADRO c1csc(-c2ncc(C[NH2+]Cc3ccc(OC4CCCC4)cc3)s2)c1 ZINC000560073718 568515512 /nfs/dbraw/zinc/51/55/12/568515512.db2.gz ZPKLSTGZTWVBRH-UHFFFAOYSA-N 1 0 370.543 5.483 20 0 FKADRO CCOc1ccc(C[NH2+]Cc2cnc(C3CCCC3)s2)cc1Cl ZINC000560073869 568515516 /nfs/dbraw/zinc/51/55/16/568515516.db2.gz BJEVTGBCLFOCRR-UHFFFAOYSA-N 1 0 350.915 5.143 20 0 FKADRO Clc1ccc(CCCC[NH2+]Cc2cnc(-c3ccccn3)s2)s1 ZINC000560075762 568515622 /nfs/dbraw/zinc/51/56/22/568515622.db2.gz LJZIJJLYWSUKEP-UHFFFAOYSA-N 1 0 363.939 5.033 20 0 FKADRO CC(C)C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccn1 ZINC000560076793 568515593 /nfs/dbraw/zinc/51/55/93/568515593.db2.gz HGBXSBWYIIVDSB-IBGZPJMESA-N 1 0 371.937 5.736 20 0 FKADRO CC(C)C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccn1 ZINC000560076797 568515586 /nfs/dbraw/zinc/51/55/86/568515586.db2.gz HGBXSBWYIIVDSB-LJQANCHMSA-N 1 0 371.937 5.736 20 0 FKADRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560079370 568510696 /nfs/dbraw/zinc/51/06/96/568510696.db2.gz UWKUCIGXWLPAGJ-CYBMUJFWSA-N 1 0 357.910 5.272 20 0 FKADRO CCc1cnccc1[C@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560079371 568510706 /nfs/dbraw/zinc/51/07/06/568510706.db2.gz UWKUCIGXWLPAGJ-ZDUSSCGKSA-N 1 0 357.910 5.272 20 0 FKADRO CC[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1c(C)noc1C ZINC000560081081 568510761 /nfs/dbraw/zinc/51/07/61/568510761.db2.gz AVBGZVHFJCQVEJ-INIZCTEOSA-N 1 0 361.898 5.309 20 0 FKADRO CC[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1c(C)noc1C ZINC000560081090 568510853 /nfs/dbraw/zinc/51/08/53/568510853.db2.gz AVBGZVHFJCQVEJ-MRXNPFEDSA-N 1 0 361.898 5.309 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc(Cl)cc1 ZINC000560091663 568511456 /nfs/dbraw/zinc/51/14/56/568511456.db2.gz LEZJMECEIUDIEK-APPDUMDISA-N 1 0 365.702 5.299 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc(Cl)cc1 ZINC000560091664 568511377 /nfs/dbraw/zinc/51/13/77/568511377.db2.gz LEZJMECEIUDIEK-DIFFPNOSSA-N 1 0 365.702 5.299 20 0 FKADRO C[C@H]([NH2+][C@H](c1cncc(Br)c1)C1CC1)c1ccc(Cl)cc1 ZINC000560091665 568511379 /nfs/dbraw/zinc/51/13/79/568511379.db2.gz LEZJMECEIUDIEK-GTNSWQLSSA-N 1 0 365.702 5.299 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cncc(Br)c1)C1CC1)c1ccc(Cl)cc1 ZINC000560091666 568511453 /nfs/dbraw/zinc/51/14/53/568511453.db2.gz LEZJMECEIUDIEK-PIGZYNQJSA-N 1 0 365.702 5.299 20 0 FKADRO Fc1ccc(C2([NH2+]Cc3c(Cl)oc4ccccc43)CCOCC2)cc1 ZINC000560142535 568517345 /nfs/dbraw/zinc/51/73/45/568517345.db2.gz NWKZQKWCFHBTFR-UHFFFAOYSA-N 1 0 359.828 5.021 20 0 FKADRO CCCC[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(OC)cc1 ZINC000560162040 568516222 /nfs/dbraw/zinc/51/62/22/568516222.db2.gz ITGOGWCLJRJMKX-GOSISDBHSA-N 1 0 352.400 5.130 20 0 FKADRO CCCC[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(OC)cc1 ZINC000560162042 568516293 /nfs/dbraw/zinc/51/62/93/568516293.db2.gz ITGOGWCLJRJMKX-SFHVURJKSA-N 1 0 352.400 5.130 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(-c2cccnc2)cc1 ZINC000560163138 568518371 /nfs/dbraw/zinc/51/83/71/568518371.db2.gz KNQXDVHMSKKOAQ-CQSZACIVSA-N 1 0 357.379 5.013 20 0 FKADRO FC(F)(F)c1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)nc1 ZINC000560166877 568523468 /nfs/dbraw/zinc/52/34/68/568523468.db2.gz NXJGARXIJBPXGS-UHFFFAOYSA-N 1 0 374.328 5.288 20 0 FKADRO CC(C)C[N@H+](Cc1ccc(C(F)(F)F)cn1)[C@@H]1CCCc2cccnc21 ZINC000560167240 568523488 /nfs/dbraw/zinc/52/34/88/568523488.db2.gz ORLVVCOZSFYSAN-GOSISDBHSA-N 1 0 363.427 5.031 20 0 FKADRO CC(C)C[N@H+](Cc1ccc(C(F)(F)F)cn1)[C@H]1CCCc2cccnc21 ZINC000560167241 568523591 /nfs/dbraw/zinc/52/35/91/568523591.db2.gz ORLVVCOZSFYSAN-SFHVURJKSA-N 1 0 363.427 5.031 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)c2ccccc21 ZINC000560168032 568523655 /nfs/dbraw/zinc/52/36/55/568523655.db2.gz WYSGABCSISIUBK-GFCCVEGCSA-N 1 0 364.798 5.758 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(Cl)c2ccccc21 ZINC000560168033 568523661 /nfs/dbraw/zinc/52/36/61/568523661.db2.gz WYSGABCSISIUBK-LBPRGKRZSA-N 1 0 364.798 5.758 20 0 FKADRO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000560169051 568523634 /nfs/dbraw/zinc/52/36/34/568523634.db2.gz WUERZZICASOZQF-HNNXBMFYSA-N 1 0 365.864 5.240 20 0 FKADRO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000560169052 568523614 /nfs/dbraw/zinc/52/36/14/568523614.db2.gz WUERZZICASOZQF-OAHLLOKOSA-N 1 0 365.864 5.240 20 0 FKADRO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3CCC=C(c4ccccc4)C3)o2)cc1C ZINC000560169874 568523627 /nfs/dbraw/zinc/52/36/27/568523627.db2.gz BSIWBGCAACDQOP-GOSISDBHSA-N 1 0 359.473 5.204 20 0 FKADRO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3CCC=C(c4ccccc4)C3)o2)cc1C ZINC000560169877 568523644 /nfs/dbraw/zinc/52/36/44/568523644.db2.gz BSIWBGCAACDQOP-SFHVURJKSA-N 1 0 359.473 5.204 20 0 FKADRO CC(C)CN(Cc1nnc(C2CC2)n1C1CC1)[C@@H](C)c1ccccc1Cl ZINC000560178320 568524572 /nfs/dbraw/zinc/52/45/72/568524572.db2.gz JQAKWABQSMKDDC-HNNXBMFYSA-N 1 0 372.944 5.363 20 0 FKADRO CC(C)CN(Cc1nnc(C2CC2)n1C1CC1)[C@H](C)c1ccccc1Cl ZINC000560178321 568524612 /nfs/dbraw/zinc/52/46/12/568524612.db2.gz JQAKWABQSMKDDC-OAHLLOKOSA-N 1 0 372.944 5.363 20 0 FKADRO Cc1ccccc1-c1cnc(CN(C)[C@@]2(c3ccccc3)CCCCC2=O)o1 ZINC000560193115 568524932 /nfs/dbraw/zinc/52/49/32/568524932.db2.gz UGZIUPVYMBQNAQ-XMMPIXPASA-N 1 0 374.484 5.120 20 0 FKADRO CCn1c2cccc(F)c2nc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000560194318 568525012 /nfs/dbraw/zinc/52/50/12/568525012.db2.gz CTZZVEKBTAHOIC-UHFFFAOYSA-N 1 0 357.860 5.018 20 0 FKADRO Cc1c(Cl)c(C[NH+]2CCC(F)(c3cccnc3)CC2)nc2ccccc12 ZINC000560205745 568525837 /nfs/dbraw/zinc/52/58/37/568525837.db2.gz LUZPZRFMYDNLNV-UHFFFAOYSA-N 1 0 369.871 5.052 20 0 FKADRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1Cl ZINC000560234291 568527007 /nfs/dbraw/zinc/52/70/07/568527007.db2.gz HGBADMNWYXHIGX-HNNXBMFYSA-N 1 0 358.913 5.252 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1Cl ZINC000560234292 568526979 /nfs/dbraw/zinc/52/69/79/568526979.db2.gz HGBADMNWYXHIGX-OAHLLOKOSA-N 1 0 358.913 5.252 20 0 FKADRO CC(=O)Nc1ccc([C@@H](C)[NH2+]CCCCc2ccc(Cl)s2)cc1 ZINC000560236690 568526947 /nfs/dbraw/zinc/52/69/47/568526947.db2.gz SJYHFKBWNPHACE-CYBMUJFWSA-N 1 0 350.915 5.033 20 0 FKADRO CC(=O)Nc1ccc([C@H](C)[NH2+]CCCCc2ccc(Cl)s2)cc1 ZINC000560236691 568526975 /nfs/dbraw/zinc/52/69/75/568526975.db2.gz SJYHFKBWNPHACE-ZDUSSCGKSA-N 1 0 350.915 5.033 20 0 FKADRO CC(C)Oc1ccc([C@H](C)NC2CC[NH+](C3CCCC3)CC2)cc1Cl ZINC000560241675 568527088 /nfs/dbraw/zinc/52/70/88/568527088.db2.gz UEKVUAFZLQOVJW-INIZCTEOSA-N 1 0 364.961 5.185 20 0 FKADRO CC(C)Oc1ccc([C@@H](C)NC2CC[NH+](C3CCCC3)CC2)cc1Cl ZINC000560241676 568527040 /nfs/dbraw/zinc/52/70/40/568527040.db2.gz UEKVUAFZLQOVJW-MRXNPFEDSA-N 1 0 364.961 5.185 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000560243550 568527205 /nfs/dbraw/zinc/52/72/05/568527205.db2.gz LIKZEZPDSRBYLW-AVCGJXAMSA-N 1 0 353.506 5.294 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000560243551 568527230 /nfs/dbraw/zinc/52/72/30/568527230.db2.gz LIKZEZPDSRBYLW-HARLFGEKSA-N 1 0 353.506 5.294 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000560243552 568527188 /nfs/dbraw/zinc/52/71/88/568527188.db2.gz LIKZEZPDSRBYLW-QTGUNEKASA-N 1 0 353.506 5.294 20 0 FKADRO CCCCOc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000560243553 568527176 /nfs/dbraw/zinc/52/71/76/568527176.db2.gz LIKZEZPDSRBYLW-ZEYPLWLESA-N 1 0 353.506 5.294 20 0 FKADRO CC[C@@H]([NH2+]Cc1cccc2cccnc21)c1ccccc1Br ZINC000560244087 568527220 /nfs/dbraw/zinc/52/72/20/568527220.db2.gz VNEGSIJBAZEIQL-GOSISDBHSA-N 1 0 355.279 5.238 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]C(c2cccs2)c2cccs2)cc1Cl ZINC000560244571 568527385 /nfs/dbraw/zinc/52/73/85/568527385.db2.gz NJIBFFSDHLMLLK-LLVKDONJSA-N 1 0 364.923 5.307 20 0 FKADRO COc1ncc([C@H](C)[NH2+]C(c2cccs2)c2cccs2)cc1Cl ZINC000560244572 568527363 /nfs/dbraw/zinc/52/73/63/568527363.db2.gz NJIBFFSDHLMLLK-NSHDSACASA-N 1 0 364.923 5.307 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)nn(C)c1C ZINC000560244902 568527342 /nfs/dbraw/zinc/52/73/42/568527342.db2.gz QRPRYRGXLZTREG-ACJLOTCBSA-N 1 0 363.933 5.279 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)nn(C)c1C ZINC000560244903 568527361 /nfs/dbraw/zinc/52/73/61/568527361.db2.gz QRPRYRGXLZTREG-FZKQIMNGSA-N 1 0 363.933 5.279 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)nn(C)c1C ZINC000560244904 568527392 /nfs/dbraw/zinc/52/73/92/568527392.db2.gz QRPRYRGXLZTREG-SCLBCKFNSA-N 1 0 363.933 5.279 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1c(C)nn(C)c1C ZINC000560244905 568527334 /nfs/dbraw/zinc/52/73/34/568527334.db2.gz QRPRYRGXLZTREG-UGSOOPFHSA-N 1 0 363.933 5.279 20 0 FKADRO CCC[C@@H]([NH2+][C@@H](C)c1cnc(OC)c(Cl)c1)c1ccc(F)cc1F ZINC000560245141 568527486 /nfs/dbraw/zinc/52/74/86/568527486.db2.gz HKWCQCIJMOLAPW-APPDUMDISA-N 1 0 354.828 5.214 20 0 FKADRO CCC[C@H]([NH2+][C@H](C)c1cnc(OC)c(Cl)c1)c1ccc(F)cc1F ZINC000560245143 568527523 /nfs/dbraw/zinc/52/75/23/568527523.db2.gz HKWCQCIJMOLAPW-DIFFPNOSSA-N 1 0 354.828 5.214 20 0 FKADRO CCC[C@H]([NH2+][C@@H](C)c1cnc(OC)c(Cl)c1)c1ccc(F)cc1F ZINC000560245145 568527463 /nfs/dbraw/zinc/52/74/63/568527463.db2.gz HKWCQCIJMOLAPW-GTNSWQLSSA-N 1 0 354.828 5.214 20 0 FKADRO CCC[C@@H]([NH2+][C@H](C)c1cnc(OC)c(Cl)c1)c1ccc(F)cc1F ZINC000560245146 568527542 /nfs/dbraw/zinc/52/75/42/568527542.db2.gz HKWCQCIJMOLAPW-PIGZYNQJSA-N 1 0 354.828 5.214 20 0 FKADRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000560245855 568527594 /nfs/dbraw/zinc/52/75/94/568527594.db2.gz WUSSOMHELAWVHP-QWHCGFSZSA-N 1 0 350.890 5.014 20 0 FKADRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000560245856 568527692 /nfs/dbraw/zinc/52/76/92/568527692.db2.gz WUSSOMHELAWVHP-STQMWFEESA-N 1 0 350.890 5.014 20 0 FKADRO O[C@H]1CC[C@H]([NH2+][C@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000560245859 568527633 /nfs/dbraw/zinc/52/76/33/568527633.db2.gz XAMQYPGZAZHMMW-DZKIICNBSA-N 1 0 372.372 5.025 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@H]2CCSc3ccc(Cl)cc32)cc1Cl ZINC000560245951 568527648 /nfs/dbraw/zinc/52/76/48/568527648.db2.gz NIMVZIZZZADKOL-BMIGLBTASA-N 1 0 369.317 5.285 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@H]2CCSc3ccc(Cl)cc32)cc1Cl ZINC000560245952 568527750 /nfs/dbraw/zinc/52/77/50/568527750.db2.gz NIMVZIZZZADKOL-BONVTDFDSA-N 1 0 369.317 5.285 20 0 FKADRO COc1ncc([C@@H](C)[NH2+][C@@H]2CCSc3ccc(Cl)cc32)cc1Cl ZINC000560245953 568527834 /nfs/dbraw/zinc/52/78/34/568527834.db2.gz NIMVZIZZZADKOL-MEBBXXQBSA-N 1 0 369.317 5.285 20 0 FKADRO COc1ncc([C@H](C)[NH2+][C@@H]2CCSc3ccc(Cl)cc32)cc1Cl ZINC000560245954 568527773 /nfs/dbraw/zinc/52/77/73/568527773.db2.gz NIMVZIZZZADKOL-ZUZCIYMTSA-N 1 0 369.317 5.285 20 0 FKADRO O[C@H]1CC[C@H]([NH2+][C@@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000560245968 568527816 /nfs/dbraw/zinc/52/78/16/568527816.db2.gz XAMQYPGZAZHMMW-IIAWOOMASA-N 1 0 372.372 5.025 20 0 FKADRO COc1ncc([C@@H](C)[NH2+]Cc2ccc(-c3csc(C)n3)cc2)cc1Cl ZINC000560246479 568527819 /nfs/dbraw/zinc/52/78/19/568527819.db2.gz QMBXPPUFBSYJAV-GFCCVEGCSA-N 1 0 373.909 5.026 20 0 FKADRO COc1ncc([C@H](C)[NH2+]Cc2ccc(-c3csc(C)n3)cc2)cc1Cl ZINC000560246480 568527811 /nfs/dbraw/zinc/52/78/11/568527811.db2.gz QMBXPPUFBSYJAV-LBPRGKRZSA-N 1 0 373.909 5.026 20 0 FKADRO Brc1ccsc1[C@@H]([NH2+]Cc1cccnc1)C1CCCCC1 ZINC000560250881 568522490 /nfs/dbraw/zinc/52/24/90/568522490.db2.gz QTIAOPGFXPJHNR-INIZCTEOSA-N 1 0 365.340 5.317 20 0 FKADRO Brc1ccsc1[C@H]([NH2+]Cc1cccnc1)C1CCCCC1 ZINC000560250899 568522500 /nfs/dbraw/zinc/52/25/00/568522500.db2.gz QTIAOPGFXPJHNR-MRXNPFEDSA-N 1 0 365.340 5.317 20 0 FKADRO C[C@H](NCc1cnc(C(C)(C)C)nc1)c1cc(F)c(Cl)cc1Cl ZINC000560255206 568522784 /nfs/dbraw/zinc/52/27/84/568522784.db2.gz JJKANFLPNOHYBX-JTQLQIEISA-N 1 0 356.272 5.071 20 0 FKADRO C[C@@H](NCc1cnc(C(C)(C)C)nc1)c1cc(F)c(Cl)cc1Cl ZINC000560255207 568522807 /nfs/dbraw/zinc/52/28/07/568522807.db2.gz JJKANFLPNOHYBX-SNVBAGLBSA-N 1 0 356.272 5.071 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)cn1 ZINC000560257021 568522823 /nfs/dbraw/zinc/52/28/23/568522823.db2.gz IYRJMYBTXITHEF-UHFFFAOYSA-N 1 0 359.464 5.002 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)cn1 ZINC000560258348 568524554 /nfs/dbraw/zinc/52/45/54/568524554.db2.gz JETUBZSKPPMDKR-JOCHJYFZSA-N 1 0 357.501 5.218 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)cn1 ZINC000560258356 568524564 /nfs/dbraw/zinc/52/45/64/568524564.db2.gz JETUBZSKPPMDKR-QFIPXVFZSA-N 1 0 357.501 5.218 20 0 FKADRO COc1ccc([C@@H](C[NH+](C)C)N[C@H](C)c2cc3cc(Cl)ccc3o2)cc1 ZINC000560261057 568526019 /nfs/dbraw/zinc/52/60/19/568526019.db2.gz FZSSRFFOXLRODI-AUUYWEPGSA-N 1 0 372.896 5.048 20 0 FKADRO COc1ccc([C@H](C[NH+](C)C)N[C@@H](C)c2cc3cc(Cl)ccc3o2)cc1 ZINC000560261060 568526223 /nfs/dbraw/zinc/52/62/23/568526223.db2.gz FZSSRFFOXLRODI-LIRRHRJNSA-N 1 0 372.896 5.048 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000560263692 568523390 /nfs/dbraw/zinc/52/33/90/568523390.db2.gz ZIEOEHXITSCMLP-INIZCTEOSA-N 1 0 366.892 5.652 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl ZINC000560263693 568523358 /nfs/dbraw/zinc/52/33/58/568523358.db2.gz ZIEOEHXITSCMLP-MRXNPFEDSA-N 1 0 366.892 5.652 20 0 FKADRO Cc1ccc([C@@H](C)[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)o1 ZINC000560264385 568524450 /nfs/dbraw/zinc/52/44/50/568524450.db2.gz AEMZXMSZYAIUFL-KUHUBIRLSA-N 1 0 367.411 5.425 20 0 FKADRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c(C)c1 ZINC000560265219 568529879 /nfs/dbraw/zinc/52/98/79/568529879.db2.gz GXGJLDISUXIFOV-AUUYWEPGSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1ccc([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c(C)c1 ZINC000560265220 568529916 /nfs/dbraw/zinc/52/99/16/568529916.db2.gz GXGJLDISUXIFOV-IFXJQAMLSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1ccc([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c(C)c1 ZINC000560265221 568529942 /nfs/dbraw/zinc/52/99/42/568529942.db2.gz GXGJLDISUXIFOV-KUHUBIRLSA-N 1 0 359.311 5.263 20 0 FKADRO Cc1ccc([C@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c(C)c1 ZINC000560265222 568529908 /nfs/dbraw/zinc/52/99/08/568529908.db2.gz GXGJLDISUXIFOV-LIRRHRJNSA-N 1 0 359.311 5.263 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1N(C)C ZINC000560265530 568529896 /nfs/dbraw/zinc/52/98/96/568529896.db2.gz ONRWFHWFSWBFMR-AWEZNQCLSA-N 1 0 371.937 5.380 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1N(C)C ZINC000560265531 568529887 /nfs/dbraw/zinc/52/98/87/568529887.db2.gz ONRWFHWFSWBFMR-CQSZACIVSA-N 1 0 371.937 5.380 20 0 FKADRO Cc1c([C@@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cnn1C(C)C ZINC000560265652 568529898 /nfs/dbraw/zinc/52/98/98/568529898.db2.gz PGQMQOSKBQYNAN-CYBMUJFWSA-N 1 0 374.941 5.400 20 0 FKADRO Cc1c([C@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cnn1C(C)C ZINC000560265653 568529911 /nfs/dbraw/zinc/52/99/11/568529911.db2.gz PGQMQOSKBQYNAN-ZDUSSCGKSA-N 1 0 374.941 5.400 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1Cl ZINC000560265962 568530081 /nfs/dbraw/zinc/53/00/81/568530081.db2.gz SGLZZPWZTHGOKE-HNNXBMFYSA-N 1 0 369.896 5.084 20 0 FKADRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)cc1Cl ZINC000560265964 568530061 /nfs/dbraw/zinc/53/00/61/568530061.db2.gz SGLZZPWZTHGOKE-OAHLLOKOSA-N 1 0 369.896 5.084 20 0 FKADRO COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1OC ZINC000560266081 568530086 /nfs/dbraw/zinc/53/00/86/568530086.db2.gz DUVHVKVHHLRRNI-HNNXBMFYSA-N 1 0 373.468 5.015 20 0 FKADRO COc1cc(F)c([C@@H](C)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1OC ZINC000560266082 568530024 /nfs/dbraw/zinc/53/00/24/568530024.db2.gz DUVHVKVHHLRRNI-OAHLLOKOSA-N 1 0 373.468 5.015 20 0 FKADRO CCOc1ccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1Cl ZINC000560266377 568530238 /nfs/dbraw/zinc/53/02/38/568530238.db2.gz ORAQXHVSNMUKRJ-INIZCTEOSA-N 1 0 351.874 5.205 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1Cl ZINC000560266379 568530217 /nfs/dbraw/zinc/53/02/17/568530217.db2.gz ORAQXHVSNMUKRJ-MRXNPFEDSA-N 1 0 351.874 5.205 20 0 FKADRO C[C@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccco1 ZINC000560267646 568530176 /nfs/dbraw/zinc/53/01/76/568530176.db2.gz JXUPGRRAWSUVPG-BBRMVZONSA-N 1 0 374.834 5.209 20 0 FKADRO C[C@@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccco1 ZINC000560267647 568530202 /nfs/dbraw/zinc/53/02/02/568530202.db2.gz JXUPGRRAWSUVPG-CJNGLKHVSA-N 1 0 374.834 5.209 20 0 FKADRO C[C@H]([NH2+]C[C@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccco1 ZINC000560267649 568530139 /nfs/dbraw/zinc/53/01/39/568530139.db2.gz JXUPGRRAWSUVPG-XJKSGUPXSA-N 1 0 374.834 5.209 20 0 FKADRO Cc1cc([C@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c(C)s1 ZINC000560268132 568530312 /nfs/dbraw/zinc/53/03/12/568530312.db2.gz XTLSWAAMIXSUFT-APPDUMDISA-N 1 0 365.340 5.324 20 0 FKADRO Cc1cc([C@@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c(C)s1 ZINC000560268133 568530289 /nfs/dbraw/zinc/53/02/89/568530289.db2.gz XTLSWAAMIXSUFT-DIFFPNOSSA-N 1 0 365.340 5.324 20 0 FKADRO Cc1cc([C@H](C)[NH2+][C@H](c2cncc(Br)c2)C2CC2)c(C)s1 ZINC000560268134 568530280 /nfs/dbraw/zinc/53/02/80/568530280.db2.gz XTLSWAAMIXSUFT-GTNSWQLSSA-N 1 0 365.340 5.324 20 0 FKADRO Cc1cc([C@@H](C)[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c(C)s1 ZINC000560268135 568530318 /nfs/dbraw/zinc/53/03/18/568530318.db2.gz XTLSWAAMIXSUFT-PIGZYNQJSA-N 1 0 365.340 5.324 20 0 FKADRO COCC[C@H]([NH2+][C@H](C)c1cncc(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000560268353 568530294 /nfs/dbraw/zinc/53/02/94/568530294.db2.gz LKXUIEXZENNSHM-ACJLOTCBSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@@H]([NH2+][C@H](C)c1cncc(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000560268355 568530344 /nfs/dbraw/zinc/53/03/44/568530344.db2.gz LKXUIEXZENNSHM-FZKQIMNGSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1cncc(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000560268357 568530348 /nfs/dbraw/zinc/53/03/48/568530348.db2.gz LKXUIEXZENNSHM-SCLBCKFNSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1cncc(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000560268359 568530359 /nfs/dbraw/zinc/53/03/59/568530359.db2.gz LKXUIEXZENNSHM-UGSOOPFHSA-N 1 0 353.293 5.125 20 0 FKADRO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccs1 ZINC000560269021 568530354 /nfs/dbraw/zinc/53/03/54/568530354.db2.gz CFDVVPPVGLZCAA-ACJLOTCBSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccs1 ZINC000560269022 568530308 /nfs/dbraw/zinc/53/03/08/568530308.db2.gz CFDVVPPVGLZCAA-FZKQIMNGSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccs1 ZINC000560269024 568530364 /nfs/dbraw/zinc/53/03/64/568530364.db2.gz CFDVVPPVGLZCAA-SCLBCKFNSA-N 1 0 369.452 5.585 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccs1 ZINC000560269026 568530366 /nfs/dbraw/zinc/53/03/66/568530366.db2.gz CFDVVPPVGLZCAA-UGSOOPFHSA-N 1 0 369.452 5.585 20 0 FKADRO COCC[C@@H]([NH2+][C@@H](C)c1cnccc1C)c1ccc(Cl)c(Cl)c1 ZINC000560269310 568530336 /nfs/dbraw/zinc/53/03/36/568530336.db2.gz UQNVVDREBWECLM-SCLBCKFNSA-N 1 0 353.293 5.125 20 0 FKADRO COCC[C@H]([NH2+][C@@H](C)c1cnccc1C)c1ccc(Cl)c(Cl)c1 ZINC000560269311 568530346 /nfs/dbraw/zinc/53/03/46/568530346.db2.gz UQNVVDREBWECLM-UGSOOPFHSA-N 1 0 353.293 5.125 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)ccn1 ZINC000560269472 568530483 /nfs/dbraw/zinc/53/04/83/568530483.db2.gz RBDPBBPLEHJIAI-AWEZNQCLSA-N 1 0 370.852 5.053 20 0 FKADRO FC(F)Oc1cc(C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)ccn1 ZINC000560269474 568530436 /nfs/dbraw/zinc/53/04/36/568530436.db2.gz RBDPBBPLEHJIAI-CQSZACIVSA-N 1 0 370.852 5.053 20 0 FKADRO c1nc2n(c1C[NH2+][C@H](CCCc1ccccc1)c1ccccc1)CCCC2 ZINC000560269487 568530413 /nfs/dbraw/zinc/53/04/13/568530413.db2.gz RGVWQEVILWNVKE-HSZRJFAPSA-N 1 0 359.517 5.073 20 0 FKADRO c1nc2n(c1C[NH2+][C@@H](CCCc1ccccc1)c1ccccc1)CCCC2 ZINC000560269488 568530469 /nfs/dbraw/zinc/53/04/69/568530469.db2.gz RGVWQEVILWNVKE-QHCPKHFHSA-N 1 0 359.517 5.073 20 0 FKADRO CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2ccnc(OC(F)F)c2)cc1 ZINC000560269530 568530475 /nfs/dbraw/zinc/53/04/75/568530475.db2.gz SOWNXKXUQRGFAD-CYBMUJFWSA-N 1 0 352.450 5.034 20 0 FKADRO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2ccnc(OC(F)F)c2)cc1 ZINC000560269531 568530449 /nfs/dbraw/zinc/53/04/49/568530449.db2.gz SOWNXKXUQRGFAD-ZDUSSCGKSA-N 1 0 352.450 5.034 20 0 FKADRO c1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1 ZINC000560269982 568530394 /nfs/dbraw/zinc/53/03/94/568530394.db2.gz YWBSHCKPHZAAIG-GBXCKJPGSA-N 1 0 365.517 5.266 20 0 FKADRO c1ccc([C@@H](C[C@H]2CCOC2)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1 ZINC000560269986 568530498 /nfs/dbraw/zinc/53/04/98/568530498.db2.gz YWBSHCKPHZAAIG-HYBUGGRVSA-N 1 0 365.517 5.266 20 0 FKADRO c1ccc([C@H](C[C@@H]2CCOC2)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1 ZINC000560269988 568530494 /nfs/dbraw/zinc/53/04/94/568530494.db2.gz YWBSHCKPHZAAIG-RDPSFJRHSA-N 1 0 365.517 5.266 20 0 FKADRO c1ccc([C@H](C[C@H]2CCOC2)[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1 ZINC000560269990 568530463 /nfs/dbraw/zinc/53/04/63/568530463.db2.gz YWBSHCKPHZAAIG-YKSBVNFPSA-N 1 0 365.517 5.266 20 0 FKADRO CCC[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(Cl)cc1Cl ZINC000560270242 568530617 /nfs/dbraw/zinc/53/06/17/568530617.db2.gz KVKBQKNWGCHOHB-KRWDZBQOSA-N 1 0 352.309 5.157 20 0 FKADRO CCC[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccc(Cl)cc1Cl ZINC000560270245 568530592 /nfs/dbraw/zinc/53/05/92/568530592.db2.gz KVKBQKNWGCHOHB-QGZVFWFLSA-N 1 0 352.309 5.157 20 0 FKADRO CCOc1ccc(C[NH2+][C@H]2CCSc3ccc(OC)cc32)cc1Cl ZINC000560270253 568530620 /nfs/dbraw/zinc/53/06/20/568530620.db2.gz LBAHSVJQVCBLHS-KRWDZBQOSA-N 1 0 363.910 5.074 20 0 FKADRO CCOc1ccc(C[NH2+][C@@H]2CCSc3ccc(OC)cc32)cc1Cl ZINC000560270259 568530615 /nfs/dbraw/zinc/53/06/15/568530615.db2.gz LBAHSVJQVCBLHS-QGZVFWFLSA-N 1 0 363.910 5.074 20 0 FKADRO C[C@@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccoc1 ZINC000560270449 568530590 /nfs/dbraw/zinc/53/05/90/568530590.db2.gz ORCLMKDHAINVRW-DYVFJYSZSA-N 1 0 374.834 5.209 20 0 FKADRO C[C@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccoc1 ZINC000560270450 568530546 /nfs/dbraw/zinc/53/05/46/568530546.db2.gz ORCLMKDHAINVRW-GUYCJALGSA-N 1 0 374.834 5.209 20 0 FKADRO C[C@H]([NH2+]C[C@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccoc1 ZINC000560270452 568530582 /nfs/dbraw/zinc/53/05/82/568530582.db2.gz ORCLMKDHAINVRW-SUMWQHHRSA-N 1 0 374.834 5.209 20 0 FKADRO C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccc2c(c1)COC2 ZINC000560270699 568530605 /nfs/dbraw/zinc/53/06/05/568530605.db2.gz QHEKEPUWIYNZSQ-CYBMUJFWSA-N 1 0 370.905 5.345 20 0 FKADRO C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccc2c(c1)COC2 ZINC000560270700 568530595 /nfs/dbraw/zinc/53/05/95/568530595.db2.gz QHEKEPUWIYNZSQ-ZDUSSCGKSA-N 1 0 370.905 5.345 20 0 FKADRO CC(C)(C)c1ncc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cn1 ZINC000560285603 568531144 /nfs/dbraw/zinc/53/11/44/568531144.db2.gz VRLIOJSTBFLNBH-QGZVFWFLSA-N 1 0 363.427 5.034 20 0 FKADRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1sccc1Br ZINC000560349051 568537507 /nfs/dbraw/zinc/53/75/07/568537507.db2.gz SRMWEHRCCXHUQI-DMDPSCGWSA-N 1 0 372.353 5.143 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1sccc1Br ZINC000560349052 568537534 /nfs/dbraw/zinc/53/75/34/568537534.db2.gz SRMWEHRCCXHUQI-NQBHXWOUSA-N 1 0 372.353 5.143 20 0 FKADRO CCC(CC)[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)C1CC1 ZINC000560428783 568543592 /nfs/dbraw/zinc/54/35/92/568543592.db2.gz JGNSIMVUDCCUFN-UHFFFAOYSA-N 1 0 350.506 5.335 20 0 FKADRO c1cn(Cc2ccccc2)c(NCc2cnc(C3CCCCC3)s2)[nH+]1 ZINC000560459673 568539323 /nfs/dbraw/zinc/53/93/23/568539323.db2.gz YHBFNZIJKBBEPY-UHFFFAOYSA-N 1 0 352.507 5.048 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)c1ccc2n[nH]cc2c1 ZINC000560504441 568548699 /nfs/dbraw/zinc/54/86/99/568548699.db2.gz SUIYWZQYNXMCNI-CYBMUJFWSA-N 1 0 351.837 5.327 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)c1ccc2n[nH]cc2c1 ZINC000560504442 568548654 /nfs/dbraw/zinc/54/86/54/568548654.db2.gz SUIYWZQYNXMCNI-ZDUSSCGKSA-N 1 0 351.837 5.327 20 0 FKADRO Clc1ccc(-c2nc(C[NH2+]CC3(c4ccccn4)CCC3)cs2)cc1 ZINC000560504490 568548610 /nfs/dbraw/zinc/54/86/10/568548610.db2.gz UWNUUZHGAPHLLS-UHFFFAOYSA-N 1 0 369.921 5.070 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c(C)c1OC ZINC000560513874 568548624 /nfs/dbraw/zinc/54/86/24/568548624.db2.gz JASLENSBPXKISQ-DLBZAZTESA-N 1 0 357.494 5.211 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OC(C)C)c2)c(C)c1OC ZINC000560513875 568548839 /nfs/dbraw/zinc/54/88/39/568548839.db2.gz JASLENSBPXKISQ-IAGOWNOFSA-N 1 0 357.494 5.211 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c(C)c1OC ZINC000560513876 568548842 /nfs/dbraw/zinc/54/88/42/568548842.db2.gz JASLENSBPXKISQ-IRXDYDNUSA-N 1 0 357.494 5.211 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OC(C)C)c2)c(C)c1OC ZINC000560513877 568548820 /nfs/dbraw/zinc/54/88/20/568548820.db2.gz JASLENSBPXKISQ-SJORKVTESA-N 1 0 357.494 5.211 20 0 FKADRO COc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2C(F)(F)F)c(C)c1OC ZINC000560515010 568548960 /nfs/dbraw/zinc/54/89/60/568548960.db2.gz VOJLXHNUBOBNSX-LBPRGKRZSA-N 1 0 371.374 5.021 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)c(C)c1OC ZINC000560516491 568548922 /nfs/dbraw/zinc/54/89/22/568548922.db2.gz KDKDGDJCCCFWPY-KBPBESRZSA-N 1 0 367.411 5.443 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)c(C)c1OC ZINC000560516500 568548934 /nfs/dbraw/zinc/54/89/34/568548934.db2.gz KDKDGDJCCCFWPY-KGLIPLIRSA-N 1 0 367.411 5.443 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)c(C)c1OC ZINC000560516504 568548997 /nfs/dbraw/zinc/54/89/97/568548997.db2.gz KDKDGDJCCCFWPY-UONOGXRCSA-N 1 0 367.411 5.443 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)c(C)c1OC ZINC000560516509 568548910 /nfs/dbraw/zinc/54/89/10/568548910.db2.gz KDKDGDJCCCFWPY-ZIAGYGMSSA-N 1 0 367.411 5.443 20 0 FKADRO COc1cc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)ccc1OC(F)F ZINC000560521382 568549130 /nfs/dbraw/zinc/54/91/30/568549130.db2.gz KGMMQAMSTJPTLF-INIZCTEOSA-N 1 0 353.409 5.157 20 0 FKADRO COc1cc(C[NH2+][C@H](CCC(C)C)c2ccoc2)ccc1OC(F)F ZINC000560521383 568549051 /nfs/dbraw/zinc/54/90/51/568549051.db2.gz KGMMQAMSTJPTLF-MRXNPFEDSA-N 1 0 353.409 5.157 20 0 FKADRO CC[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)c(OC)c1)c1cccc(C)c1 ZINC000560521912 568549141 /nfs/dbraw/zinc/54/91/41/568549141.db2.gz KYJUTLBWKFXKJM-KRWDZBQOSA-N 1 0 367.411 5.186 20 0 FKADRO c1c[nH]c([C@H](NCc2ccccc2OC2CCCC2)C2CCCCC2)n1 ZINC000560522099 568549111 /nfs/dbraw/zinc/54/91/11/568549111.db2.gz UPFZVHPKXIOWEP-OAQYLSRUSA-N 1 0 353.510 5.142 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)c1 ZINC000560523913 568549108 /nfs/dbraw/zinc/54/91/08/568549108.db2.gz HLPBIZHGWLVZJT-HNNXBMFYSA-N 1 0 354.400 5.311 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)c1 ZINC000560523918 568549067 /nfs/dbraw/zinc/54/90/67/568549067.db2.gz HLPBIZHGWLVZJT-OAHLLOKOSA-N 1 0 354.400 5.311 20 0 FKADRO CC[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(OC(F)(F)F)cc1 ZINC000560528646 568550185 /nfs/dbraw/zinc/55/01/85/568550185.db2.gz IVYFQDDBEGKWRJ-GOSISDBHSA-N 1 0 360.379 5.374 20 0 FKADRO CC[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(OC(F)(F)F)cc1 ZINC000560528647 568550177 /nfs/dbraw/zinc/55/01/77/568550177.db2.gz IVYFQDDBEGKWRJ-SFHVURJKSA-N 1 0 360.379 5.374 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3s2)c(C)c1OC ZINC000560530817 568550347 /nfs/dbraw/zinc/55/03/47/568550347.db2.gz SKJCWQJGNIPVMX-GJZGRUSLSA-N 1 0 355.503 5.639 20 0 FKADRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)c(C)c1OC ZINC000560530818 568550335 /nfs/dbraw/zinc/55/03/35/568550335.db2.gz SKJCWQJGNIPVMX-HUUCEWRRSA-N 1 0 355.503 5.639 20 0 FKADRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)c(C)c1OC ZINC000560530819 568550293 /nfs/dbraw/zinc/55/02/93/568550293.db2.gz SKJCWQJGNIPVMX-LSDHHAIUSA-N 1 0 355.503 5.639 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@H](C)c2cc(C)ccn2)ccc1OC1CCCC1 ZINC000560531985 568550322 /nfs/dbraw/zinc/55/03/22/568550322.db2.gz QOPXNFZFDBJJKF-DLBZAZTESA-N 1 0 354.494 5.132 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccn2)ccc1OC1CCCC1 ZINC000560531986 568550318 /nfs/dbraw/zinc/55/03/18/568550318.db2.gz QOPXNFZFDBJJKF-IAGOWNOFSA-N 1 0 354.494 5.132 20 0 FKADRO COc1cc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)ccc1OC1CCCC1 ZINC000560531987 568550340 /nfs/dbraw/zinc/55/03/40/568550340.db2.gz QOPXNFZFDBJJKF-IRXDYDNUSA-N 1 0 354.494 5.132 20 0 FKADRO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)ccc1OC1CCCC1 ZINC000560531988 568550308 /nfs/dbraw/zinc/55/03/08/568550308.db2.gz QOPXNFZFDBJJKF-SJORKVTESA-N 1 0 354.494 5.132 20 0 FKADRO COCc1ccccc1/C=C(/C)C[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000560532591 568550408 /nfs/dbraw/zinc/55/04/08/568550408.db2.gz CAMOQYRJYBOUHW-BFCLXNFXSA-N 1 0 355.444 5.289 20 0 FKADRO COCc1ccccc1/C=C(\C)C[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000560532592 568550397 /nfs/dbraw/zinc/55/03/97/568550397.db2.gz CAMOQYRJYBOUHW-KJPNRUOZSA-N 1 0 355.444 5.289 20 0 FKADRO C[N@H+](Cc1ccc(Sc2ccccn2)o1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000560532995 568550399 /nfs/dbraw/zinc/55/03/99/568550399.db2.gz SWTLYSLIFQTFAW-OKILXGFUSA-N 1 0 370.440 5.379 20 0 FKADRO Cc1ccccc1[C@H](C(C)C)[N@H+](C)Cc1cnc(-c2ccncc2)s1 ZINC000560535111 568550875 /nfs/dbraw/zinc/55/08/75/568550875.db2.gz ICEUDDMQAVHDIW-FQEVSTJZSA-N 1 0 351.519 5.343 20 0 FKADRO Cc1ccccc1[C@@H](C(C)C)[N@H+](C)Cc1cnc(-c2ccncc2)s1 ZINC000560535112 568551210 /nfs/dbraw/zinc/55/12/10/568551210.db2.gz ICEUDDMQAVHDIW-HXUWFJFHSA-N 1 0 351.519 5.343 20 0 FKADRO COC(=O)c1csc([C@@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000560536581 568545288 /nfs/dbraw/zinc/54/52/88/568545288.db2.gz KXSHBPAXFJXZCE-SNVBAGLBSA-N 1 0 370.301 5.181 20 0 FKADRO CCS(=O)(=O)c1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(CC(C)C)c2)cc1 ZINC000560536643 568545308 /nfs/dbraw/zinc/54/53/08/568545308.db2.gz OZVJUCZPBBJHDM-MSOLQXFVSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(CC(C)C)c2)cc1 ZINC000560536650 568545302 /nfs/dbraw/zinc/54/53/02/568545302.db2.gz OZVJUCZPBBJHDM-QZTJIDSGSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(CC(C)C)c2)cc1 ZINC000560536652 568545277 /nfs/dbraw/zinc/54/52/77/568545277.db2.gz OZVJUCZPBBJHDM-ROUUACIJSA-N 1 0 373.562 5.091 20 0 FKADRO CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@H](C)c2cccc(CC(C)C)c2)cc1 ZINC000560536656 568545260 /nfs/dbraw/zinc/54/52/60/568545260.db2.gz OZVJUCZPBBJHDM-ZWKOTPCHSA-N 1 0 373.562 5.091 20 0 FKADRO CC[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(OC(F)(F)F)cc1 ZINC000560537910 568545281 /nfs/dbraw/zinc/54/52/81/568545281.db2.gz DHMDNIBGLCRQGA-SFHVURJKSA-N 1 0 360.379 5.374 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)c(C)c1OC ZINC000560538758 568545576 /nfs/dbraw/zinc/54/55/76/568545576.db2.gz PDIQLYAWWGXVQE-KKUMJFAQSA-N 1 0 359.432 5.032 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c(C)c1OC ZINC000560538759 568545561 /nfs/dbraw/zinc/54/55/61/568545561.db2.gz PDIQLYAWWGXVQE-RRFJBIMHSA-N 1 0 359.432 5.032 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)c(C)c1OC ZINC000560538760 568545566 /nfs/dbraw/zinc/54/55/66/568545566.db2.gz PDIQLYAWWGXVQE-SOUVJXGZSA-N 1 0 359.432 5.032 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)c(C)c1OC ZINC000560538761 568545580 /nfs/dbraw/zinc/54/55/80/568545580.db2.gz PDIQLYAWWGXVQE-ZNMIVQPWSA-N 1 0 359.432 5.032 20 0 FKADRO c1sc(COc2ccccc2)nc1C[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC000560542025 568546600 /nfs/dbraw/zinc/54/66/00/568546600.db2.gz KZORYIUCBXVKDH-NRFANRHFSA-N 1 0 364.514 5.006 20 0 FKADRO c1sc(COc2ccccc2)nc1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000560542026 568546528 /nfs/dbraw/zinc/54/65/28/568546528.db2.gz KZORYIUCBXVKDH-OAQYLSRUSA-N 1 0 364.514 5.006 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)c1 ZINC000560543194 568546977 /nfs/dbraw/zinc/54/69/77/568546977.db2.gz AZULYSQYZDLDPT-CQSZACIVSA-N 1 0 357.910 5.060 20 0 FKADRO CC[NH+](CC)Cc1cccc(N[C@@H](C)c2ccc(OC)c(OC)c2C)c1 ZINC000560543621 568546997 /nfs/dbraw/zinc/54/69/97/568546997.db2.gz FEEKRSQQYPUGCX-KRWDZBQOSA-N 1 0 356.510 5.027 20 0 FKADRO CC[NH+](CC)Cc1cccc(N[C@H](C)c2ccc(OC)c(OC)c2C)c1 ZINC000560543623 568546916 /nfs/dbraw/zinc/54/69/16/568546916.db2.gz FEEKRSQQYPUGCX-QGZVFWFLSA-N 1 0 356.510 5.027 20 0 FKADRO FC(F)(F)Oc1cccc([C@@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)C2CC2)c1 ZINC000560544398 568546950 /nfs/dbraw/zinc/54/69/50/568546950.db2.gz PXACUFKQWKBVKB-AEFFLSMTSA-N 1 0 369.427 5.118 20 0 FKADRO FC(F)(F)Oc1cccc([C@H]([NH2+][C@H]2CCOC3(CCCC3)C2)C2CC2)c1 ZINC000560544400 568547011 /nfs/dbraw/zinc/54/70/11/568547011.db2.gz PXACUFKQWKBVKB-FUHWJXTLSA-N 1 0 369.427 5.118 20 0 FKADRO FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)C2CC2)c1 ZINC000560544402 568547002 /nfs/dbraw/zinc/54/70/02/568547002.db2.gz PXACUFKQWKBVKB-SJLPKXTDSA-N 1 0 369.427 5.118 20 0 FKADRO FC(F)(F)Oc1cccc([C@@H]([NH2+][C@H]2CCOC3(CCCC3)C2)C2CC2)c1 ZINC000560544405 568546981 /nfs/dbraw/zinc/54/69/81/568546981.db2.gz PXACUFKQWKBVKB-WMZOPIPTSA-N 1 0 369.427 5.118 20 0 FKADRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000560545085 568547128 /nfs/dbraw/zinc/54/71/28/568547128.db2.gz UDLFUMCJEFOHKK-BBATYDOGSA-N 1 0 368.399 5.034 20 0 FKADRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000560545086 568547109 /nfs/dbraw/zinc/54/71/09/568547109.db2.gz UDLFUMCJEFOHKK-VOJFVSQTSA-N 1 0 368.399 5.034 20 0 FKADRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000560545088 568547087 /nfs/dbraw/zinc/54/70/87/568547087.db2.gz UDLFUMCJEFOHKK-ZMZPIMSZSA-N 1 0 368.399 5.034 20 0 FKADRO CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(OC(F)(F)F)cc1 ZINC000560546394 568547230 /nfs/dbraw/zinc/54/72/30/568547230.db2.gz RPDHSHFLRGYHEM-BZNIZROVSA-N 1 0 356.388 5.034 20 0 FKADRO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(OC(F)(F)F)cc1 ZINC000560546396 568547254 /nfs/dbraw/zinc/54/72/54/568547254.db2.gz RPDHSHFLRGYHEM-MEDUHNTESA-N 1 0 356.388 5.034 20 0 FKADRO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(OC(F)(F)F)cc1 ZINC000560546398 568547225 /nfs/dbraw/zinc/54/72/25/568547225.db2.gz RPDHSHFLRGYHEM-ZBEGNZNMSA-N 1 0 356.388 5.034 20 0 FKADRO CC(C)Cc1cccc([C@@H](C)[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)c1 ZINC000560546929 568547622 /nfs/dbraw/zinc/54/76/22/568547622.db2.gz YABJWMIAWVWVTB-UXHICEINSA-N 1 0 365.565 5.156 20 0 FKADRO CC(C)Cc1cccc([C@H](C)[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000560546931 568547617 /nfs/dbraw/zinc/54/76/17/568547617.db2.gz YABJWMIAWVWVTB-VQTJNVASSA-N 1 0 365.565 5.156 20 0 FKADRO CC(C)Cc1cccc([C@@H](C)[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000560546934 568547565 /nfs/dbraw/zinc/54/75/65/568547565.db2.gz YABJWMIAWVWVTB-WOJBJXKFSA-N 1 0 365.565 5.156 20 0 FKADRO Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000560549140 568547678 /nfs/dbraw/zinc/54/76/78/568547678.db2.gz WHLPGGXEQCNRHP-JQERWDHBSA-N 1 0 357.929 5.111 20 0 FKADRO Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000560549146 568547781 /nfs/dbraw/zinc/54/77/81/568547781.db2.gz WHLPGGXEQCNRHP-MCYKXBRJSA-N 1 0 357.929 5.111 20 0 FKADRO Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000560549148 568547682 /nfs/dbraw/zinc/54/76/82/568547682.db2.gz WHLPGGXEQCNRHP-RARDXLECSA-N 1 0 357.929 5.111 20 0 FKADRO Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000560549150 568547798 /nfs/dbraw/zinc/54/77/98/568547798.db2.gz WHLPGGXEQCNRHP-SMMRIJLZSA-N 1 0 357.929 5.111 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1cccc(C)c1 ZINC000560551295 568547907 /nfs/dbraw/zinc/54/79/07/568547907.db2.gz YQWKTURUODQUBR-CXAGYDPISA-N 1 0 353.432 5.173 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1cccc(C)c1 ZINC000560551300 568547949 /nfs/dbraw/zinc/54/79/49/568547949.db2.gz YQWKTURUODQUBR-DYVFJYSZSA-N 1 0 353.432 5.173 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1cccc(C)c1 ZINC000560551306 568547846 /nfs/dbraw/zinc/54/78/46/568547846.db2.gz YQWKTURUODQUBR-GUYCJALGSA-N 1 0 353.432 5.173 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1cccc(C)c1 ZINC000560551307 568547932 /nfs/dbraw/zinc/54/79/32/568547932.db2.gz YQWKTURUODQUBR-SUMWQHHRSA-N 1 0 353.432 5.173 20 0 FKADRO COc1ccc([C@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)c(C)c1OC ZINC000560553153 568548071 /nfs/dbraw/zinc/54/80/71/568548071.db2.gz KNACBUZIKRICNA-AWEZNQCLSA-N 1 0 361.432 5.020 20 0 FKADRO COc1ccc([C@@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)c(C)c1OC ZINC000560553154 568548073 /nfs/dbraw/zinc/54/80/73/568548073.db2.gz KNACBUZIKRICNA-CQSZACIVSA-N 1 0 361.432 5.020 20 0 FKADRO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc(-c3cccnc3)c2)s1 ZINC000560554851 568548193 /nfs/dbraw/zinc/54/81/93/568548193.db2.gz MZSYQGZORKYYRQ-INIZCTEOSA-N 1 0 351.519 5.269 20 0 FKADRO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc(-c3cccnc3)c2)s1 ZINC000560554852 568548145 /nfs/dbraw/zinc/54/81/45/568548145.db2.gz MZSYQGZORKYYRQ-MRXNPFEDSA-N 1 0 351.519 5.269 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(C(C)(C)C)cc1 ZINC000560558227 568548726 /nfs/dbraw/zinc/54/87/26/568548726.db2.gz QFPORUVODHPSPE-ATIYNZHBSA-N 1 0 371.590 5.350 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(C(C)(C)C)cc1 ZINC000560558232 568548814 /nfs/dbraw/zinc/54/88/14/568548814.db2.gz QFPORUVODHPSPE-BKMJKUGQSA-N 1 0 371.590 5.350 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(C(C)(C)C)cc1 ZINC000560558234 568548790 /nfs/dbraw/zinc/54/87/90/568548790.db2.gz QFPORUVODHPSPE-GJZUVCINSA-N 1 0 371.590 5.350 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(C(C)(C)C)cc1 ZINC000560558236 568548859 /nfs/dbraw/zinc/54/88/59/568548859.db2.gz QFPORUVODHPSPE-NVQXNPDNSA-N 1 0 371.590 5.350 20 0 FKADRO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(-c3ccncc3)s2)o1 ZINC000560558507 568549434 /nfs/dbraw/zinc/54/94/34/568549434.db2.gz CTUDJTOCQOHBTG-KBXCAEBGSA-N 1 0 353.491 5.080 20 0 FKADRO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(-c3ccncc3)s2)o1 ZINC000560558512 568549890 /nfs/dbraw/zinc/54/98/90/568549890.db2.gz CTUDJTOCQOHBTG-KDOFPFPSSA-N 1 0 353.491 5.080 20 0 FKADRO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(-c3ccncc3)s2)o1 ZINC000560558516 568550203 /nfs/dbraw/zinc/55/02/03/568550203.db2.gz CTUDJTOCQOHBTG-KSSFIOAISA-N 1 0 353.491 5.080 20 0 FKADRO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(-c3ccncc3)s2)o1 ZINC000560558519 568550165 /nfs/dbraw/zinc/55/01/65/568550165.db2.gz CTUDJTOCQOHBTG-RDTXWAMCSA-N 1 0 353.491 5.080 20 0 FKADRO Cc1cc2cc(C[NH2+][C@H](C)c3ccc(Br)c(F)c3)ccc2[nH]1 ZINC000560558977 568550521 /nfs/dbraw/zinc/55/05/21/568550521.db2.gz UZWCPOKSYXFMNV-GFCCVEGCSA-N 1 0 361.258 5.229 20 0 FKADRO Cc1cc2cc(C[NH2+][C@@H](C)c3ccc(Br)c(F)c3)ccc2[nH]1 ZINC000560558979 568550592 /nfs/dbraw/zinc/55/05/92/568550592.db2.gz UZWCPOKSYXFMNV-LBPRGKRZSA-N 1 0 361.258 5.229 20 0 FKADRO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1ccc(C[S@@](C)=O)cc1 ZINC000560559038 568550574 /nfs/dbraw/zinc/55/05/74/568550574.db2.gz VNJZFXTVHZIBBL-AKJBCIBTSA-N 1 0 369.530 5.033 20 0 FKADRO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1ccc(C[S@](C)=O)cc1 ZINC000560559049 568551190 /nfs/dbraw/zinc/55/11/90/568551190.db2.gz VNJZFXTVHZIBBL-DXPJPUQTSA-N 1 0 369.530 5.033 20 0 FKADRO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1ccc(C[S@](C)=O)cc1 ZINC000560559052 568551215 /nfs/dbraw/zinc/55/12/15/568551215.db2.gz VNJZFXTVHZIBBL-QMTYFTJSSA-N 1 0 369.530 5.033 20 0 FKADRO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1ccc(C[S@@](C)=O)cc1 ZINC000560559054 568551258 /nfs/dbraw/zinc/55/12/58/568551258.db2.gz VNJZFXTVHZIBBL-YHAMSUFESA-N 1 0 369.530 5.033 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(C2CCCCC2)cc1 ZINC000560559524 568548043 /nfs/dbraw/zinc/54/80/43/568548043.db2.gz XYJYYFJHSQBBOS-DWXRJYCRSA-N 1 0 369.574 5.464 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(C2CCCCC2)cc1 ZINC000560559525 568548022 /nfs/dbraw/zinc/54/80/22/568548022.db2.gz XYJYYFJHSQBBOS-HFJWLAOPSA-N 1 0 369.574 5.464 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(C2CCCCC2)cc1 ZINC000560559526 568548055 /nfs/dbraw/zinc/54/80/55/568548055.db2.gz XYJYYFJHSQBBOS-QYBDOPJKSA-N 1 0 369.574 5.464 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(C2CCCCC2)cc1 ZINC000560559528 568548018 /nfs/dbraw/zinc/54/80/18/568548018.db2.gz XYJYYFJHSQBBOS-WXTAPIANSA-N 1 0 369.574 5.464 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560569377 568552913 /nfs/dbraw/zinc/55/29/13/568552913.db2.gz DJMJGEVGLXTPSY-ACJLOTCBSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560569381 568552921 /nfs/dbraw/zinc/55/29/21/568552921.db2.gz DJMJGEVGLXTPSY-FZKQIMNGSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560569383 568552919 /nfs/dbraw/zinc/55/29/19/568552919.db2.gz DJMJGEVGLXTPSY-SCLBCKFNSA-N 1 0 350.384 5.091 20 0 FKADRO Cc1ccnc([C@H](C)[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560569384 568552908 /nfs/dbraw/zinc/55/29/08/568552908.db2.gz DJMJGEVGLXTPSY-UGSOOPFHSA-N 1 0 350.384 5.091 20 0 FKADRO COCCC[C@@H](C[NH2+][C@H](C)c1ccc2c(c1)COC2)c1ccc(Cl)cc1 ZINC000560569858 568553051 /nfs/dbraw/zinc/55/30/51/568553051.db2.gz LTHIMJGMQRWSJM-APWZRJJASA-N 1 0 373.924 5.231 20 0 FKADRO COCCC[C@@H](C[NH2+][C@@H](C)c1ccc2c(c1)COC2)c1ccc(Cl)cc1 ZINC000560569861 568553075 /nfs/dbraw/zinc/55/30/75/568553075.db2.gz LTHIMJGMQRWSJM-LPHOPBHVSA-N 1 0 373.924 5.231 20 0 FKADRO COCCC[C@H](C[NH2+][C@@H](C)c1ccc2c(c1)COC2)c1ccc(Cl)cc1 ZINC000560569863 568553080 /nfs/dbraw/zinc/55/30/80/568553080.db2.gz LTHIMJGMQRWSJM-QFBILLFUSA-N 1 0 373.924 5.231 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(-c2ccccc2)s1 ZINC000560570338 568553041 /nfs/dbraw/zinc/55/30/41/568553041.db2.gz BEHHBOUCSUIQIF-CPJLOUKISA-N 1 0 369.555 5.144 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(-c2ccccc2)s1 ZINC000560570339 568553017 /nfs/dbraw/zinc/55/30/17/568553017.db2.gz BEHHBOUCSUIQIF-IVCQMTBJSA-N 1 0 369.555 5.144 20 0 FKADRO C[C@H]([NH2+]Cc1ccc(C[S@](C)=O)cc1)c1ccc(-c2ccccc2)s1 ZINC000560570340 568553076 /nfs/dbraw/zinc/55/30/76/568553076.db2.gz BEHHBOUCSUIQIF-LMKMVOKYSA-N 1 0 369.555 5.144 20 0 FKADRO C[C@@H]([NH2+]Cc1ccc(C[S@@](C)=O)cc1)c1ccc(-c2ccccc2)s1 ZINC000560570341 568553003 /nfs/dbraw/zinc/55/30/03/568553003.db2.gz BEHHBOUCSUIQIF-PUAOIOHZSA-N 1 0 369.555 5.144 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@@H](C)c2cc3ccccc3s2)cc1 ZINC000560570957 568553154 /nfs/dbraw/zinc/55/31/54/568553154.db2.gz DLNFRTFRNWLRMV-INIZCTEOSA-N 1 0 355.503 5.167 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](C)c2cc3ccccc3s2)cc1 ZINC000560570963 568553375 /nfs/dbraw/zinc/55/33/75/568553375.db2.gz DLNFRTFRNWLRMV-MRXNPFEDSA-N 1 0 355.503 5.167 20 0 FKADRO Fc1cccc([C@@H](NCc2cnn3ccccc23)c2cccc(Cl)c2)c1 ZINC000560571448 568553333 /nfs/dbraw/zinc/55/33/33/568553333.db2.gz HJTXQHHRFSHFBC-NRFANRHFSA-N 1 0 365.839 5.006 20 0 FKADRO Fc1cccc([C@H](NCc2cnn3ccccc23)c2cccc(Cl)c2)c1 ZINC000560571451 568553378 /nfs/dbraw/zinc/55/33/78/568553378.db2.gz HJTXQHHRFSHFBC-OAQYLSRUSA-N 1 0 365.839 5.006 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)Nc2ccc([NH+]3CCCCCC3)cc2C)c1 ZINC000560571671 568553644 /nfs/dbraw/zinc/55/36/44/568553644.db2.gz JOXKHQKPMYZLGU-GOSISDBHSA-N 1 0 365.521 5.507 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)Nc2ccc([NH+]3CCCCCC3)cc2C)c1 ZINC000560571672 568553706 /nfs/dbraw/zinc/55/37/06/568553706.db2.gz JOXKHQKPMYZLGU-SFHVURJKSA-N 1 0 365.521 5.507 20 0 FKADRO CC[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Oc2ccccc2)cc1 ZINC000560571699 568553794 /nfs/dbraw/zinc/55/37/94/568553794.db2.gz JSTGHVCWUPGISY-FCHUYYIVSA-N 1 0 361.489 5.404 20 0 FKADRO CC[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Oc2ccccc2)cc1 ZINC000560571702 568553801 /nfs/dbraw/zinc/55/38/01/568553801.db2.gz JSTGHVCWUPGISY-FGZHOGPDSA-N 1 0 361.489 5.404 20 0 FKADRO CC[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Oc2ccccc2)cc1 ZINC000560571703 568553827 /nfs/dbraw/zinc/55/38/27/568553827.db2.gz JSTGHVCWUPGISY-VXKWHMMOSA-N 1 0 361.489 5.404 20 0 FKADRO CC[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Oc2ccccc2)cc1 ZINC000560571705 568553837 /nfs/dbraw/zinc/55/38/37/568553837.db2.gz JSTGHVCWUPGISY-YADHBBJMSA-N 1 0 361.489 5.404 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)cc1 ZINC000560572009 568553829 /nfs/dbraw/zinc/55/38/29/568553829.db2.gz PUIKWQWXHMKKRB-AWEZNQCLSA-N 1 0 368.304 5.260 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)cc1 ZINC000560572012 568553831 /nfs/dbraw/zinc/55/38/31/568553831.db2.gz PUIKWQWXHMKKRB-CQSZACIVSA-N 1 0 368.304 5.260 20 0 FKADRO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(SC2CCCC2)cc1 ZINC000560572691 568553913 /nfs/dbraw/zinc/55/39/13/568553913.db2.gz UJNHCLKASHUNKK-FOIQADDNSA-N 1 0 355.551 5.257 20 0 FKADRO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(SC2CCCC2)cc1 ZINC000560572700 568553966 /nfs/dbraw/zinc/55/39/66/568553966.db2.gz UJNHCLKASHUNKK-MGPUTAFESA-N 1 0 355.551 5.257 20 0 FKADRO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(SC2CCCC2)cc1 ZINC000560572702 568553896 /nfs/dbraw/zinc/55/38/96/568553896.db2.gz UJNHCLKASHUNKK-QRWLVFNGSA-N 1 0 355.551 5.257 20 0 FKADRO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(SC2CCCC2)cc1 ZINC000560572703 568553951 /nfs/dbraw/zinc/55/39/51/568553951.db2.gz UJNHCLKASHUNKK-YWZLYKJASA-N 1 0 355.551 5.257 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@@H](C)CC(=O)Nc1ccccc1C(C)C ZINC000560572742 568553936 /nfs/dbraw/zinc/55/39/36/568553936.db2.gz BHJZUYFGFHCUFW-HNNXBMFYSA-N 1 0 374.525 5.178 20 0 FKADRO CSc1cccc(F)c1C[NH2+][C@H](C)CC(=O)Nc1ccccc1C(C)C ZINC000560572744 568553946 /nfs/dbraw/zinc/55/39/46/568553946.db2.gz BHJZUYFGFHCUFW-OAHLLOKOSA-N 1 0 374.525 5.178 20 0 FKADRO Cc1nc([C@@H](C)[NH2+]CC2(c3ccc(Br)s3)CCC2)cs1 ZINC000560573438 568554055 /nfs/dbraw/zinc/55/40/55/568554055.db2.gz YOHXXMPUBASJLI-SNVBAGLBSA-N 1 0 371.369 5.048 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000560573541 568554039 /nfs/dbraw/zinc/55/40/39/568554039.db2.gz GQOOIBCOPONOCP-HNNXBMFYSA-N 1 0 369.509 5.244 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000560573546 568554077 /nfs/dbraw/zinc/55/40/77/568554077.db2.gz GQOOIBCOPONOCP-OAHLLOKOSA-N 1 0 369.509 5.244 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@H](c2cccs2)C2CCCC2)cc1 ZINC000560574029 568554496 /nfs/dbraw/zinc/55/44/96/568554496.db2.gz JUAFJJYEAKWXAY-NRFANRHFSA-N 1 0 359.535 5.185 20 0 FKADRO COCCCOc1ccc(C[NH2+][C@@H](c2cccs2)C2CCCC2)cc1 ZINC000560574035 568554501 /nfs/dbraw/zinc/55/45/01/568554501.db2.gz JUAFJJYEAKWXAY-OAQYLSRUSA-N 1 0 359.535 5.185 20 0 FKADRO CC[C@H]([NH2+][C@H](C)c1cc2cccc(OC)c2o1)c1ccc(OC)c(OC)c1 ZINC000560575300 568554703 /nfs/dbraw/zinc/55/47/03/568554703.db2.gz UANUOCIVGCTRMZ-PBHICJAKSA-N 1 0 369.461 5.261 20 0 FKADRO CC[C@@H]([NH2+][C@H](C)c1cc2cccc(OC)c2o1)c1ccc(OC)c(OC)c1 ZINC000560575301 568554676 /nfs/dbraw/zinc/55/46/76/568554676.db2.gz UANUOCIVGCTRMZ-RHSMWYFYSA-N 1 0 369.461 5.261 20 0 FKADRO CC[C@@H]([NH2+][C@@H](C)c1cc2cccc(OC)c2o1)c1ccc(OC)c(OC)c1 ZINC000560575302 568554662 /nfs/dbraw/zinc/55/46/62/568554662.db2.gz UANUOCIVGCTRMZ-WMLDXEAASA-N 1 0 369.461 5.261 20 0 FKADRO CC[C@H]([NH2+][C@@H](C)c1cc2cccc(OC)c2o1)c1ccc(OC)c(OC)c1 ZINC000560575304 568554690 /nfs/dbraw/zinc/55/46/90/568554690.db2.gz UANUOCIVGCTRMZ-YOEHRIQHSA-N 1 0 369.461 5.261 20 0 FKADRO C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000560575913 568554976 /nfs/dbraw/zinc/55/49/76/568554976.db2.gz GQRBANROSCSHRY-NEPJUHHUSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@@H]([NH2+][C@@H](C)CCc1cccc(C(F)(F)F)c1)c1c(F)cncc1F ZINC000560575914 568554926 /nfs/dbraw/zinc/55/49/26/568554926.db2.gz GQRBANROSCSHRY-NWDGAFQWSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000560575916 568554932 /nfs/dbraw/zinc/55/49/32/568554932.db2.gz GQRBANROSCSHRY-RYUDHWBXSA-N 1 0 358.354 5.051 20 0 FKADRO C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@H](C)c1c(F)cncc1F ZINC000560575917 568554956 /nfs/dbraw/zinc/55/49/56/568554956.db2.gz GQRBANROSCSHRY-VXGBXAGGSA-N 1 0 358.354 5.051 20 0 FKADRO CC[C@H](N[C@@H](C)c1c(F)cncc1F)c1ccc2cc(OC)ccc2c1 ZINC000560576786 568555098 /nfs/dbraw/zinc/55/50/98/568555098.db2.gz XAEFHEGTCIPQGC-RBZFPXEDSA-N 1 0 356.416 5.324 20 0 FKADRO CC[C@@H](N[C@@H](C)c1c(F)cncc1F)c1ccc2cc(OC)ccc2c1 ZINC000560576787 568555079 /nfs/dbraw/zinc/55/50/79/568555079.db2.gz XAEFHEGTCIPQGC-RNODOKPDSA-N 1 0 356.416 5.324 20 0 FKADRO CC[C@H](N[C@H](C)c1c(F)cncc1F)c1ccc2cc(OC)ccc2c1 ZINC000560576788 568555016 /nfs/dbraw/zinc/55/50/16/568555016.db2.gz XAEFHEGTCIPQGC-XCLFUZPHSA-N 1 0 356.416 5.324 20 0 FKADRO CC[C@@H](N[C@H](C)c1c(F)cncc1F)c1ccc2cc(OC)ccc2c1 ZINC000560576789 568555100 /nfs/dbraw/zinc/55/51/00/568555100.db2.gz XAEFHEGTCIPQGC-ZUOKHONESA-N 1 0 356.416 5.324 20 0 FKADRO c1c2ccccc2oc1C[NH2+]Cc1cn(C2CCCC2)nc1-c1ccccn1 ZINC000560578124 568555270 /nfs/dbraw/zinc/55/52/70/568555270.db2.gz YVNCXNJCFFBLAE-UHFFFAOYSA-N 1 0 372.472 5.096 20 0 FKADRO COc1cc([C@@H](C)[NH2+]Cc2ccc(CSC)cc2)ccc1OC(F)F ZINC000560581019 568558974 /nfs/dbraw/zinc/55/89/74/568558974.db2.gz CEQOXCGPCHNOLM-CYBMUJFWSA-N 1 0 367.461 5.010 20 0 FKADRO COc1cc([C@H](C)[NH2+]Cc2ccc(CSC)cc2)ccc1OC(F)F ZINC000560581020 568558942 /nfs/dbraw/zinc/55/89/42/568558942.db2.gz CEQOXCGPCHNOLM-ZDUSSCGKSA-N 1 0 367.461 5.010 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000560581029 568558927 /nfs/dbraw/zinc/55/89/27/568558927.db2.gz COJMYNFUFHBQSH-KBPBESRZSA-N 1 0 362.502 5.407 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)c1ccc2n[nH]cc2c1 ZINC000560581030 568559029 /nfs/dbraw/zinc/55/90/29/568559029.db2.gz COJMYNFUFHBQSH-KGLIPLIRSA-N 1 0 362.502 5.407 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000560581031 568559014 /nfs/dbraw/zinc/55/90/14/568559014.db2.gz COJMYNFUFHBQSH-UONOGXRCSA-N 1 0 362.502 5.407 20 0 FKADRO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)c1ccc2n[nH]cc2c1 ZINC000560581032 568559146 /nfs/dbraw/zinc/55/91/46/568559146.db2.gz COJMYNFUFHBQSH-ZIAGYGMSSA-N 1 0 362.502 5.407 20 0 FKADRO Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)c3ccc4n[nH]cc4c3)cs2)cs1 ZINC000560581051 568559162 /nfs/dbraw/zinc/55/91/62/568559162.db2.gz DPRXCFCKIGFWHU-NEPJUHHUSA-N 1 0 368.531 5.468 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H](C)c3ccc4n[nH]cc4c3)cs2)cs1 ZINC000560581052 568559052 /nfs/dbraw/zinc/55/90/52/568559052.db2.gz DPRXCFCKIGFWHU-NWDGAFQWSA-N 1 0 368.531 5.468 20 0 FKADRO Cc1nc(-c2cc([C@@H](C)[NH2+][C@H](C)c3ccc4n[nH]cc4c3)cs2)cs1 ZINC000560581054 568559057 /nfs/dbraw/zinc/55/90/57/568559057.db2.gz DPRXCFCKIGFWHU-VXGBXAGGSA-N 1 0 368.531 5.468 20 0 FKADRO CSCc1ccc(C[NH2+][C@H](C)c2sccc2Br)cc1 ZINC000560581750 568559086 /nfs/dbraw/zinc/55/90/86/568559086.db2.gz UZMFWLBWGYOELT-LLVKDONJSA-N 1 0 356.354 5.224 20 0 FKADRO CSCc1ccc(C[NH2+][C@@H](C)c2sccc2Br)cc1 ZINC000560581752 568559446 /nfs/dbraw/zinc/55/94/46/568559446.db2.gz UZMFWLBWGYOELT-NSHDSACASA-N 1 0 356.354 5.224 20 0 FKADRO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000560582172 568559578 /nfs/dbraw/zinc/55/95/78/568559578.db2.gz XZAFMHSYSVGQKQ-DLBZAZTESA-N 1 0 371.484 5.650 20 0 FKADRO COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000560582173 568559595 /nfs/dbraw/zinc/55/95/95/568559595.db2.gz XZAFMHSYSVGQKQ-IAGOWNOFSA-N 1 0 371.484 5.650 20 0 FKADRO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000560582174 568559566 /nfs/dbraw/zinc/55/95/66/568559566.db2.gz XZAFMHSYSVGQKQ-IRXDYDNUSA-N 1 0 371.484 5.650 20 0 FKADRO COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000560582175 568559546 /nfs/dbraw/zinc/55/95/46/568559546.db2.gz XZAFMHSYSVGQKQ-SJORKVTESA-N 1 0 371.484 5.650 20 0 FKADRO CSCc1ccc(CN[C@@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000560582578 568559670 /nfs/dbraw/zinc/55/96/70/568559670.db2.gz FAVDQWNHAVVEQG-NRFANRHFSA-N 1 0 370.468 5.102 20 0 FKADRO CSCc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000560582829 568559722 /nfs/dbraw/zinc/55/97/22/568559722.db2.gz JNTCBPRPNGDJLX-HNNXBMFYSA-N 1 0 354.544 5.524 20 0 FKADRO CSCc1ccc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000560582830 568559664 /nfs/dbraw/zinc/55/96/64/568559664.db2.gz JNTCBPRPNGDJLX-OAHLLOKOSA-N 1 0 354.544 5.524 20 0 FKADRO CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)Cc1cnc(-c2ccncc2)s1 ZINC000560585207 568559839 /nfs/dbraw/zinc/55/98/39/568559839.db2.gz QOXZPMJCDIWPFV-FQEVSTJZSA-N 1 0 369.509 5.043 20 0 FKADRO CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)Cc1cnc(-c2ccncc2)s1 ZINC000560585208 568559834 /nfs/dbraw/zinc/55/98/34/568559834.db2.gz QOXZPMJCDIWPFV-HXUWFJFHSA-N 1 0 369.509 5.043 20 0 FKADRO CCOc1ccc([C@H](CC)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1OCC ZINC000560585830 568559957 /nfs/dbraw/zinc/55/99/57/568559957.db2.gz XZKFXMHCSLDFPC-BEFAXECRSA-N 1 0 367.493 5.162 20 0 FKADRO CCOc1ccc([C@@H](CC)[NH2+][C@H](C)c2ccc3n[nH]cc3c2)cc1OCC ZINC000560585831 568559932 /nfs/dbraw/zinc/55/99/32/568559932.db2.gz XZKFXMHCSLDFPC-DNVCBOLYSA-N 1 0 367.493 5.162 20 0 FKADRO CCOc1ccc([C@@H](CC)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1OCC ZINC000560585832 568559920 /nfs/dbraw/zinc/55/99/20/568559920.db2.gz XZKFXMHCSLDFPC-HNAYVOBHSA-N 1 0 367.493 5.162 20 0 FKADRO CCOc1ccc([C@H](CC)[NH2+][C@@H](C)c2ccc3n[nH]cc3c2)cc1OCC ZINC000560585833 568559940 /nfs/dbraw/zinc/55/99/40/568559940.db2.gz XZKFXMHCSLDFPC-KXBFYZLASA-N 1 0 367.493 5.162 20 0 FKADRO Fc1ccc([C@H]([NH2+]CC2(C(F)(F)F)CC2)c2cnc3ccccc3c2)cc1 ZINC000560586862 568560507 /nfs/dbraw/zinc/56/05/07/568560507.db2.gz WHLAJEYWHYJCAE-IBGZPJMESA-N 1 0 374.381 5.395 20 0 FKADRO Fc1ccc([C@@H]([NH2+]CC2(C(F)(F)F)CC2)c2cnc3ccccc3c2)cc1 ZINC000560586863 568560489 /nfs/dbraw/zinc/56/04/89/568560489.db2.gz WHLAJEYWHYJCAE-LJQANCHMSA-N 1 0 374.381 5.395 20 0 FKADRO Cc1cc(C)cc(-c2ccc(C[NH2+][C@@H](c3cccnc3)C(C)(C)CO)cc2)c1 ZINC000560587370 568560545 /nfs/dbraw/zinc/56/05/45/568560545.db2.gz SKBQQAUDGMFAGK-DEOSSOPVSA-N 1 0 374.528 5.215 20 0 FKADRO Cc1cc(C)cc(-c2ccc(C[NH2+][C@H](c3cccnc3)C(C)(C)CO)cc2)c1 ZINC000560587371 568560494 /nfs/dbraw/zinc/56/04/94/568560494.db2.gz SKBQQAUDGMFAGK-XMMPIXPASA-N 1 0 374.528 5.215 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@H](C)c2ccccc2N(C)C)c2ccccn2)cc1 ZINC000560595416 568561332 /nfs/dbraw/zinc/56/13/32/568561332.db2.gz UPWWKGYNTUHXGM-AUSIDOKSSA-N 1 0 359.517 5.091 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@@H](C)c2ccccc2N(C)C)c2ccccn2)cc1 ZINC000560595816 568561298 /nfs/dbraw/zinc/56/12/98/568561298.db2.gz UPWWKGYNTUHXGM-CVDCTZTESA-N 1 0 359.517 5.091 20 0 FKADRO Cc1ccc(C[C@@H]([NH2+][C@@H](C)c2ccccc2N(C)C)c2ccccn2)cc1 ZINC000560595817 568561329 /nfs/dbraw/zinc/56/13/29/568561329.db2.gz UPWWKGYNTUHXGM-WMZHIEFXSA-N 1 0 359.517 5.091 20 0 FKADRO Cc1ccc(C[C@H]([NH2+][C@H](C)c2ccccc2N(C)C)c2ccccn2)cc1 ZINC000560595818 568561362 /nfs/dbraw/zinc/56/13/62/568561362.db2.gz UPWWKGYNTUHXGM-XXBNENTESA-N 1 0 359.517 5.091 20 0 FKADRO Cc1ccc(Sc2ccc(NC(=O)CCCC[NH+](C)C)cc2)cc1C ZINC000560597664 568561472 /nfs/dbraw/zinc/56/14/72/568561472.db2.gz ITKZRVYMIKFTNB-UHFFFAOYSA-N 1 0 356.535 5.125 20 0 FKADRO CC[C@H](C)c1ccc([C@@H](NC(=O)CCCC[NH+](C)C)c2cccs2)cc1 ZINC000560601884 568556923 /nfs/dbraw/zinc/55/69/23/568556923.db2.gz LJXJUERGOPXCET-HTAPYJJXSA-N 1 0 372.578 5.199 20 0 FKADRO CC[C@H](C)c1ccc([C@H](NC(=O)CCCC[NH+](C)C)c2cccs2)cc1 ZINC000560601885 568556853 /nfs/dbraw/zinc/55/68/53/568556853.db2.gz LJXJUERGOPXCET-JTSKRJEESA-N 1 0 372.578 5.199 20 0 FKADRO CC[C@@H](C)c1ccc([C@@H](NC(=O)CCCC[NH+](C)C)c2cccs2)cc1 ZINC000560601886 568556859 /nfs/dbraw/zinc/55/68/59/568556859.db2.gz LJXJUERGOPXCET-VGOFRKELSA-N 1 0 372.578 5.199 20 0 FKADRO CC[C@@H](C)c1ccc([C@H](NC(=O)CCCC[NH+](C)C)c2cccs2)cc1 ZINC000560601887 568556882 /nfs/dbraw/zinc/55/68/82/568556882.db2.gz LJXJUERGOPXCET-VGSWGCGISA-N 1 0 372.578 5.199 20 0 FKADRO Cc1cc(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)ccc1Oc1ccncc1 ZINC000560686507 568593861 /nfs/dbraw/zinc/59/38/61/568593861.db2.gz PVEJDUCGOAUPQL-KBPBESRZSA-N 1 0 364.367 5.099 20 0 FKADRO Cc1cc(NC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)ccc1Oc1ccncc1 ZINC000560686509 568593713 /nfs/dbraw/zinc/59/37/13/568593713.db2.gz PVEJDUCGOAUPQL-KGLIPLIRSA-N 1 0 364.367 5.099 20 0 FKADRO Cc1cc(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)ccc1Oc1ccncc1 ZINC000560686511 568593772 /nfs/dbraw/zinc/59/37/72/568593772.db2.gz PVEJDUCGOAUPQL-UONOGXRCSA-N 1 0 364.367 5.099 20 0 FKADRO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)ccc1Oc1ccncc1 ZINC000560686512 568593733 /nfs/dbraw/zinc/59/37/33/568593733.db2.gz PVEJDUCGOAUPQL-ZIAGYGMSSA-N 1 0 364.367 5.099 20 0 FKADRO CC(C)C[C@H]([NH2+][C@H](C)c1ccc(F)cn1)c1cccc(C(F)(F)F)c1 ZINC000560788485 568628340 /nfs/dbraw/zinc/62/83/40/568628340.db2.gz FNUCJLVZVKZSRR-ACJLOTCBSA-N 1 0 354.391 5.678 20 0 FKADRO CC(C)C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1cccc(C(F)(F)F)c1 ZINC000560788486 568628407 /nfs/dbraw/zinc/62/84/07/568628407.db2.gz FNUCJLVZVKZSRR-FZKQIMNGSA-N 1 0 354.391 5.678 20 0 FKADRO CC(C)C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1cccc(C(F)(F)F)c1 ZINC000560788490 568628372 /nfs/dbraw/zinc/62/83/72/568628372.db2.gz FNUCJLVZVKZSRR-UGSOOPFHSA-N 1 0 354.391 5.678 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000560807528 568639369 /nfs/dbraw/zinc/63/93/69/568639369.db2.gz QXJLBNIXSJNBIB-HNNXBMFYSA-N 1 0 354.494 5.725 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000560807529 568639474 /nfs/dbraw/zinc/63/94/74/568639474.db2.gz QXJLBNIXSJNBIB-OAHLLOKOSA-N 1 0 354.494 5.725 20 0 FKADRO CCC[N@H+](Cc1nnc(-c2ccccc2Cl)o1)Cc1cc(C)cc(C)c1 ZINC000560817876 568634022 /nfs/dbraw/zinc/63/40/22/568634022.db2.gz AFTSVBRZKAZLHY-UHFFFAOYSA-N 1 0 369.896 5.419 20 0 FKADRO CC(C)[C@@H]([NH2+]Cc1cn2cccnc2n1)c1ccc(C2CCCCC2)cc1 ZINC000560825058 568640227 /nfs/dbraw/zinc/64/02/27/568640227.db2.gz RRELDDTUWCMUQG-JOCHJYFZSA-N 1 0 362.521 5.264 20 0 FKADRO CC(C)[C@H]([NH2+]Cc1cn2cccnc2n1)c1ccc(C2CCCCC2)cc1 ZINC000560825061 568640308 /nfs/dbraw/zinc/64/03/08/568640308.db2.gz RRELDDTUWCMUQG-QFIPXVFZSA-N 1 0 362.521 5.264 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000560853359 568654410 /nfs/dbraw/zinc/65/44/10/568654410.db2.gz SJIMPWUEVYGCCY-GOSISDBHSA-N 1 0 374.937 5.228 20 0 FKADRO CSc1ccccc1NC(=O)CC[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000560853360 568657090 /nfs/dbraw/zinc/65/70/90/568657090.db2.gz SJIMPWUEVYGCCY-SFHVURJKSA-N 1 0 374.937 5.228 20 0 FKADRO CC[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)CCc1ccccc1 ZINC000560862806 568671372 /nfs/dbraw/zinc/67/13/72/568671372.db2.gz PKLFOFKXRWZFKV-UHFFFAOYSA-N 1 0 372.512 5.247 20 0 FKADRO CCOc1ccccc1-c1cccc(C(=O)Nc2ccccc2C[NH+](C)C)c1 ZINC000560865847 568686062 /nfs/dbraw/zinc/68/60/62/568686062.db2.gz JZMSPIHUBACPQK-UHFFFAOYSA-N 1 0 374.484 5.066 20 0 FKADRO CC(C)CC[N@@H+]1Cc2cccc(NC(=O)c3ccccc3OC(C)C)c2C1 ZINC000560869858 568682741 /nfs/dbraw/zinc/68/27/41/568682741.db2.gz VTXDRRONMYFZSZ-UHFFFAOYSA-N 1 0 366.505 5.088 20 0 FKADRO c1csc([C@H]([NH2+]Cc2ccc(N3CCCCC3)nc2)C2CCCC2)c1 ZINC000560873590 568705373 /nfs/dbraw/zinc/70/53/73/568705373.db2.gz DLBVXZAROGIWEJ-OAQYLSRUSA-N 1 0 355.551 5.155 20 0 FKADRO CSc1cc(C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)ccn1 ZINC000560875109 568705535 /nfs/dbraw/zinc/70/55/35/568705535.db2.gz BYXMMKBZSHENTI-CYBMUJFWSA-N 1 0 374.456 5.409 20 0 FKADRO CSc1cc(C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)ccn1 ZINC000560875118 568705620 /nfs/dbraw/zinc/70/56/20/568705620.db2.gz BYXMMKBZSHENTI-ZDUSSCGKSA-N 1 0 374.456 5.409 20 0 FKADRO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(Br)s1 ZINC000560883614 568693251 /nfs/dbraw/zinc/69/32/51/568693251.db2.gz MLQFJTXYWPMONC-SECBINFHSA-N 1 0 360.704 5.023 20 0 FKADRO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(Br)s1 ZINC000560883621 568693333 /nfs/dbraw/zinc/69/33/33/568693333.db2.gz MLQFJTXYWPMONC-VIFPVBQESA-N 1 0 360.704 5.023 20 0 FKADRO Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000560884270 568693616 /nfs/dbraw/zinc/69/36/16/568693616.db2.gz OJBDTWMUYWXHMD-IBGZPJMESA-N 1 0 370.500 5.012 20 0 FKADRO Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@H](C)c1ccc2ccccc2n1 ZINC000560884283 568693850 /nfs/dbraw/zinc/69/38/50/568693850.db2.gz OJBDTWMUYWXHMD-LJQANCHMSA-N 1 0 370.500 5.012 20 0 FKADRO CC(=O)Nc1cccc(C[NH2+][C@H]2CCCc3c4ccccc4sc32)c1 ZINC000560890627 568697230 /nfs/dbraw/zinc/69/72/30/568697230.db2.gz FNCLIZCIJZJQRP-IBGZPJMESA-N 1 0 350.487 5.027 20 0 FKADRO CC(=O)Nc1cccc(C[NH2+][C@@H]2CCCc3c4ccccc4sc32)c1 ZINC000560890630 568697450 /nfs/dbraw/zinc/69/74/50/568697450.db2.gz FNCLIZCIJZJQRP-LJQANCHMSA-N 1 0 350.487 5.027 20 0 FKADRO C[C@@H]([NH2+]CCCc1nccs1)c1ccc2ccccc2c1OC(F)F ZINC000560897355 568699047 /nfs/dbraw/zinc/69/90/47/568699047.db2.gz CVHBKZHRWLTATK-CYBMUJFWSA-N 1 0 362.445 5.181 20 0 FKADRO C[C@H]([NH2+]CCCc1nccs1)c1ccc2ccccc2c1OC(F)F ZINC000560897356 568699015 /nfs/dbraw/zinc/69/90/15/568699015.db2.gz CVHBKZHRWLTATK-ZDUSSCGKSA-N 1 0 362.445 5.181 20 0 FKADRO Cc1c2ccccc2oc1[C@H](C)[NH2+]CCc1nc(-c2ccccn2)cs1 ZINC000560897606 568699072 /nfs/dbraw/zinc/69/90/72/568699072.db2.gz ICRNZKOBFFUKGQ-HNNXBMFYSA-N 1 0 363.486 5.153 20 0 FKADRO Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCc1nc(-c2ccccn2)cs1 ZINC000560897607 568699093 /nfs/dbraw/zinc/69/90/93/568699093.db2.gz ICRNZKOBFFUKGQ-OAHLLOKOSA-N 1 0 363.486 5.153 20 0 FKADRO Cc1noc(CCC[NH2+][C@H](C)c2ccc(-c3ccccc3Cl)s2)n1 ZINC000560898378 568699761 /nfs/dbraw/zinc/69/97/61/568699761.db2.gz HJOQBHNRYBBUDZ-GFCCVEGCSA-N 1 0 361.898 5.043 20 0 FKADRO Cc1noc(CCC[NH2+][C@@H](C)c2ccc(-c3ccccc3Cl)s2)n1 ZINC000560898382 568699894 /nfs/dbraw/zinc/69/98/94/568699894.db2.gz HJOQBHNRYBBUDZ-LBPRGKRZSA-N 1 0 361.898 5.043 20 0 FKADRO Cc1n[nH]cc1C[NH2+][C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000560901534 568701869 /nfs/dbraw/zinc/70/18/69/568701869.db2.gz CNVDFOGLCPFLLF-GFCCVEGCSA-N 1 0 365.424 5.316 20 0 FKADRO Cc1n[nH]cc1C[NH2+][C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000560901535 568701938 /nfs/dbraw/zinc/70/19/38/568701938.db2.gz CNVDFOGLCPFLLF-LBPRGKRZSA-N 1 0 365.424 5.316 20 0 FKADRO Cc1nc([C@@H](C)NCc2ccc(-c3nc4ccccc4s3)o2)cs1 ZINC000560901565 568701820 /nfs/dbraw/zinc/70/18/20/568701820.db2.gz QVBPBCQOAGRNCZ-LLVKDONJSA-N 1 0 355.488 5.172 20 0 FKADRO C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccc(-c2ccc(F)cc2)s1 ZINC000560902230 568702456 /nfs/dbraw/zinc/70/24/56/568702456.db2.gz FRJCARLFXYILEZ-ACJLOTCBSA-N 1 0 359.441 5.078 20 0 FKADRO C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(-c2ccc(F)cc2)s1 ZINC000560902231 568702410 /nfs/dbraw/zinc/70/24/10/568702410.db2.gz FRJCARLFXYILEZ-FZKQIMNGSA-N 1 0 359.441 5.078 20 0 FKADRO C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccc(-c2ccc(F)cc2)s1 ZINC000560902233 568702448 /nfs/dbraw/zinc/70/24/48/568702448.db2.gz FRJCARLFXYILEZ-SCLBCKFNSA-N 1 0 359.441 5.078 20 0 FKADRO CC[C@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1Cl ZINC000560902459 568702864 /nfs/dbraw/zinc/70/28/64/568702864.db2.gz YCWOFLPJOOSSAA-HNNXBMFYSA-N 1 0 369.258 5.061 20 0 FKADRO CC[C@@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1Cl ZINC000560902463 568703242 /nfs/dbraw/zinc/70/32/42/568703242.db2.gz YCWOFLPJOOSSAA-OAHLLOKOSA-N 1 0 369.258 5.061 20 0 FKADRO C[C@H]([NH2+][C@H]1CC[C@H](O)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000560908027 568718513 /nfs/dbraw/zinc/71/85/13/568718513.db2.gz GXUVGXOYUSIWGU-RCBQFDQVSA-N 1 0 369.452 5.388 20 0 FKADRO C[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1cccc(Cl)c1Cl ZINC000560908606 568719702 /nfs/dbraw/zinc/71/97/02/568719702.db2.gz GBBXFLRXNUYXNO-CYBMUJFWSA-N 1 0 360.288 5.245 20 0 FKADRO C[C@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1cccc(Cl)c1Cl ZINC000560908625 568719851 /nfs/dbraw/zinc/71/98/51/568719851.db2.gz GBBXFLRXNUYXNO-ZDUSSCGKSA-N 1 0 360.288 5.245 20 0 FKADRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000560909799 568708359 /nfs/dbraw/zinc/70/83/59/568708359.db2.gz LJBZXKLECPBESP-BTDLBPIBSA-N 1 0 355.696 5.844 20 0 FKADRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000560909800 568708513 /nfs/dbraw/zinc/70/85/13/568708513.db2.gz LJBZXKLECPBESP-DYZYQPBXSA-N 1 0 355.696 5.844 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](CC2CCCC2)c2ccccc2)c1 ZINC000560911068 568719171 /nfs/dbraw/zinc/71/91/71/568719171.db2.gz WEDCHDQASAPWIP-GAJHUEQPSA-N 1 0 350.506 5.617 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](CC2CCCC2)c2ccccc2)c1 ZINC000560911084 568719245 /nfs/dbraw/zinc/71/92/45/568719245.db2.gz WEDCHDQASAPWIP-HXOBKFHXSA-N 1 0 350.506 5.617 20 0 FKADRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](CC2CCCC2)c2ccccc2)c1 ZINC000560911089 568708034 /nfs/dbraw/zinc/70/80/34/568708034.db2.gz WEDCHDQASAPWIP-SBUREZEXSA-N 1 0 350.506 5.617 20 0 FKADRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](CC2CCCC2)c2ccccc2)c1 ZINC000560911095 568709488 /nfs/dbraw/zinc/70/94/88/568709488.db2.gz WEDCHDQASAPWIP-UZUQRXQVSA-N 1 0 350.506 5.617 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccc(F)cc3)cc2)cn1 ZINC000560915934 568728357 /nfs/dbraw/zinc/72/83/57/568728357.db2.gz GHGWBDWRSBQKJQ-DLBZAZTESA-N 1 0 351.469 5.682 20 0 FKADRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccc(F)cc3)cc2)cn1 ZINC000560915945 568728307 /nfs/dbraw/zinc/72/83/07/568728307.db2.gz GHGWBDWRSBQKJQ-IAGOWNOFSA-N 1 0 351.469 5.682 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccc(F)cc3)cc2)cn1 ZINC000560915947 568728260 /nfs/dbraw/zinc/72/82/60/568728260.db2.gz GHGWBDWRSBQKJQ-IRXDYDNUSA-N 1 0 351.469 5.682 20 0 FKADRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccc(F)cc3)cc2)cn1 ZINC000560915949 568728365 /nfs/dbraw/zinc/72/83/65/568728365.db2.gz GHGWBDWRSBQKJQ-SJORKVTESA-N 1 0 351.469 5.682 20 0 FKADRO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1cnc2ccsc2c1 ZINC000560918111 568728379 /nfs/dbraw/zinc/72/83/79/568728379.db2.gz KHPRNPFCIUNREY-PXAZEXFGSA-N 1 0 356.466 5.388 20 0 FKADRO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1cnc2ccsc2c1 ZINC000560918121 568728285 /nfs/dbraw/zinc/72/82/85/568728285.db2.gz KHPRNPFCIUNREY-SJCJKPOMSA-N 1 0 356.466 5.388 20 0 FKADRO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1cnc2ccsc2c1 ZINC000560918123 568728299 /nfs/dbraw/zinc/72/82/99/568728299.db2.gz KHPRNPFCIUNREY-SJKOYZFVSA-N 1 0 356.466 5.388 20 0 FKADRO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1cnc2ccsc2c1 ZINC000560918126 568728330 /nfs/dbraw/zinc/72/83/30/568728330.db2.gz KHPRNPFCIUNREY-YVEFUNNKSA-N 1 0 356.466 5.388 20 0 FKADRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000560927341 568730483 /nfs/dbraw/zinc/73/04/83/568730483.db2.gz LHDVWZNECDALSB-HNNXBMFYSA-N 1 0 368.427 5.565 20 0 FKADRO Cc1c(N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cccc1-c1ncco1 ZINC000563149091 568281918 /nfs/dbraw/zinc/28/19/18/568281918.db2.gz DWQRUVPBVUEWNP-FQEVSTJZSA-N 1 0 373.500 5.259 20 0 FKADRO Cc1nc2ccccc2c(C)c1Cc1nc(-c2nccc3ccccc32)no1 ZINC000603780727 568166400 /nfs/dbraw/zinc/16/64/00/568166400.db2.gz JMYUKWJYHRBDED-UHFFFAOYSA-N 1 0 366.424 5.041 20 0 FKADRO CC(C)c1cc(CNCc2cccc(OCc3ccccc3Cl)c2)on1 ZINC000603950004 568187092 /nfs/dbraw/zinc/18/70/92/568187092.db2.gz NJCZYQREENNMRW-UHFFFAOYSA-N 1 0 370.880 5.320 20 0 FKADRO CC(C)OCc1ccccc1C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000604414918 568279619 /nfs/dbraw/zinc/27/96/19/568279619.db2.gz QQWXJYYTCYOQOE-UHFFFAOYSA-N 1 0 371.427 5.440 20 0 FKADRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000604415595 568281025 /nfs/dbraw/zinc/28/10/25/568281025.db2.gz ACJKDAHWKGCFQJ-UHFFFAOYSA-N 1 0 357.400 5.258 20 0 FKADRO CCCOc1c(Cl)cc(C[NH2+]Cc2oc3ccccc3c2C)cc1OC ZINC000604416798 568275043 /nfs/dbraw/zinc/27/50/43/568275043.db2.gz HSXSGSRRLMEQGO-UHFFFAOYSA-N 1 0 373.880 5.482 20 0 FKADRO Cc1ccc([C@@H]2CSCCN2Cc2coc(-c3ccc(F)cc3)n2)cc1 ZINC000604761667 568361350 /nfs/dbraw/zinc/36/13/50/568361350.db2.gz LTBLOMQVPRPCBU-FQEVSTJZSA-N 1 0 368.477 5.079 20 0 FKADRO C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)Nc2cccc3ccccc32)CC1 ZINC000604775152 568368942 /nfs/dbraw/zinc/36/89/42/568368942.db2.gz WPEUURBFHDDVRH-GOSISDBHSA-N 1 0 373.500 5.187 20 0 FKADRO CC(C)([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)c1cccs1 ZINC000604892764 568381245 /nfs/dbraw/zinc/38/12/45/568381245.db2.gz ZKBCGILHISNGGM-UHFFFAOYSA-N 1 0 354.500 5.643 20 0 FKADRO c1ccc([C@@H]2C[N@H+](Cc3ccccc3Oc3cccnc3)CCS2)cc1 ZINC000605153825 568597734 /nfs/dbraw/zinc/59/77/34/568597734.db2.gz CJUSHPJJECHXSZ-QFIPXVFZSA-N 1 0 362.498 5.164 20 0 FKADRO C[N@H+](Cc1ccccc1NC(=O)c1coc(C(F)F)c1)C1CCCCC1 ZINC000623721816 568311609 /nfs/dbraw/zinc/31/16/09/568311609.db2.gz QUBCCKXYMJPCHF-UHFFFAOYSA-N 1 0 362.420 5.234 20 0 FKADRO CN(C)[C@@H](C[NH2+]Cc1ccc(-c2ccccc2Cl)s1)c1ccco1 ZINC000636861196 568150425 /nfs/dbraw/zinc/15/04/25/568150425.db2.gz AOGVKQSZZSHCMD-KRWDZBQOSA-N 1 0 360.910 5.054 20 0 FKADRO CN(C)[C@H](C[NH2+]Cc1ccc(-c2ccccc2Cl)s1)c1ccco1 ZINC000636861197 568150390 /nfs/dbraw/zinc/15/03/90/568150390.db2.gz AOGVKQSZZSHCMD-QGZVFWFLSA-N 1 0 360.910 5.054 20 0 FKADRO C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(-c3ccccc3Cl)s2)cc1 ZINC000636864195 568154438 /nfs/dbraw/zinc/15/44/38/568154438.db2.gz VDFHBTYEGZFPSW-UHFFFAOYSA-N 1 0 370.949 5.420 20 0 FKADRO O=C(CCC(F)F)Nc1cccc(C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000644848526 568335025 /nfs/dbraw/zinc/33/50/25/568335025.db2.gz BVJARILUVYDSCM-UHFFFAOYSA-N 1 0 372.459 5.050 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@@H](C)O ZINC000658359101 568293277 /nfs/dbraw/zinc/29/32/77/568293277.db2.gz AAEKXQUWUWKYEW-OHNRDTAOSA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@H](C)O ZINC000658359102 568293732 /nfs/dbraw/zinc/29/37/32/568293732.db2.gz AAEKXQUWUWKYEW-RFUYNDQBSA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@@H](C)O ZINC000658359103 568294406 /nfs/dbraw/zinc/29/44/06/568294406.db2.gz AAEKXQUWUWKYEW-ZBQZNYHESA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@H](C)O ZINC000658359104 568274014 /nfs/dbraw/zinc/27/40/14/568274014.db2.gz AAEKXQUWUWKYEW-ZUEVXXBESA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@@H](C)O ZINC000658359343 568313074 /nfs/dbraw/zinc/31/30/74/568313074.db2.gz CIJQLSCLJKDHAH-OHNRDTAOSA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@H](C)O ZINC000658359344 568313254 /nfs/dbraw/zinc/31/32/54/568313254.db2.gz CIJQLSCLJKDHAH-RFUYNDQBSA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@@H](C)O ZINC000658359345 568313272 /nfs/dbraw/zinc/31/32/72/568313272.db2.gz CIJQLSCLJKDHAH-ZBQZNYHESA-N 1 0 370.493 5.030 20 0 FKADRO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@H](C)O ZINC000658359346 568313261 /nfs/dbraw/zinc/31/32/61/568313261.db2.gz CIJQLSCLJKDHAH-ZUEVXXBESA-N 1 0 370.493 5.030 20 0 FKADRO CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCC3(C=Cc4ccccc43)CC2)nc1 ZINC001164420218 718909519 /nfs/dbraw/zinc/90/95/19/718909519.db2.gz HZZNPDXWZKJUEH-HSZRJFAPSA-N 1 0 373.544 5.194 20 0 FKADRO CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCC3(C=Cc4ccccc43)CC2)nc1 ZINC001164420219 718909303 /nfs/dbraw/zinc/90/93/03/718909303.db2.gz HZZNPDXWZKJUEH-QHCPKHFHSA-N 1 0 373.544 5.194 20 0 FKADRO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCC[C@]2(C[C@H](c3ccccc3)CO2)C1 ZINC001164771277 721061299 /nfs/dbraw/zinc/06/12/99/721061299.db2.gz MHYWGADGTHYCET-AVRDEDQJSA-N 1 0 370.924 5.009 20 0 FKADRO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCC[C@]2(C[C@@H](c3ccccc3)CO2)C1 ZINC001164771288 721062097 /nfs/dbraw/zinc/06/20/97/721062097.db2.gz MHYWGADGTHYCET-GCJKJVERSA-N 1 0 370.924 5.009 20 0 FKADRO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCC[C@@]2(C[C@H](c3ccccc3)CO2)C1 ZINC001164771289 721061880 /nfs/dbraw/zinc/06/18/80/721061880.db2.gz MHYWGADGTHYCET-PGRDOPGGSA-N 1 0 370.924 5.009 20 0 FKADRO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCC[C@@]2(C[C@@H](c3ccccc3)CO2)C1 ZINC001164771290 721061852 /nfs/dbraw/zinc/06/18/52/721061852.db2.gz MHYWGADGTHYCET-XMSQKQJNSA-N 1 0 370.924 5.009 20 0 FKADRO CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@@H]2c2cccnc2)nc1 ZINC001165045909 721963944 /nfs/dbraw/zinc/96/39/44/721963944.db2.gz DJRVNZIRCXLOLY-FCHUYYIVSA-N 1 0 364.537 5.145 20 0 FKADRO CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@@H]2c2cccnc2)nc1 ZINC001165045910 721963919 /nfs/dbraw/zinc/96/39/19/721963919.db2.gz DJRVNZIRCXLOLY-FGZHOGPDSA-N 1 0 364.537 5.145 20 0 FKADRO CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@H]2c2cccnc2)nc1 ZINC001165045911 721964072 /nfs/dbraw/zinc/96/40/72/721964072.db2.gz DJRVNZIRCXLOLY-VXKWHMMOSA-N 1 0 364.537 5.145 20 0 FKADRO CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@H]2c2cccnc2)nc1 ZINC001165045912 721964054 /nfs/dbraw/zinc/96/40/54/721964054.db2.gz DJRVNZIRCXLOLY-YADHBBJMSA-N 1 0 364.537 5.145 20 0 FKADRO CC(C)(c1ccnc(Cl)c1)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC001165051686 721989342 /nfs/dbraw/zinc/98/93/42/721989342.db2.gz UTOACCMOTONCEU-UHFFFAOYSA-N 1 0 371.937 5.459 20 0 FKADRO CC[NH+](CC)C1CCN(c2c(Cl)nc(Cl)c(Cl)c2Cl)CC1 ZINC001165053926 722001606 /nfs/dbraw/zinc/00/16/06/722001606.db2.gz SGWQBUQKKQSSLR-UHFFFAOYSA-N 1 0 371.139 5.006 20 0 FKADRO