smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(Cl)c(Cl)c1 ZINC000006976181 568408210 /nfs/dbraw/zinc/40/82/10/568408210.db2.gz KBNVXHBOZIIYHX-UHFFFAOYSA-N 1 2 353.274 5.342 20 0 FKADLO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(Cl)c(Cl)c1 ZINC000006976181 568408209 /nfs/dbraw/zinc/40/82/09/568408209.db2.gz KBNVXHBOZIIYHX-UHFFFAOYSA-N 1 2 353.274 5.342 20 0 FKADLO C[N@@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccc(Cl)c(Cl)c1 ZINC000006976274 568129371 /nfs/dbraw/zinc/12/93/71/568129371.db2.gz LMUDECQROUDGDC-UHFFFAOYSA-N 1 2 365.235 5.420 20 0 FKADLO C[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccc(Cl)c(Cl)c1 ZINC000006976274 568129370 /nfs/dbraw/zinc/12/93/70/568129370.db2.gz LMUDECQROUDGDC-UHFFFAOYSA-N 1 2 365.235 5.420 20 0 FKADLO COc1ccc(-c2nc(C[N@@H+](C)Cc3ccc(Cl)cc3)cs2)cc1 ZINC000007444308 568236402 /nfs/dbraw/zinc/23/64/02/568236402.db2.gz ALTLYNJOYMWMKC-UHFFFAOYSA-N 1 2 358.894 5.104 20 0 FKADLO COc1ccc(-c2nc(C[N@H+](C)Cc3ccc(Cl)cc3)cs2)cc1 ZINC000007444308 568236401 /nfs/dbraw/zinc/23/64/01/568236401.db2.gz ALTLYNJOYMWMKC-UHFFFAOYSA-N 1 2 358.894 5.104 20 0 FKADLO Clc1ccc(-c2cnc(C[NH2+]C(c3ccccc3)c3ccccc3)o2)cc1 ZINC000007496840 568237782 /nfs/dbraw/zinc/23/77/82/568237782.db2.gz GVOCVUXDAABOLF-UHFFFAOYSA-N 1 2 374.871 5.874 20 0 FKADLO Fc1ccc(-c2cnc(C[NH2+]C(c3ccccc3)c3ccccc3)o2)cc1 ZINC000007496981 568237828 /nfs/dbraw/zinc/23/78/28/568237828.db2.gz ZNMHLKVDHKXMQL-UHFFFAOYSA-N 1 2 358.416 5.360 20 0 FKADLO CCc1ccc(-c2noc(C[NH2+]C(c3ccccc3)c3ccccc3)n2)cc1 ZINC000007496994 568523101 /nfs/dbraw/zinc/52/31/01/568523101.db2.gz LZURNEMZNJYGHP-UHFFFAOYSA-N 1 2 369.468 5.178 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nnc(-c2cccc(Cl)c2)o1 ZINC000007500120 568523825 /nfs/dbraw/zinc/52/38/25/568523825.db2.gz YARYIGVSCMBRTO-RYUDHWBXSA-N 1 2 362.260 5.455 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1Cl ZINC000007500121 568523843 /nfs/dbraw/zinc/52/38/43/568523843.db2.gz YARYIGVSCMBRTO-NEPJUHHUSA-N 1 2 362.260 5.455 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nnc(-c2cccc(Cl)c2)o1 ZINC000007500122 568523840 /nfs/dbraw/zinc/52/38/40/568523840.db2.gz YARYIGVSCMBRTO-NWDGAFQWSA-N 1 2 362.260 5.455 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1nnc(-c2cccc(Cl)c2)o1 ZINC000007500123 568523845 /nfs/dbraw/zinc/52/38/45/568523845.db2.gz YARYIGVSCMBRTO-VXGBXAGGSA-N 1 2 362.260 5.455 20 0 FKADLO CC(C)c1ccccc1NC(=O)C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000007580428 568534087 /nfs/dbraw/zinc/53/40/87/568534087.db2.gz UPSMAPOVPSODTB-UHFFFAOYSA-N 1 2 368.502 5.105 20 0 FKADLO CC(C)c1ccccc1NC(=O)C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000007580428 568534085 /nfs/dbraw/zinc/53/40/85/568534085.db2.gz UPSMAPOVPSODTB-UHFFFAOYSA-N 1 2 368.502 5.105 20 0 FKADLO Cc1cccc(NC(=O)C[NH+](Cc2cccs2)Cc2cccs2)c1C ZINC000007688148 568251912 /nfs/dbraw/zinc/25/19/12/568251912.db2.gz ZNIBJBIBTVCQTI-UHFFFAOYSA-N 1 2 370.543 5.067 20 0 FKADLO Cc1ccc(C)c(NC(=O)C[NH+](Cc2cccs2)Cc2cccs2)c1 ZINC000007688242 568251958 /nfs/dbraw/zinc/25/19/58/568251958.db2.gz WZKPRRQIZQEUBK-UHFFFAOYSA-N 1 2 370.543 5.067 20 0 FKADLO Cc1ccc(NC(=O)C[NH+](Cc2cccs2)Cc2cccs2)c(C)c1 ZINC000007688250 568251924 /nfs/dbraw/zinc/25/19/24/568251924.db2.gz AJITWWTZLJKMDE-UHFFFAOYSA-N 1 2 370.543 5.067 20 0 FKADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000008152359 568272276 /nfs/dbraw/zinc/27/22/76/568272276.db2.gz AWUPRWAGGWZSNC-NSHDSACASA-N 1 2 371.695 5.278 20 0 FKADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000008152359 568272274 /nfs/dbraw/zinc/27/22/74/568272274.db2.gz AWUPRWAGGWZSNC-NSHDSACASA-N 1 2 371.695 5.278 20 0 FKADLO Cc1[nH]c2cc(NC(=O)c3sc4cc(F)ccc4c3Cl)ccc2[nH+]1 ZINC000010896174 568455746 /nfs/dbraw/zinc/45/57/46/568455746.db2.gz DRAMNHBFVWUDFI-UHFFFAOYSA-N 1 2 359.813 5.131 20 0 FKADLO Cc1[nH]c2ccc(NC(=O)c3sc4cc(F)ccc4c3Cl)cc2[nH+]1 ZINC000010896174 568455744 /nfs/dbraw/zinc/45/57/44/568455744.db2.gz DRAMNHBFVWUDFI-UHFFFAOYSA-N 1 2 359.813 5.131 20 0 FKADLO O=C(Nc1ccc2c(c1)[nH+]c1n2CCCCC1)c1cccc(Cl)c1Cl ZINC000014910418 207531621 /nfs/dbraw/zinc/53/16/21/207531621.db2.gz NQCHBXNOWZEQQN-UHFFFAOYSA-N 1 2 374.271 5.322 20 0 FKADLO c1csc([C@H]2c3ccsc3CC[N@@H+]2Cc2nc3ccccc3s2)c1 ZINC000021584856 211317342 /nfs/dbraw/zinc/31/73/42/211317342.db2.gz WLDOFWVJIZOMAE-LJQANCHMSA-N 1 2 368.552 5.567 20 0 FKADLO c1csc([C@H]2c3ccsc3CC[N@H+]2Cc2nc3ccccc3s2)c1 ZINC000021584856 211317336 /nfs/dbraw/zinc/31/73/36/211317336.db2.gz WLDOFWVJIZOMAE-LJQANCHMSA-N 1 2 368.552 5.567 20 0 FKADLO CCc1cccc2c(C(=O)[C@H]([NH2+]Cc3ccco3)c3ccccc3)c[nH]c21 ZINC000023864782 568285473 /nfs/dbraw/zinc/28/54/73/568285473.db2.gz YCFIZIZWRDRGTB-JOCHJYFZSA-N 1 2 358.441 5.037 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1nnc(-c2ccccc2)o1 ZINC000024518822 204819731 /nfs/dbraw/zinc/81/97/31/204819731.db2.gz VNHRKYUXHHRXIQ-VXGBXAGGSA-N 1 2 362.260 5.455 20 0 FKADLO COc1ccc(-c2nc(C[N@@H+](Cc3ccc(F)cc3)C3CC3)cs2)cc1 ZINC000032775947 568404032 /nfs/dbraw/zinc/40/40/32/568404032.db2.gz PLAJZZSVHWOBLW-UHFFFAOYSA-N 1 2 368.477 5.122 20 0 FKADLO COc1ccc(-c2nc(C[N@H+](Cc3ccc(F)cc3)C3CC3)cs2)cc1 ZINC000032775947 568404031 /nfs/dbraw/zinc/40/40/31/568404031.db2.gz PLAJZZSVHWOBLW-UHFFFAOYSA-N 1 2 368.477 5.122 20 0 FKADLO C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1nc2ccccc2s1 ZINC000038038953 211366408 /nfs/dbraw/zinc/36/64/08/211366408.db2.gz ICJTXJJGSRCYHT-SNVBAGLBSA-N 1 2 365.271 5.049 20 0 FKADLO Cc1cccc(C)c1NC(=O)Cn1c2ccccc2[nH+]c1C1CCCCC1 ZINC000040295853 205065493 /nfs/dbraw/zinc/06/54/93/205065493.db2.gz HCDHQTWJTHBTNH-UHFFFAOYSA-N 1 2 361.489 5.340 20 0 FKADLO CCCCOc1ccc(-c2nnc(C[N@@H+](C)[C@@H](C)c3cccs3)o2)cc1 ZINC000051501847 568048307 /nfs/dbraw/zinc/04/83/07/568048307.db2.gz XAWQKEITAVBSCQ-HNNXBMFYSA-N 1 2 371.506 5.170 20 0 FKADLO CCCCOc1ccc(-c2nnc(C[N@H+](C)[C@@H](C)c3cccs3)o2)cc1 ZINC000051501847 568048306 /nfs/dbraw/zinc/04/83/06/568048306.db2.gz XAWQKEITAVBSCQ-HNNXBMFYSA-N 1 2 371.506 5.170 20 0 FKADLO CCCCOc1ccc(-c2nnc(C[N@@H+](C)[C@H](C)c3cccs3)o2)cc1 ZINC000051501848 568048334 /nfs/dbraw/zinc/04/83/34/568048334.db2.gz XAWQKEITAVBSCQ-OAHLLOKOSA-N 1 2 371.506 5.170 20 0 FKADLO CCCCOc1ccc(-c2nnc(C[N@H+](C)[C@H](C)c3cccs3)o2)cc1 ZINC000051501848 568048333 /nfs/dbraw/zinc/04/83/33/568048333.db2.gz XAWQKEITAVBSCQ-OAHLLOKOSA-N 1 2 371.506 5.170 20 0 FKADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000055042361 205204891 /nfs/dbraw/zinc/20/48/91/205204891.db2.gz BJGYATOJACWKTN-UHFFFAOYSA-N 1 2 366.408 5.362 20 0 FKADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000055042361 205204887 /nfs/dbraw/zinc/20/48/87/205204887.db2.gz BJGYATOJACWKTN-UHFFFAOYSA-N 1 2 366.408 5.362 20 0 FKADLO O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000060331844 212021016 /nfs/dbraw/zinc/02/10/16/212021016.db2.gz DHZKDEBDOFWSQT-UHFFFAOYSA-N 1 2 373.378 5.030 20 0 FKADLO CC(C)c1nc(C[NH2+][C@@H](COc2ccccc2F)c2ccccc2)cs1 ZINC000062422228 567951835 /nfs/dbraw/zinc/95/18/35/567951835.db2.gz MZYBBMFFUJKBDH-IBGZPJMESA-N 1 2 370.493 5.316 20 0 FKADLO COc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1O ZINC000062422479 567951838 /nfs/dbraw/zinc/95/18/38/567951838.db2.gz WNBSLYCDVWQYFU-NRFANRHFSA-N 1 2 371.839 5.073 20 0 FKADLO Clc1ccc([C@@H]2C[N@@H+](Cc3cccc4cnccc43)CCO2)cc1Cl ZINC000071762395 221369604 /nfs/dbraw/zinc/36/96/04/221369604.db2.gz ZQCIFIJCNVZWBC-FQEVSTJZSA-N 1 2 373.283 5.115 20 0 FKADLO Clc1ccc([C@@H]2C[N@H+](Cc3cccc4cnccc43)CCO2)cc1Cl ZINC000071762395 221369601 /nfs/dbraw/zinc/36/96/01/221369601.db2.gz ZQCIFIJCNVZWBC-FQEVSTJZSA-N 1 2 373.283 5.115 20 0 FKADLO Clc1ccc([C@H]2C[N@@H+](Cc3cccc4cnccc43)CCO2)cc1Cl ZINC000071762396 221369841 /nfs/dbraw/zinc/36/98/41/221369841.db2.gz ZQCIFIJCNVZWBC-HXUWFJFHSA-N 1 2 373.283 5.115 20 0 FKADLO Clc1ccc([C@H]2C[N@H+](Cc3cccc4cnccc43)CCO2)cc1Cl ZINC000071762396 221369839 /nfs/dbraw/zinc/36/98/39/221369839.db2.gz ZQCIFIJCNVZWBC-HXUWFJFHSA-N 1 2 373.283 5.115 20 0 FKADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1nc(-c2ccc(F)cc2)no1)C1CC1 ZINC000071939193 221387727 /nfs/dbraw/zinc/38/77/27/221387727.db2.gz XAJXUWMYXIJGPJ-ZDUSSCGKSA-N 1 2 371.843 5.255 20 0 FKADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1nc(-c2ccc(F)cc2)no1)C1CC1 ZINC000071939193 221387723 /nfs/dbraw/zinc/38/77/23/221387723.db2.gz XAJXUWMYXIJGPJ-ZDUSSCGKSA-N 1 2 371.843 5.255 20 0 FKADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000096955096 209164763 /nfs/dbraw/zinc/16/47/63/209164763.db2.gz RRKQZOXQNXRNIF-SFHVURJKSA-N 1 2 361.470 5.288 20 0 FKADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000096955096 209164762 /nfs/dbraw/zinc/16/47/62/209164762.db2.gz RRKQZOXQNXRNIF-SFHVURJKSA-N 1 2 361.470 5.288 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1nc(-c2ccccc2)no1 ZINC000096966028 222146249 /nfs/dbraw/zinc/14/62/49/222146249.db2.gz SCWNCVLWNKPPEI-RYUDHWBXSA-N 1 2 362.260 5.455 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)no1)c1ccc(Cl)cc1Cl ZINC000096966029 222146201 /nfs/dbraw/zinc/14/62/01/222146201.db2.gz SCWNCVLWNKPPEI-NEPJUHHUSA-N 1 2 362.260 5.455 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1nc(-c2ccccc2)no1 ZINC000096966031 209165855 /nfs/dbraw/zinc/16/58/55/209165855.db2.gz SCWNCVLWNKPPEI-VXGBXAGGSA-N 1 2 362.260 5.455 20 0 FKADLO c1coc(-c2nc(C[N@H+]3CCC[C@H]3c3nc4ccccc4s3)cs2)c1 ZINC000097039046 209168536 /nfs/dbraw/zinc/16/85/36/209168536.db2.gz XEVOWGGHWAHLMS-HNNXBMFYSA-N 1 2 367.499 5.350 20 0 FKADLO c1coc(-c2nc(C[N@@H+]3CCC[C@H]3c3nc4ccccc4s3)cs2)c1 ZINC000097039046 209168533 /nfs/dbraw/zinc/16/85/33/209168533.db2.gz XEVOWGGHWAHLMS-HNNXBMFYSA-N 1 2 367.499 5.350 20 0 FKADLO c1coc(-c2nc(C[N@H+]3CCC[C@@H]3c3nc4ccccc4s3)cs2)c1 ZINC000097039048 222153343 /nfs/dbraw/zinc/15/33/43/222153343.db2.gz XEVOWGGHWAHLMS-OAHLLOKOSA-N 1 2 367.499 5.350 20 0 FKADLO c1coc(-c2nc(C[N@@H+]3CCC[C@@H]3c3nc4ccccc4s3)cs2)c1 ZINC000097039048 222153339 /nfs/dbraw/zinc/15/33/39/222153339.db2.gz XEVOWGGHWAHLMS-OAHLLOKOSA-N 1 2 367.499 5.350 20 0 FKADLO Cc1c2cc(Br)ccc2oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000097040104 222153785 /nfs/dbraw/zinc/15/37/85/222153785.db2.gz CZQSXRCNPBNZIH-UHFFFAOYSA-N 1 2 373.250 5.076 20 0 FKADLO Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000097213888 222168815 /nfs/dbraw/zinc/16/88/15/222168815.db2.gz VTMDFLCKYYVOOP-UHFFFAOYSA-N 1 2 371.893 5.344 20 0 FKADLO Cc1cc(C)c(NC(=O)c2csc(-c3ccc(Cl)cc3)n2)c(C)[nH+]1 ZINC000097213943 222168740 /nfs/dbraw/zinc/16/87/40/222168740.db2.gz WKKQNHDIODXWIR-UHFFFAOYSA-N 1 2 357.866 5.036 20 0 FKADLO Cc1cc(-c2noc([C@@H](C)[NH2+][C@H](C)c3ccc(Cl)cc3)n2)ccc1F ZINC000097473778 205910591 /nfs/dbraw/zinc/91/05/91/205910591.db2.gz LPWSBTWAMPQTCW-CHWSQXEVSA-N 1 2 359.832 5.249 20 0 FKADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000097546024 222189568 /nfs/dbraw/zinc/18/95/68/222189568.db2.gz IYXPOGRHWDOYKL-XIKOKIGWSA-N 1 2 371.349 5.118 20 0 FKADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000097546024 222189564 /nfs/dbraw/zinc/18/95/64/222189564.db2.gz IYXPOGRHWDOYKL-XIKOKIGWSA-N 1 2 371.349 5.118 20 0 FKADLO CCc1ccccc1NC(=O)C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000105814638 222377031 /nfs/dbraw/zinc/37/70/31/222377031.db2.gz NARQJRLBRFKAQM-CYBMUJFWSA-N 1 2 365.304 5.187 20 0 FKADLO CCc1ccccc1NC(=O)C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000105814638 222377028 /nfs/dbraw/zinc/37/70/28/222377028.db2.gz NARQJRLBRFKAQM-CYBMUJFWSA-N 1 2 365.304 5.187 20 0 FKADLO CC[C@@H](C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1ccccc1 ZINC000108315398 206028933 /nfs/dbraw/zinc/02/89/33/206028933.db2.gz WHFCWXQGGGEMBF-HXUWFJFHSA-N 1 2 359.473 5.019 20 0 FKADLO O=C(Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1cc2ccccc2s1 ZINC000108852391 222432056 /nfs/dbraw/zinc/43/20/56/222432056.db2.gz UGASPJFLRLQGLV-UHFFFAOYSA-N 1 2 373.481 5.353 20 0 FKADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000109594014 209310920 /nfs/dbraw/zinc/31/09/20/209310920.db2.gz AXKYEUIYCBJZMG-UHFFFAOYSA-N 1 2 374.318 5.025 20 0 FKADLO CCOc1ccc2cc(C(=O)Nc3ccc(Oc4cc[nH+]cc4)cc3)[nH]c2c1 ZINC000109596725 209310622 /nfs/dbraw/zinc/31/06/22/209310622.db2.gz MOOWCUZRRIEZGB-UHFFFAOYSA-N 1 2 373.412 5.006 20 0 FKADLO Cc1[nH]c2ccc(C(=O)Nc3ccc(Oc4cc[nH+]cc4)cc3)cc2c1C ZINC000109597740 222467919 /nfs/dbraw/zinc/46/79/19/222467919.db2.gz KYYVANXQDXCMFH-UHFFFAOYSA-N 1 2 357.413 5.224 20 0 FKADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1ccc(Cl)cc1Cl ZINC000109684131 209310714 /nfs/dbraw/zinc/31/07/14/209310714.db2.gz SMJPONBTORUFNM-UHFFFAOYSA-N 1 2 366.635 5.085 20 0 FKADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)c1occc1-c1ccccc1 ZINC000109891510 206065642 /nfs/dbraw/zinc/06/56/42/206065642.db2.gz CVKOKBWCOFULQA-UHFFFAOYSA-N 1 2 357.413 5.343 20 0 FKADLO Cc1ccc(-c2cc(C(=O)Nc3ccc4[nH]c(C5CCC5)[nH+]c4c3)on2)cc1 ZINC000109894561 206065407 /nfs/dbraw/zinc/06/54/07/206065407.db2.gz DCXGZWMQVAVPQI-UHFFFAOYSA-N 1 2 372.428 5.046 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2)o1)[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000110273570 209321562 /nfs/dbraw/zinc/32/15/62/209321562.db2.gz GGXVMBPUVYXSLM-KRWDZBQOSA-N 1 2 367.452 5.480 20 0 FKADLO COc1cccc([C@H]([NH2+]Cc2nc(C)sc2C)c2ccccc2Cl)c1 ZINC000152001062 568273489 /nfs/dbraw/zinc/27/34/89/568273489.db2.gz VRJKWTNLGHFTRM-FQEVSTJZSA-N 1 2 372.921 5.301 20 0 FKADLO COc1cccc([C@@H]([NH2+]Cc2nc(C)sc2C)c2ccccc2Cl)c1 ZINC000152001144 568273469 /nfs/dbraw/zinc/27/34/69/568273469.db2.gz VRJKWTNLGHFTRM-HXUWFJFHSA-N 1 2 372.921 5.301 20 0 FKADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(F)c(Br)c2)cs1 ZINC000153237572 568511916 /nfs/dbraw/zinc/51/19/16/568511916.db2.gz WIXINPIDDARYTH-JTQLQIEISA-N 1 2 357.292 5.019 20 0 FKADLO C[C@@H]([NH2+]Cc1nc(-c2ccc(F)cc2)no1)c1cc(Cl)ccc1Cl ZINC000186180962 567890312 /nfs/dbraw/zinc/89/03/12/567890312.db2.gz RKLFHKUBESIPDG-SNVBAGLBSA-N 1 2 366.223 5.033 20 0 FKADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186183478 567890612 /nfs/dbraw/zinc/89/06/12/567890612.db2.gz JLINCOYZEMLOPO-MNOVXSKESA-N 1 2 359.322 5.398 20 0 FKADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186183495 567890597 /nfs/dbraw/zinc/89/05/97/567890597.db2.gz JLINCOYZEMLOPO-GHMZBOCLSA-N 1 2 359.322 5.398 20 0 FKADLO C[C@@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1cc(Cl)ccc1Cl ZINC000186184410 567890726 /nfs/dbraw/zinc/89/07/26/567890726.db2.gz UHIDXDBWKMJROW-SSDOTTSWSA-N 1 2 355.212 5.320 20 0 FKADLO C[C@H]([NH2+]Cc1nc(-c2ccc(F)cc2)no1)c1cc(Cl)ccc1Cl ZINC000186769199 567981459 /nfs/dbraw/zinc/98/14/59/567981459.db2.gz RKLFHKUBESIPDG-JTQLQIEISA-N 1 2 366.223 5.033 20 0 FKADLO CCO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186777516 567982769 /nfs/dbraw/zinc/98/27/69/567982769.db2.gz JLINCOYZEMLOPO-QWRGUYRKSA-N 1 2 359.322 5.398 20 0 FKADLO CCO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000186777532 567982817 /nfs/dbraw/zinc/98/28/17/567982817.db2.gz JLINCOYZEMLOPO-WDEREUQCSA-N 1 2 359.322 5.398 20 0 FKADLO C[C@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1cc(Cl)ccc1Cl ZINC000186780128 567983155 /nfs/dbraw/zinc/98/31/55/567983155.db2.gz UHIDXDBWKMJROW-ZETCQYMHSA-N 1 2 355.212 5.320 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1ncc(Br)cc1F)c1ccccc1Cl ZINC000186900695 568006734 /nfs/dbraw/zinc/00/67/34/568006734.db2.gz BMFOEJFXXIZIFG-UWVGGRQHSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ncc(Br)cc1F)c1ccccc1Cl ZINC000186900716 568006727 /nfs/dbraw/zinc/00/67/27/568006727.db2.gz BMFOEJFXXIZIFG-ZJUUUORDSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ncc(Br)cc1F ZINC000186900732 568006748 /nfs/dbraw/zinc/00/67/48/568006748.db2.gz BMFOEJFXXIZIFG-VHSXEESVSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ncc(Br)cc1F)c1ccccc1Cl ZINC000186900752 568006725 /nfs/dbraw/zinc/00/67/25/568006725.db2.gz BMFOEJFXXIZIFG-NXEZZACHSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1cc(Cl)sc1Cl ZINC000221855157 567853276 /nfs/dbraw/zinc/85/32/76/567853276.db2.gz MSYYHOYPDVWAEK-MRVPVSSYSA-N 1 2 352.233 5.507 20 0 FKADLO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1cc(Cl)sc1Cl ZINC000221855217 567853297 /nfs/dbraw/zinc/85/32/97/567853297.db2.gz MSYYHOYPDVWAEK-QMMMGPOBSA-N 1 2 352.233 5.507 20 0 FKADLO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2nc(C)cs2)c2cccs2)cc1 ZINC000236902341 568253085 /nfs/dbraw/zinc/25/30/85/568253085.db2.gz ZFLULEGXTKEVGU-JLTOFOAXSA-N 1 2 356.560 5.906 20 0 FKADLO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2nc(C)cs2)c2cccs2)cc1 ZINC000236903323 568254237 /nfs/dbraw/zinc/25/42/37/568254237.db2.gz ZFLULEGXTKEVGU-VLIAUNLRSA-N 1 2 356.560 5.906 20 0 FKADLO Fc1cc(F)c(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)c(F)c1F ZINC000430740445 568083554 /nfs/dbraw/zinc/08/35/54/568083554.db2.gz BVNBSYLBJODZSP-CYBMUJFWSA-N 1 2 361.791 5.223 20 0 FKADLO Fc1cc(F)c(C[NH2+][C@H]2CCSc3c(Cl)cccc32)c(F)c1F ZINC000430740451 568083523 /nfs/dbraw/zinc/08/35/23/568083523.db2.gz BVNBSYLBJODZSP-ZDUSSCGKSA-N 1 2 361.791 5.223 20 0 FKADLO Clc1scc(C[NH+]2CCC3(CC2)OCCc2ccsc23)c1Cl ZINC000432922753 568478610 /nfs/dbraw/zinc/47/86/10/568478610.db2.gz BIOCTIJNCCEGHG-UHFFFAOYSA-N 1 2 374.358 5.180 20 0 FKADLO CCC(C)(C)OCc1cccc(NC(=O)NCc2c[nH+]c(C)cc2C)c1C ZINC000454915896 568028795 /nfs/dbraw/zinc/02/87/95/568028795.db2.gz CUKHATGSRMYHBK-UHFFFAOYSA-N 1 2 369.509 5.034 20 0 FKADLO Cc1ccc(CN(Cc2ccco2)C(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC000455460252 568127136 /nfs/dbraw/zinc/12/71/36/568127136.db2.gz ANBBHGOFHQXSTI-UHFFFAOYSA-N 1 2 369.490 5.204 20 0 FKADLO CCCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)[C@@H](C)c1ccccc1OC ZINC000455461174 568127118 /nfs/dbraw/zinc/12/71/18/568127118.db2.gz BAXBPYYQTTYTIR-KRWDZBQOSA-N 1 2 355.482 5.021 20 0 FKADLO CCCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)[C@H](C)c1ccccc1OC ZINC000455461176 568127127 /nfs/dbraw/zinc/12/71/27/568127127.db2.gz BAXBPYYQTTYTIR-QGZVFWFLSA-N 1 2 355.482 5.021 20 0 FKADLO Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC000455462341 568127533 /nfs/dbraw/zinc/12/75/33/568127533.db2.gz BZYRDRXAZXYZAZ-UHFFFAOYSA-N 1 2 374.488 5.118 20 0 FKADLO Cc1cc(C)c(NC(=O)N(Cc2cccs2)Cc2cccs2)c(C)[nH+]1 ZINC000455464379 568127710 /nfs/dbraw/zinc/12/77/10/568127710.db2.gz DGAXMUBDUICAPF-UHFFFAOYSA-N 1 2 371.531 5.364 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2c2cccc3ccccc32)c(C)[nH+]1 ZINC000455465595 568128054 /nfs/dbraw/zinc/12/80/54/568128054.db2.gz DZNYESPNOMVALR-NRFANRHFSA-N 1 2 359.473 5.529 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2c2cccc3ccccc32)c(C)[nH+]1 ZINC000455465601 568127996 /nfs/dbraw/zinc/12/79/96/568127996.db2.gz DZNYESPNOMVALR-OAQYLSRUSA-N 1 2 359.473 5.529 20 0 FKADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000455466757 568128347 /nfs/dbraw/zinc/12/83/47/568128347.db2.gz FVLBUEKYGGULDL-JOCHJYFZSA-N 1 2 371.484 5.186 20 0 FKADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000455466765 568128307 /nfs/dbraw/zinc/12/83/07/568128307.db2.gz FVLBUEKYGGULDL-QFIPXVFZSA-N 1 2 371.484 5.186 20 0 FKADLO Cc1[nH]c2ccccc2c1C1=CCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC000455471506 568130157 /nfs/dbraw/zinc/13/01/57/568130157.db2.gz IVBAELLXHRRAAC-UHFFFAOYSA-N 1 2 374.488 5.118 20 0 FKADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000455471953 568130178 /nfs/dbraw/zinc/13/01/78/568130178.db2.gz BMWLEUSCJPTVMD-JOCHJYFZSA-N 1 2 371.484 5.338 20 0 FKADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000455471959 568130175 /nfs/dbraw/zinc/13/01/75/568130175.db2.gz BMWLEUSCJPTVMD-QFIPXVFZSA-N 1 2 371.484 5.338 20 0 FKADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)c(C)[nH+]1 ZINC000455472877 568130182 /nfs/dbraw/zinc/13/01/82/568130182.db2.gz JBHKAYANRHITEH-AWEZNQCLSA-N 1 2 365.399 5.251 20 0 FKADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c(C)[nH+]1 ZINC000455472878 568130200 /nfs/dbraw/zinc/13/02/00/568130200.db2.gz JBHKAYANRHITEH-CQSZACIVSA-N 1 2 365.399 5.251 20 0 FKADLO CCC(C)(C)OCc1ccccc1NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455473803 568130301 /nfs/dbraw/zinc/13/03/01/568130301.db2.gz CIUPIQNGVCKWKH-UHFFFAOYSA-N 1 2 355.482 5.356 20 0 FKADLO CCN(Cc1cccc(-c2ccncc2)c1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455474775 568130412 /nfs/dbraw/zinc/13/04/12/568130412.db2.gz DAZNFADDMWMFNI-UHFFFAOYSA-N 1 2 374.488 5.123 20 0 FKADLO Cc1cccc(CN(Cc2ccco2)C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455475111 568130383 /nfs/dbraw/zinc/13/03/83/568130383.db2.gz KSFHSGJDBACVPJ-UHFFFAOYSA-N 1 2 363.461 5.143 20 0 FKADLO Cc1cc(C)c(NC(=O)Nc2cccc(COC(C)(C)C)c2C)c(C)[nH+]1 ZINC000455481809 568130805 /nfs/dbraw/zinc/13/08/05/568130805.db2.gz HUDRMRYUHORBAH-UHFFFAOYSA-N 1 2 355.482 5.274 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c(C)[nH+]1 ZINC000455486316 568131205 /nfs/dbraw/zinc/13/12/05/568131205.db2.gz RSOKMDFDCMRWHM-HNNXBMFYSA-N 1 2 366.490 5.013 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c(C)[nH+]1 ZINC000455486331 568131243 /nfs/dbraw/zinc/13/12/43/568131243.db2.gz RSOKMDFDCMRWHM-OAHLLOKOSA-N 1 2 366.490 5.013 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c(C)[nH+]1 ZINC000455489662 568131914 /nfs/dbraw/zinc/13/19/14/568131914.db2.gz VXDDRJOZKJULFV-FQEVSTJZSA-N 1 2 362.477 5.247 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c(C)[nH+]1 ZINC000455489665 568132057 /nfs/dbraw/zinc/13/20/57/568132057.db2.gz VXDDRJOZKJULFV-HXUWFJFHSA-N 1 2 362.477 5.247 20 0 FKADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000455490264 568132028 /nfs/dbraw/zinc/13/20/28/568132028.db2.gz WVOKTVBXIYFUCE-AWEZNQCLSA-N 1 2 365.399 5.251 20 0 FKADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000455490665 568132086 /nfs/dbraw/zinc/13/20/86/568132086.db2.gz WVOKTVBXIYFUCE-CQSZACIVSA-N 1 2 365.399 5.251 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)c(C)[nH+]1 ZINC000455492364 568132257 /nfs/dbraw/zinc/13/22/57/568132257.db2.gz ZPYFUOOQORNLGC-HNNXBMFYSA-N 1 2 361.898 5.019 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)c(C)[nH+]1 ZINC000455492374 568132268 /nfs/dbraw/zinc/13/22/68/568132268.db2.gz ZPYFUOOQORNLGC-OAHLLOKOSA-N 1 2 361.898 5.019 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000455492421 568132232 /nfs/dbraw/zinc/13/22/32/568132232.db2.gz ZUZPQEAPGGZYNF-HSZRJFAPSA-N 1 2 371.484 5.186 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000455492424 568132281 /nfs/dbraw/zinc/13/22/81/568132281.db2.gz ZUZPQEAPGGZYNF-QHCPKHFHSA-N 1 2 371.484 5.186 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2C)c(C)[nH+]1 ZINC000455492504 568132213 /nfs/dbraw/zinc/13/22/13/568132213.db2.gz BRFWNRVFUVSJBL-INIZCTEOSA-N 1 2 365.399 5.130 20 0 FKADLO Cc1cc(C)c(NC(=O)N[C@H](CC(F)(F)F)c2ccccc2C)c(C)[nH+]1 ZINC000455492511 568132234 /nfs/dbraw/zinc/13/22/34/568132234.db2.gz BRFWNRVFUVSJBL-MRXNPFEDSA-N 1 2 365.399 5.130 20 0 FKADLO Cc1cc(C)c(NC(=O)Nc2ccccc2CCC(F)(F)F)c(C)[nH+]1 ZINC000455492901 568128990 /nfs/dbraw/zinc/12/89/90/568128990.db2.gz LQPBWZTYQPKNDY-UHFFFAOYSA-N 1 2 351.372 5.146 20 0 FKADLO Cc1cc(C)c(NC(=O)Nc2cnn(CCC(C)C)c2C(C)C)c(C)[nH+]1 ZINC000455493737 568129163 /nfs/dbraw/zinc/12/91/63/568129163.db2.gz CQWCYQPJWPKRQY-UHFFFAOYSA-N 1 2 357.502 5.017 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000455495538 568129487 /nfs/dbraw/zinc/12/94/87/568129487.db2.gz OJNGBWCXCKSLTG-GOSISDBHSA-N 1 2 359.420 5.044 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000455495542 568129538 /nfs/dbraw/zinc/12/95/38/568129538.db2.gz OJNGBWCXCKSLTG-SFHVURJKSA-N 1 2 359.420 5.044 20 0 FKADLO Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497469 568129689 /nfs/dbraw/zinc/12/96/89/568129689.db2.gz QFTUWFHAVVNYHW-HNNXBMFYSA-N 1 2 360.527 5.120 20 0 FKADLO Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497477 568129674 /nfs/dbraw/zinc/12/96/74/568129674.db2.gz QFTUWFHAVVNYHW-OAHLLOKOSA-N 1 2 360.527 5.120 20 0 FKADLO Cc1cc(C)c(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)c(C)[nH+]1 ZINC000455498448 568129699 /nfs/dbraw/zinc/12/96/99/568129699.db2.gz REXJUVXCGZZHDX-UHFFFAOYSA-N 1 2 351.372 5.146 20 0 FKADLO Cc1cc(C)c(NC(=O)Nc2ccc(COC3CCCC3)cc2)c(C)[nH+]1 ZINC000455500508 568129747 /nfs/dbraw/zinc/12/97/47/568129747.db2.gz SYOYBZNLUKIJQF-UHFFFAOYSA-N 1 2 353.466 5.110 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC(c3cccc(Cl)c3)CC2)c(C)[nH+]1 ZINC000455515249 568134152 /nfs/dbraw/zinc/13/41/52/568134152.db2.gz KBOOJLNBMHURJP-UHFFFAOYSA-N 1 2 357.885 5.072 20 0 FKADLO COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455518568 568135256 /nfs/dbraw/zinc/13/52/56/568135256.db2.gz LKUIMDYSTGZMDT-AUUYWEPGSA-N 1 2 367.493 5.021 20 0 FKADLO COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455518571 568135273 /nfs/dbraw/zinc/13/52/73/568135273.db2.gz LKUIMDYSTGZMDT-IFXJQAMLSA-N 1 2 367.493 5.021 20 0 FKADLO COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455518575 568135268 /nfs/dbraw/zinc/13/52/68/568135268.db2.gz LKUIMDYSTGZMDT-KUHUBIRLSA-N 1 2 367.493 5.021 20 0 FKADLO COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455518578 568135270 /nfs/dbraw/zinc/13/52/70/568135270.db2.gz LKUIMDYSTGZMDT-LIRRHRJNSA-N 1 2 367.493 5.021 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000455524802 568137026 /nfs/dbraw/zinc/13/70/26/568137026.db2.gz OVYBLVPBKTYADJ-GOSISDBHSA-N 1 2 357.885 5.419 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000455524806 568137041 /nfs/dbraw/zinc/13/70/41/568137041.db2.gz OVYBLVPBKTYADJ-SFHVURJKSA-N 1 2 357.885 5.419 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000455525499 568137037 /nfs/dbraw/zinc/13/70/37/568137037.db2.gz PFFHOYFDPJNKQM-GOSISDBHSA-N 1 2 357.885 5.419 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000455525500 568137084 /nfs/dbraw/zinc/13/70/84/568137084.db2.gz PFFHOYFDPJNKQM-SFHVURJKSA-N 1 2 357.885 5.419 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC(c3ccc(Cl)cc3)CC2)c(C)[nH+]1 ZINC000455539735 568138360 /nfs/dbraw/zinc/13/83/60/568138360.db2.gz YDRYRFBSWWRZRZ-UHFFFAOYSA-N 1 2 357.885 5.072 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)c(C)[nH+]1 ZINC000455540744 568138388 /nfs/dbraw/zinc/13/83/88/568138388.db2.gz YVLNQKSWUXUWDI-IBGZPJMESA-N 1 2 373.447 5.101 20 0 FKADLO Cc1cc(C)c(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)c(C)[nH+]1 ZINC000455540759 568138363 /nfs/dbraw/zinc/13/83/63/568138363.db2.gz YVLNQKSWUXUWDI-LJQANCHMSA-N 1 2 373.447 5.101 20 0 FKADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)Nc1cc(C)cc2ccccc21 ZINC000455748262 568161274 /nfs/dbraw/zinc/16/12/74/568161274.db2.gz XQOCFOFOSGTCMD-FQEVSTJZSA-N 1 2 362.477 5.124 20 0 FKADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)Nc1cc(C)cc2ccccc21 ZINC000455748264 568161272 /nfs/dbraw/zinc/16/12/72/568161272.db2.gz XQOCFOFOSGTCMD-HXUWFJFHSA-N 1 2 362.477 5.124 20 0 FKADLO Cc1cc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)sc1-c1cccc(Cl)c1 ZINC000456395799 568282036 /nfs/dbraw/zinc/28/20/36/568282036.db2.gz SMIBBPAWYDXTPU-DOMZBBRYSA-N 1 2 371.893 5.009 20 0 FKADLO Cc1cc(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)sc1-c1cccc(Cl)c1 ZINC000456395801 568282028 /nfs/dbraw/zinc/28/20/28/568282028.db2.gz SMIBBPAWYDXTPU-IUODEOHRSA-N 1 2 371.893 5.009 20 0 FKADLO Cc1cc(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)sc1-c1cccc(Cl)c1 ZINC000456395802 568282006 /nfs/dbraw/zinc/28/20/06/568282006.db2.gz SMIBBPAWYDXTPU-SWLSCSKDSA-N 1 2 371.893 5.009 20 0 FKADLO Cc1cc(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)sc1-c1cccc(Cl)c1 ZINC000456395804 568281977 /nfs/dbraw/zinc/28/19/77/568281977.db2.gz SMIBBPAWYDXTPU-WFASDCNBSA-N 1 2 371.893 5.009 20 0 FKADLO C[C@@H](CC(F)(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000457524091 568395371 /nfs/dbraw/zinc/39/53/71/568395371.db2.gz HLGZQIHCBFEULC-JTQLQIEISA-N 1 2 358.747 5.054 20 0 FKADLO C[C@H](CC(F)(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000457524094 568395375 /nfs/dbraw/zinc/39/53/75/568395375.db2.gz HLGZQIHCBFEULC-SNVBAGLBSA-N 1 2 358.747 5.054 20 0 FKADLO CC[C@H](CC(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000457546762 568396805 /nfs/dbraw/zinc/39/68/05/568396805.db2.gz ZZZWCQSYGWDQNZ-LLVKDONJSA-N 1 2 354.784 5.147 20 0 FKADLO CC[C@@H](CC(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000457546763 568396768 /nfs/dbraw/zinc/39/67/68/568396768.db2.gz ZZZWCQSYGWDQNZ-NSHDSACASA-N 1 2 354.784 5.147 20 0 FKADLO CC[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccc(Cl)c1F ZINC000461108713 568026228 /nfs/dbraw/zinc/02/62/28/568026228.db2.gz GJXPHUHEHAIQSZ-SJLPKXTDSA-N 1 2 360.885 5.766 20 0 FKADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1coc(C2CCCCC2)n1 ZINC000548600930 567830063 /nfs/dbraw/zinc/83/00/63/567830063.db2.gz VYVPWMYRLMFEIA-UHFFFAOYSA-N 1 2 363.417 5.162 20 0 FKADLO CCc1nc(C)c(NC(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)s1 ZINC000548625994 567838113 /nfs/dbraw/zinc/83/81/13/567838113.db2.gz BDWXVGXCACTGRV-UHFFFAOYSA-N 1 2 373.865 5.107 20 0 FKADLO CCc1ccc(-c2nc(C[NH2+]C3(c4nc(C)cs4)CCC3)cs2)cc1 ZINC000548626217 567838131 /nfs/dbraw/zinc/83/81/31/567838131.db2.gz LKHOHTMLVPVVQH-UHFFFAOYSA-N 1 2 369.559 5.306 20 0 FKADLO Cc1ccc(-c2noc(C[NH2+][C@@H](C)c3cc(Cl)ccc3Cl)n2)cc1 ZINC000548630509 567838305 /nfs/dbraw/zinc/83/83/05/567838305.db2.gz HVYIFWZGONHIKW-LBPRGKRZSA-N 1 2 362.260 5.203 20 0 FKADLO Cc1oc(-c2ccccc2)c(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1C ZINC000548690865 567862687 /nfs/dbraw/zinc/86/26/87/567862687.db2.gz NEPXPARMXHMRDN-UHFFFAOYSA-N 1 2 357.413 5.206 20 0 FKADLO Cc1oc(-c2ccccc2)c(C(=O)Nc2ccc3c(c2)[nH+]c(C)n3C)c1C ZINC000548693868 567862864 /nfs/dbraw/zinc/86/28/64/567862864.db2.gz UEHRBAAXXWPVPZ-UHFFFAOYSA-N 1 2 359.429 5.011 20 0 FKADLO CC(F)(F)c1cccc(NC(=O)CCn2c3ccccc3[nH+]c2C2CC2)c1 ZINC000548708003 567864028 /nfs/dbraw/zinc/86/40/28/567864028.db2.gz OXWRKFOSCHJUDE-UHFFFAOYSA-N 1 2 369.415 5.054 20 0 FKADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000548730126 567874086 /nfs/dbraw/zinc/87/40/86/567874086.db2.gz KMIYIBTXFFKBJU-JTQLQIEISA-N 1 2 353.775 5.075 20 0 FKADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000548730127 567874562 /nfs/dbraw/zinc/87/45/62/567874562.db2.gz KMIYIBTXFFKBJU-SNVBAGLBSA-N 1 2 353.775 5.075 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1nc2ccccc2n1C(F)F ZINC000548730459 567871742 /nfs/dbraw/zinc/87/17/42/567871742.db2.gz VTCLZDMDLJGIEN-GHMZBOCLSA-N 1 2 351.347 5.121 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)c1c(F)cccc1F ZINC000548730460 567872079 /nfs/dbraw/zinc/87/20/79/567872079.db2.gz VTCLZDMDLJGIEN-MNOVXSKESA-N 1 2 351.347 5.121 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2ccccc2n1C(F)F ZINC000548730461 567872229 /nfs/dbraw/zinc/87/22/29/567872229.db2.gz VTCLZDMDLJGIEN-QWRGUYRKSA-N 1 2 351.347 5.121 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2ccccc2n1C(F)F ZINC000548730462 567872246 /nfs/dbraw/zinc/87/22/46/567872246.db2.gz VTCLZDMDLJGIEN-WDEREUQCSA-N 1 2 351.347 5.121 20 0 FKADLO Cc1cc(SC2CCCCC2)ccc1NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000548741813 567878249 /nfs/dbraw/zinc/87/82/49/567878249.db2.gz BAWFLYKXXSUKRP-KRWDZBQOSA-N 1 2 369.534 5.202 20 0 FKADLO Cc1cc(SC2CCCCC2)ccc1NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000548741814 567878297 /nfs/dbraw/zinc/87/82/97/567878297.db2.gz BAWFLYKXXSUKRP-QGZVFWFLSA-N 1 2 369.534 5.202 20 0 FKADLO c1c2ccccc2oc1C[NH2+][C@@H](c1cc2ccccc2o1)c1cccnc1 ZINC000548796084 567888521 /nfs/dbraw/zinc/88/85/21/567888521.db2.gz IMCJROVHQHDMGD-HSZRJFAPSA-N 1 2 354.409 5.453 20 0 FKADLO c1c2ccccc2oc1C[NH2+][C@H](c1cc2ccccc2o1)c1cccnc1 ZINC000548796085 567888585 /nfs/dbraw/zinc/88/85/85/567888585.db2.gz IMCJROVHQHDMGD-QHCPKHFHSA-N 1 2 354.409 5.453 20 0 FKADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000548852974 567900995 /nfs/dbraw/zinc/90/09/95/567900995.db2.gz GECIMRXGSSXLOV-CYBMUJFWSA-N 1 2 358.894 5.568 20 0 FKADLO C[C@@H]1C[C@@]1([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 ZINC000548865918 567905254 /nfs/dbraw/zinc/90/52/54/567905254.db2.gz NFUZHFHPFVAWSN-BLVKFPJESA-N 1 2 374.271 5.068 20 0 FKADLO C[C@H]1C[C@@]1([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 ZINC000548865919 567905449 /nfs/dbraw/zinc/90/54/49/567905449.db2.gz NFUZHFHPFVAWSN-BUXKBTBVSA-N 1 2 374.271 5.068 20 0 FKADLO C[C@@H]1C[C@]1([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 ZINC000548865920 567905620 /nfs/dbraw/zinc/90/56/20/567905620.db2.gz NFUZHFHPFVAWSN-CWTRNNRKSA-N 1 2 374.271 5.068 20 0 FKADLO C[C@H]1C[C@]1([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 ZINC000548865921 567905633 /nfs/dbraw/zinc/90/56/33/567905633.db2.gz NFUZHFHPFVAWSN-HXPMCKFVSA-N 1 2 374.271 5.068 20 0 FKADLO COc1ccc(C[NH2+][C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)nc1 ZINC000548915571 567929513 /nfs/dbraw/zinc/92/95/13/567929513.db2.gz KQXNWYTWBRLMAE-GFCCVEGCSA-N 1 2 373.909 5.026 20 0 FKADLO COc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)nc1 ZINC000548915572 567929606 /nfs/dbraw/zinc/92/96/06/567929606.db2.gz KQXNWYTWBRLMAE-LBPRGKRZSA-N 1 2 373.909 5.026 20 0 FKADLO CCO[C@@H](C)c1nc(C[N@@H+](C)C(c2ccccc2)c2ccccc2)cs1 ZINC000548919746 567929665 /nfs/dbraw/zinc/92/96/65/567929665.db2.gz UXFSCNCFYKQVLY-KRWDZBQOSA-N 1 2 366.530 5.462 20 0 FKADLO CCO[C@@H](C)c1nc(C[N@H+](C)C(c2ccccc2)c2ccccc2)cs1 ZINC000548919746 567929664 /nfs/dbraw/zinc/92/96/64/567929664.db2.gz UXFSCNCFYKQVLY-KRWDZBQOSA-N 1 2 366.530 5.462 20 0 FKADLO CCO[C@H](C)c1nc(C[N@@H+](C)C(c2ccccc2)c2ccccc2)cs1 ZINC000548919748 567929724 /nfs/dbraw/zinc/92/97/24/567929724.db2.gz UXFSCNCFYKQVLY-QGZVFWFLSA-N 1 2 366.530 5.462 20 0 FKADLO CCO[C@H](C)c1nc(C[N@H+](C)C(c2ccccc2)c2ccccc2)cs1 ZINC000548919748 567929723 /nfs/dbraw/zinc/92/97/23/567929723.db2.gz UXFSCNCFYKQVLY-QGZVFWFLSA-N 1 2 366.530 5.462 20 0 FKADLO CC[C@H](C[N@@H+](C)[C@@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931677 567933618 /nfs/dbraw/zinc/93/36/18/567933618.db2.gz WSZAJENIVAWWOH-CMPLNLGQSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@H](C[N@H+](C)[C@@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931677 567933616 /nfs/dbraw/zinc/93/36/16/567933616.db2.gz WSZAJENIVAWWOH-CMPLNLGQSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@@H](C[N@@H+](C)[C@@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931678 567933703 /nfs/dbraw/zinc/93/37/03/567933703.db2.gz WSZAJENIVAWWOH-JQWIXIFHSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@@H](C[N@H+](C)[C@@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931678 567933701 /nfs/dbraw/zinc/93/37/01/567933701.db2.gz WSZAJENIVAWWOH-JQWIXIFHSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@@H](C[N@@H+](C)[C@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931679 567933651 /nfs/dbraw/zinc/93/36/51/567933651.db2.gz WSZAJENIVAWWOH-PWSUYJOCSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@@H](C[N@H+](C)[C@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931679 567933649 /nfs/dbraw/zinc/93/36/49/567933649.db2.gz WSZAJENIVAWWOH-PWSUYJOCSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@H](C[N@@H+](C)[C@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931680 567933578 /nfs/dbraw/zinc/93/35/78/567933578.db2.gz WSZAJENIVAWWOH-ZYHUDNBSSA-N 1 2 374.337 5.004 20 0 FKADLO CC[C@H](C[N@H+](C)[C@H](C)c1nnc(C)s1)Oc1ccc(Cl)c(Cl)c1 ZINC000548931680 567933577 /nfs/dbraw/zinc/93/35/77/567933577.db2.gz WSZAJENIVAWWOH-ZYHUDNBSSA-N 1 2 374.337 5.004 20 0 FKADLO CSc1ccccc1C[N@@H+](C)[C@H](C)c1nnc(-c2ccccc2F)s1 ZINC000548933102 567925693 /nfs/dbraw/zinc/92/56/93/567925693.db2.gz NIEKKWNKROFZAO-CYBMUJFWSA-N 1 2 373.522 5.259 20 0 FKADLO CSc1ccccc1C[N@H+](C)[C@H](C)c1nnc(-c2ccccc2F)s1 ZINC000548933102 567925691 /nfs/dbraw/zinc/92/56/91/567925691.db2.gz NIEKKWNKROFZAO-CYBMUJFWSA-N 1 2 373.522 5.259 20 0 FKADLO CSc1ccccc1C[N@@H+](C)[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000548933103 567925823 /nfs/dbraw/zinc/92/58/23/567925823.db2.gz NIEKKWNKROFZAO-ZDUSSCGKSA-N 1 2 373.522 5.259 20 0 FKADLO CSc1ccccc1C[N@H+](C)[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000548933103 567925821 /nfs/dbraw/zinc/92/58/21/567925821.db2.gz NIEKKWNKROFZAO-ZDUSSCGKSA-N 1 2 373.522 5.259 20 0 FKADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@H](C(F)(F)F)C4(CCC4)C3)cs2)o1 ZINC000548934065 567926203 /nfs/dbraw/zinc/92/62/03/567926203.db2.gz PRDGWKRXEOHORK-HNNXBMFYSA-N 1 2 370.440 5.266 20 0 FKADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@H](C(F)(F)F)C4(CCC4)C3)cs2)o1 ZINC000548934065 567926201 /nfs/dbraw/zinc/92/62/01/567926201.db2.gz PRDGWKRXEOHORK-HNNXBMFYSA-N 1 2 370.440 5.266 20 0 FKADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@@H](C(F)(F)F)C4(CCC4)C3)cs2)o1 ZINC000548934066 567926169 /nfs/dbraw/zinc/92/61/69/567926169.db2.gz PRDGWKRXEOHORK-OAHLLOKOSA-N 1 2 370.440 5.266 20 0 FKADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@@H](C(F)(F)F)C4(CCC4)C3)cs2)o1 ZINC000548934066 567926167 /nfs/dbraw/zinc/92/61/67/567926167.db2.gz PRDGWKRXEOHORK-OAHLLOKOSA-N 1 2 370.440 5.266 20 0 FKADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)CC12CCC2 ZINC000548934993 567926182 /nfs/dbraw/zinc/92/61/82/567926182.db2.gz ZQJZWTQFRNQXER-AWEZNQCLSA-N 1 2 372.481 5.426 20 0 FKADLO FC(F)(F)[C@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)CC12CCC2 ZINC000548934993 567926180 /nfs/dbraw/zinc/92/61/80/567926180.db2.gz ZQJZWTQFRNQXER-AWEZNQCLSA-N 1 2 372.481 5.426 20 0 FKADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)CC12CCC2 ZINC000548934994 567926229 /nfs/dbraw/zinc/92/62/29/567926229.db2.gz ZQJZWTQFRNQXER-CQSZACIVSA-N 1 2 372.481 5.426 20 0 FKADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)CC12CCC2 ZINC000548934994 567926228 /nfs/dbraw/zinc/92/62/28/567926228.db2.gz ZQJZWTQFRNQXER-CQSZACIVSA-N 1 2 372.481 5.426 20 0 FKADLO O=C(Nc1cccc(Cl)c1Cl)c1ccccc1Oc1cc[nH+]cc1 ZINC000548935423 567926159 /nfs/dbraw/zinc/92/61/59/567926159.db2.gz JJYTYFBPFAQIJL-UHFFFAOYSA-N 1 2 359.212 5.433 20 0 FKADLO CC(C)n1cc2ccc(NC(=O)c3ccccc3Oc3cc[nH+]cc3)cc2n1 ZINC000548937528 567927275 /nfs/dbraw/zinc/92/72/75/567927275.db2.gz MIPJMEGIYMAINO-UHFFFAOYSA-N 1 2 372.428 5.057 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000549012892 567969498 /nfs/dbraw/zinc/96/94/98/567969498.db2.gz VBIVYGFZTOAABZ-UHFFFAOYSA-N 1 2 359.882 5.509 20 0 FKADLO CCn1c(SCc2ccc(C(C)C)[nH+]c2C)nnc1-c1cccs1 ZINC000549018488 567969583 /nfs/dbraw/zinc/96/95/83/567969583.db2.gz XANLLMRYPUGRQB-UHFFFAOYSA-N 1 2 358.536 5.146 20 0 FKADLO CCc1[nH+]c2cc(CNC(=O)CC/C=C\c3ccccc3)ccc2n1C1CC1 ZINC000549032493 567975856 /nfs/dbraw/zinc/97/58/56/567975856.db2.gz IHILOWYNTOBOLP-POHAHGRESA-N 1 2 373.500 5.043 20 0 FKADLO CCc1[nH+]c2cc(CNC(=O)CC/C=C/c3ccccc3)ccc2n1C1CC1 ZINC000549032497 567975832 /nfs/dbraw/zinc/97/58/32/567975832.db2.gz IHILOWYNTOBOLP-UXBLZVDNSA-N 1 2 373.500 5.043 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2cccc(Cl)c2)o1 ZINC000549034381 567976403 /nfs/dbraw/zinc/97/64/03/567976403.db2.gz PVDONUQOUMXCJE-UHFFFAOYSA-N 1 2 359.882 5.509 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(C(C)C)n1Cc1ccco1 ZINC000549036461 567976492 /nfs/dbraw/zinc/97/64/92/567976492.db2.gz MBMCUFHUZHLBAL-UHFFFAOYSA-N 1 2 370.522 5.162 20 0 FKADLO Cc1cccc([C@H]([NH2+]Cc2nc(C)c3ccccc3n2)c2cccc(F)c2)c1 ZINC000549043107 567977041 /nfs/dbraw/zinc/97/70/41/567977041.db2.gz ZTNPDLVVERCRKB-DEOSSOPVSA-N 1 2 371.459 5.265 20 0 FKADLO Cc1cccc([C@@H]([NH2+]Cc2nc(C)c3ccccc3n2)c2cccc(F)c2)c1 ZINC000549043108 567976998 /nfs/dbraw/zinc/97/69/98/567976998.db2.gz ZTNPDLVVERCRKB-XMMPIXPASA-N 1 2 371.459 5.265 20 0 FKADLO CCn1c(SCc2ccc(C(C)C)[nH+]c2C)nnc1-c1ccc(F)cc1 ZINC000549056655 567978205 /nfs/dbraw/zinc/97/82/05/567978205.db2.gz OHFAHTQNTKZUKT-UHFFFAOYSA-N 1 2 370.497 5.223 20 0 FKADLO CC(C)(C)c1cnc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000549078975 567980545 /nfs/dbraw/zinc/98/05/45/567980545.db2.gz RDEMDLPECHSLOV-QGZVFWFLSA-N 1 2 352.400 5.232 20 0 FKADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000549131462 567984643 /nfs/dbraw/zinc/98/46/43/567984643.db2.gz IBPJQERTTGUQQM-CYBMUJFWSA-N 1 2 358.894 5.323 20 0 FKADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000549131463 567984635 /nfs/dbraw/zinc/98/46/35/567984635.db2.gz IBPJQERTTGUQQM-ZDUSSCGKSA-N 1 2 358.894 5.323 20 0 FKADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)C(c1ccccc1)c1ccccc1 ZINC000549138256 567984888 /nfs/dbraw/zinc/98/48/88/567984888.db2.gz BLJVWIISJRLFST-UHFFFAOYSA-N 1 2 362.420 5.383 20 0 FKADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)C(c1ccccc1)c1ccccc1 ZINC000549138256 567984887 /nfs/dbraw/zinc/98/48/87/567984887.db2.gz BLJVWIISJRLFST-UHFFFAOYSA-N 1 2 362.420 5.383 20 0 FKADLO Brc1cccc2c(NCc3cc4ccccc4[nH]3)cc[nH+]c12 ZINC000549170090 567987016 /nfs/dbraw/zinc/98/70/16/567987016.db2.gz BVAZNNHYTUQDIY-UHFFFAOYSA-N 1 2 352.235 5.091 20 0 FKADLO CC[N@@H+](Cc1nc(-c2ccccc2Cl)no1)Cc1ccccc1Cl ZINC000549174586 567987086 /nfs/dbraw/zinc/98/70/86/567987086.db2.gz RZNSWBFPTRMEKX-UHFFFAOYSA-N 1 2 362.260 5.066 20 0 FKADLO CC[N@H+](Cc1nc(-c2ccccc2Cl)no1)Cc1ccccc1Cl ZINC000549174586 567987085 /nfs/dbraw/zinc/98/70/85/567987085.db2.gz RZNSWBFPTRMEKX-UHFFFAOYSA-N 1 2 362.260 5.066 20 0 FKADLO CC(C)n1ncc2cc(C[NH+]3Cc4ccccc4-c4ccccc4C3)cnc21 ZINC000549243124 568000744 /nfs/dbraw/zinc/00/07/44/568000744.db2.gz UOEFLNSOGFUUNC-UHFFFAOYSA-N 1 2 368.484 5.195 20 0 FKADLO CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(C)C)[nH+]c1C ZINC000549299143 568014682 /nfs/dbraw/zinc/01/46/82/568014682.db2.gz BXCPEVUTUKIPOB-UHFFFAOYSA-N 1 2 366.534 5.008 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(C[C@H](C)c2ccccc2)o1 ZINC000549300224 568014755 /nfs/dbraw/zinc/01/47/55/568014755.db2.gz PKIODLDGNILACM-HNNXBMFYSA-N 1 2 367.518 5.535 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(C[C@@H](C)c2ccccc2)o1 ZINC000549300233 568014718 /nfs/dbraw/zinc/01/47/18/568014718.db2.gz PKIODLDGNILACM-OAHLLOKOSA-N 1 2 367.518 5.535 20 0 FKADLO Cc1cc(C)c(-c2nnc(SCc3ccc(C(C)C)[nH+]c3C)o2)c(C)c1 ZINC000549336732 568030987 /nfs/dbraw/zinc/03/09/87/568030987.db2.gz HWODEYJSHHTCCZ-UHFFFAOYSA-N 1 2 367.518 5.781 20 0 FKADLO Cc1ccc(-c2nnc(SCc3ccc(C(C)C)[nH+]c3C)o2)c(C)c1 ZINC000549336797 568030963 /nfs/dbraw/zinc/03/09/63/568030963.db2.gz LBOVEBVMZOSCOT-UHFFFAOYSA-N 1 2 353.491 5.473 20 0 FKADLO CC(C)[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1[nH]cc[nH+]1 ZINC000549348396 568031490 /nfs/dbraw/zinc/03/14/90/568031490.db2.gz QUNNKZZZHORBGG-CYBMUJFWSA-N 1 2 368.289 5.058 20 0 FKADLO CC(C)[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1[nH]cc[nH+]1 ZINC000549348397 568031500 /nfs/dbraw/zinc/03/15/00/568031500.db2.gz QUNNKZZZHORBGG-ZDUSSCGKSA-N 1 2 368.289 5.058 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nncn1[C@@H](C)c1ccccc1 ZINC000549350504 568031507 /nfs/dbraw/zinc/03/15/07/568031507.db2.gz ZAARXIPTJCZCTN-INIZCTEOSA-N 1 2 352.507 5.007 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nncn1[C@H](C)c1ccccc1 ZINC000549350506 568031505 /nfs/dbraw/zinc/03/15/05/568031505.db2.gz ZAARXIPTJCZCTN-MRXNPFEDSA-N 1 2 352.507 5.007 20 0 FKADLO CC(C)COc1ccccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000549377253 568048726 /nfs/dbraw/zinc/04/87/26/568048726.db2.gz JKPHAWISCDSMQG-FQEVSTJZSA-N 1 2 352.503 5.057 20 0 FKADLO CC(C)COc1ccccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000549377254 568048776 /nfs/dbraw/zinc/04/87/76/568048776.db2.gz JKPHAWISCDSMQG-HXUWFJFHSA-N 1 2 352.503 5.057 20 0 FKADLO Cc1nc(-c2cccc(NCc3c[nH+]c4ccc(Cl)cn34)c2)cs1 ZINC000549380562 567999310 /nfs/dbraw/zinc/99/93/10/567999310.db2.gz YXRNNLXIRAYFHN-UHFFFAOYSA-N 1 2 354.866 5.032 20 0 FKADLO CCc1nc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)no1 ZINC000549404363 568020550 /nfs/dbraw/zinc/02/05/50/568020550.db2.gz OXXRKRXLQJNNFY-GOSISDBHSA-N 1 2 367.415 5.062 20 0 FKADLO CCc1nc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)no1 ZINC000549404368 568020512 /nfs/dbraw/zinc/02/05/12/568020512.db2.gz OXXRKRXLQJNNFY-SFHVURJKSA-N 1 2 367.415 5.062 20 0 FKADLO Cc1[nH+]cc(CNc2cc(Cc3ccccn3)ccc2C)n1-c1ccccc1 ZINC000549406548 568020577 /nfs/dbraw/zinc/02/05/77/568020577.db2.gz BGKUJMSTOCQMBA-UHFFFAOYSA-N 1 2 368.484 5.087 20 0 FKADLO CC[C@H]([NH2+]Cc1cccc(F)c1Cl)c1nc(C(F)(F)F)cs1 ZINC000549545457 568024633 /nfs/dbraw/zinc/02/46/33/568024633.db2.gz UXDVZVGEZIPXLZ-JTQLQIEISA-N 1 2 352.784 5.195 20 0 FKADLO CC[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1nc(C(F)(F)F)cs1 ZINC000549545458 568024626 /nfs/dbraw/zinc/02/46/26/568024626.db2.gz UXDVZVGEZIPXLZ-SNVBAGLBSA-N 1 2 352.784 5.195 20 0 FKADLO Cc1ccsc1CN(C)C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000549607666 568034376 /nfs/dbraw/zinc/03/43/76/568034376.db2.gz HOAVKUSWAZYUFR-UHFFFAOYSA-N 1 2 372.877 5.169 20 0 FKADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000549612959 568034586 /nfs/dbraw/zinc/03/45/86/568034586.db2.gz JAWNXKZLDJXRPS-GOSISDBHSA-N 1 2 358.555 5.134 20 0 FKADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000549612960 568034568 /nfs/dbraw/zinc/03/45/68/568034568.db2.gz JAWNXKZLDJXRPS-SFHVURJKSA-N 1 2 358.555 5.134 20 0 FKADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@H]1c1ccccc1 ZINC000549627204 568034815 /nfs/dbraw/zinc/03/48/15/568034815.db2.gz YMGPPYVVOMQCDL-QMMLZNLJSA-N 1 2 355.485 5.206 20 0 FKADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@H]1c1ccccc1 ZINC000549627205 568034827 /nfs/dbraw/zinc/03/48/27/568034827.db2.gz YMGPPYVVOMQCDL-YYWHXJBOSA-N 1 2 355.485 5.206 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)s1 ZINC000549687074 568036742 /nfs/dbraw/zinc/03/67/42/568036742.db2.gz ILZXSFUHSVVELG-MRVPVSSYSA-N 1 2 365.326 5.303 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)s1 ZINC000549687075 568036686 /nfs/dbraw/zinc/03/66/86/568036686.db2.gz ILZXSFUHSVVELG-QMMMGPOBSA-N 1 2 365.326 5.303 20 0 FKADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000549688122 568036985 /nfs/dbraw/zinc/03/69/85/568036985.db2.gz NCOVXTPFAPZMBZ-IBGZPJMESA-N 1 2 374.326 5.008 20 0 FKADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000549688122 568036984 /nfs/dbraw/zinc/03/69/84/568036984.db2.gz NCOVXTPFAPZMBZ-IBGZPJMESA-N 1 2 374.326 5.008 20 0 FKADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000549688123 568036971 /nfs/dbraw/zinc/03/69/71/568036971.db2.gz NCOVXTPFAPZMBZ-LJQANCHMSA-N 1 2 374.326 5.008 20 0 FKADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000549688123 568036970 /nfs/dbraw/zinc/03/69/70/568036970.db2.gz NCOVXTPFAPZMBZ-LJQANCHMSA-N 1 2 374.326 5.008 20 0 FKADLO Cc1ccc(C[S@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000549689770 568036997 /nfs/dbraw/zinc/03/69/97/568036997.db2.gz XQMJRVJHKFUVLN-BWKNWUBXSA-N 1 2 369.917 5.390 20 0 FKADLO Cc1ccc(C[S@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000549689771 568036976 /nfs/dbraw/zinc/03/69/76/568036976.db2.gz XQMJRVJHKFUVLN-OFVILXPXSA-N 1 2 369.917 5.390 20 0 FKADLO Cc1ccc(C[S@@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000549689772 568037001 /nfs/dbraw/zinc/03/70/01/568037001.db2.gz XQMJRVJHKFUVLN-PXDATVDWSA-N 1 2 369.917 5.390 20 0 FKADLO Cc1ccc(C[S@@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000549689773 568036990 /nfs/dbraw/zinc/03/69/90/568036990.db2.gz XQMJRVJHKFUVLN-SQJMNOBHSA-N 1 2 369.917 5.390 20 0 FKADLO Cc1csc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)c1Cl ZINC000549718885 568030498 /nfs/dbraw/zinc/03/04/98/568030498.db2.gz GAHMTGBJBBQKLB-UHFFFAOYSA-N 1 2 371.893 5.162 20 0 FKADLO Cc1nc(C2([NH2+]Cc3sc4c(cccc4Cl)c3C)CCCC2)no1 ZINC000549734120 568030826 /nfs/dbraw/zinc/03/08/26/568030826.db2.gz SJCBHBZLHUMNDZ-UHFFFAOYSA-N 1 2 361.898 5.114 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2F)s1 ZINC000549760864 568031546 /nfs/dbraw/zinc/03/15/46/568031546.db2.gz HCPAROXRMJYQEZ-IBGZPJMESA-N 1 2 372.534 5.219 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2F)s1 ZINC000549760865 568031582 /nfs/dbraw/zinc/03/15/82/568031582.db2.gz HCPAROXRMJYQEZ-LJQANCHMSA-N 1 2 372.534 5.219 20 0 FKADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1ccccn1 ZINC000549778868 568031953 /nfs/dbraw/zinc/03/19/53/568031953.db2.gz JOEJHFVZEDTVRJ-DEOSSOPVSA-N 1 2 358.485 5.237 20 0 FKADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1ccccn1 ZINC000549778869 568031913 /nfs/dbraw/zinc/03/19/13/568031913.db2.gz JOEJHFVZEDTVRJ-XMMPIXPASA-N 1 2 358.485 5.237 20 0 FKADLO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2noc(-c3ccc(Cl)cc3)n2)c1 ZINC000549780213 568032090 /nfs/dbraw/zinc/03/20/90/568032090.db2.gz CBHVKCDKRMRJEC-GFCCVEGCSA-N 1 2 362.260 5.203 20 0 FKADLO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2noc(-c3ccc(Cl)cc3)n2)c1 ZINC000549780214 568032064 /nfs/dbraw/zinc/03/20/64/568032064.db2.gz CBHVKCDKRMRJEC-LBPRGKRZSA-N 1 2 362.260 5.203 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)s1 ZINC000549780330 568032073 /nfs/dbraw/zinc/03/20/73/568032073.db2.gz KQAYJGOSRWPVFJ-IBGZPJMESA-N 1 2 358.507 5.024 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)s1 ZINC000549780331 568032038 /nfs/dbraw/zinc/03/20/38/568032038.db2.gz KQAYJGOSRWPVFJ-LJQANCHMSA-N 1 2 358.507 5.024 20 0 FKADLO CSCc1cnc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)s1 ZINC000549780870 568031991 /nfs/dbraw/zinc/03/19/91/568031991.db2.gz VWPJFKWRDRYRRO-UHFFFAOYSA-N 1 2 368.518 5.234 20 0 FKADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000549781268 568032077 /nfs/dbraw/zinc/03/20/77/568032077.db2.gz FYECFCUASWQHPW-GFCCVEGCSA-N 1 2 369.515 5.514 20 0 FKADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000549781268 568032076 /nfs/dbraw/zinc/03/20/76/568032076.db2.gz FYECFCUASWQHPW-GFCCVEGCSA-N 1 2 369.515 5.514 20 0 FKADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000549781269 568032060 /nfs/dbraw/zinc/03/20/60/568032060.db2.gz FYECFCUASWQHPW-LBPRGKRZSA-N 1 2 369.515 5.514 20 0 FKADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000549781269 568032059 /nfs/dbraw/zinc/03/20/59/568032059.db2.gz FYECFCUASWQHPW-LBPRGKRZSA-N 1 2 369.515 5.514 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)s1 ZINC000549822490 568035650 /nfs/dbraw/zinc/03/56/50/568035650.db2.gz CDTFNOWLSUDNAS-INIZCTEOSA-N 1 2 373.374 5.554 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)s1 ZINC000549822493 568035623 /nfs/dbraw/zinc/03/56/23/568035623.db2.gz CDTFNOWLSUDNAS-MRXNPFEDSA-N 1 2 373.374 5.554 20 0 FKADLO CC(F)(F)c1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)cc1 ZINC000549902369 568039093 /nfs/dbraw/zinc/03/90/93/568039093.db2.gz TZPSNTMYKGTELP-UHFFFAOYSA-N 1 2 354.356 5.238 20 0 FKADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccc(Br)cc2)o1 ZINC000549918909 568039557 /nfs/dbraw/zinc/03/95/57/568039557.db2.gz BXZPXTLOPQGZJI-HNNXBMFYSA-N 1 2 363.299 5.072 20 0 FKADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccc(Br)cc2)o1 ZINC000549918909 568039555 /nfs/dbraw/zinc/03/95/55/568039555.db2.gz BXZPXTLOPQGZJI-HNNXBMFYSA-N 1 2 363.299 5.072 20 0 FKADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccc(Br)cc2)o1 ZINC000549918914 568039585 /nfs/dbraw/zinc/03/95/85/568039585.db2.gz BXZPXTLOPQGZJI-OAHLLOKOSA-N 1 2 363.299 5.072 20 0 FKADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(Br)cc2)o1 ZINC000549918914 568039584 /nfs/dbraw/zinc/03/95/84/568039584.db2.gz BXZPXTLOPQGZJI-OAHLLOKOSA-N 1 2 363.299 5.072 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000549933866 568039786 /nfs/dbraw/zinc/03/97/86/568039786.db2.gz HPMUJQOSWQOGMH-HNNXBMFYSA-N 1 2 356.514 5.049 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000549933867 568039857 /nfs/dbraw/zinc/03/98/57/568039857.db2.gz HPMUJQOSWQOGMH-OAHLLOKOSA-N 1 2 356.514 5.049 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000550000004 568042048 /nfs/dbraw/zinc/04/20/48/568042048.db2.gz LGZFGFSULRVHTD-LLVKDONJSA-N 1 2 357.445 5.094 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000550000011 568042022 /nfs/dbraw/zinc/04/20/22/568042022.db2.gz LGZFGFSULRVHTD-NSHDSACASA-N 1 2 357.445 5.094 20 0 FKADLO CC(=O)c1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(Cl)c2)cs1 ZINC000550009383 568042435 /nfs/dbraw/zinc/04/24/35/568042435.db2.gz ZWYNFOAFRFZSRG-UHFFFAOYSA-N 1 2 372.833 5.044 20 0 FKADLO FC(F)c1cccc(C[N@H+]2CCC[C@H]2c2ccc(Br)cn2)c1 ZINC000550078910 568044158 /nfs/dbraw/zinc/04/41/58/568044158.db2.gz FXBDPBBLBWDXQE-INIZCTEOSA-N 1 2 367.237 5.119 20 0 FKADLO FC(F)c1cccc(C[N@@H+]2CCC[C@H]2c2ccc(Br)cn2)c1 ZINC000550078910 568044157 /nfs/dbraw/zinc/04/41/57/568044157.db2.gz FXBDPBBLBWDXQE-INIZCTEOSA-N 1 2 367.237 5.119 20 0 FKADLO FC(F)c1cccc(C[N@H+]2CCC[C@@H]2c2ccc(Br)cn2)c1 ZINC000550078911 568044138 /nfs/dbraw/zinc/04/41/38/568044138.db2.gz FXBDPBBLBWDXQE-MRXNPFEDSA-N 1 2 367.237 5.119 20 0 FKADLO FC(F)c1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(Br)cn2)c1 ZINC000550078911 568044136 /nfs/dbraw/zinc/04/41/36/568044136.db2.gz FXBDPBBLBWDXQE-MRXNPFEDSA-N 1 2 367.237 5.119 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccccc2Sc2ccccc2)s1 ZINC000550142579 568042900 /nfs/dbraw/zinc/04/29/00/568042900.db2.gz WTUXKOJQOABFGX-UHFFFAOYSA-N 1 2 372.584 5.447 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccccc2Oc2ccc(C)cc2)s1 ZINC000550144181 568043355 /nfs/dbraw/zinc/04/33/55/568043355.db2.gz QMFJSYXWMOJQNO-UHFFFAOYSA-N 1 2 370.543 5.397 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000550171646 568044891 /nfs/dbraw/zinc/04/48/91/568044891.db2.gz NJBBIZZUMCASPI-INIZCTEOSA-N 1 2 356.507 5.161 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000550171651 568044979 /nfs/dbraw/zinc/04/49/79/568044979.db2.gz NJBBIZZUMCASPI-MRXNPFEDSA-N 1 2 356.507 5.161 20 0 FKADLO CCCCn1cc[nH+]c1-c1cccc(NCc2ncc(CSC)s2)c1 ZINC000550174433 568044981 /nfs/dbraw/zinc/04/49/81/568044981.db2.gz IPWMDSZEADIBNQ-UHFFFAOYSA-N 1 2 372.563 5.282 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccc(C)cc2OCCC(C)C)s1 ZINC000550174718 568044985 /nfs/dbraw/zinc/04/49/85/568044985.db2.gz UFWRHELQOGUCIB-UHFFFAOYSA-N 1 2 364.580 5.029 20 0 FKADLO CC(C)c1ccoc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000550191730 568045550 /nfs/dbraw/zinc/04/55/50/568045550.db2.gz RBACPGNDEUWRSO-UHFFFAOYSA-N 1 2 356.809 5.496 20 0 FKADLO Cn1ccc([C@H]([NH2+]Cc2ccc(C3CCC3)cc2)c2ccc(Cl)cc2)n1 ZINC000550199579 568045854 /nfs/dbraw/zinc/04/58/54/568045854.db2.gz CSIRRTXHGYLYGS-JOCHJYFZSA-N 1 2 365.908 5.220 20 0 FKADLO Cn1ccc([C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)c2ccc(Cl)cc2)n1 ZINC000550199580 568045848 /nfs/dbraw/zinc/04/58/48/568045848.db2.gz CSIRRTXHGYLYGS-QFIPXVFZSA-N 1 2 365.908 5.220 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000550219473 568046268 /nfs/dbraw/zinc/04/62/68/568046268.db2.gz MROKQPGXZVZEGZ-UHFFFAOYSA-N 1 2 371.695 5.026 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000550219473 568046266 /nfs/dbraw/zinc/04/62/66/568046266.db2.gz MROKQPGXZVZEGZ-UHFFFAOYSA-N 1 2 371.695 5.026 20 0 FKADLO CC(F)(F)c1ccc(C[NH2+]Cc2csc(COc3ccccc3)n2)cc1 ZINC000550225775 568046336 /nfs/dbraw/zinc/04/63/36/568046336.db2.gz PLJITTFQVYCHAY-UHFFFAOYSA-N 1 2 374.456 5.124 20 0 FKADLO Cc1ccc(OCc2nc(C[NH2+]Cc3coc4ccccc34)cs2)cc1 ZINC000550226530 568046481 /nfs/dbraw/zinc/04/64/81/568046481.db2.gz DMWCHLPFBKLMEK-UHFFFAOYSA-N 1 2 364.470 5.067 20 0 FKADLO Cc1ccoc1C[NH2+]C1(c2nc(-c3ccccc3F)c(C)s2)CCC1 ZINC000550319527 568049829 /nfs/dbraw/zinc/04/98/29/568049829.db2.gz FEHVBJIPPZCHAV-UHFFFAOYSA-N 1 2 356.466 5.328 20 0 FKADLO Cc1nc(C[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)cs1 ZINC000550324317 568049969 /nfs/dbraw/zinc/04/99/69/568049969.db2.gz DHLBJWOMGFKYFE-UHFFFAOYSA-N 1 2 373.522 5.192 20 0 FKADLO Cc1csc(C[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)n1 ZINC000550324877 568049965 /nfs/dbraw/zinc/04/99/65/568049965.db2.gz KOLQMTFMACXMLV-UHFFFAOYSA-N 1 2 373.522 5.192 20 0 FKADLO CCc1nocc1C[N@@H+](C)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000550344870 568050606 /nfs/dbraw/zinc/05/06/06/568050606.db2.gz NWSFAVOIAKHSBM-CYBMUJFWSA-N 1 2 359.857 5.047 20 0 FKADLO CCc1nocc1C[N@H+](C)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000550344870 568050605 /nfs/dbraw/zinc/05/06/05/568050605.db2.gz NWSFAVOIAKHSBM-CYBMUJFWSA-N 1 2 359.857 5.047 20 0 FKADLO CCc1nocc1C[N@@H+](C)[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000550344873 568050582 /nfs/dbraw/zinc/05/05/82/568050582.db2.gz NWSFAVOIAKHSBM-ZDUSSCGKSA-N 1 2 359.857 5.047 20 0 FKADLO CCc1nocc1C[N@H+](C)[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000550344873 568050580 /nfs/dbraw/zinc/05/05/80/568050580.db2.gz NWSFAVOIAKHSBM-ZDUSSCGKSA-N 1 2 359.857 5.047 20 0 FKADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000550478969 568055977 /nfs/dbraw/zinc/05/59/77/568055977.db2.gz OAKCLSVLSDKXIO-QRWLVFNGSA-N 1 2 368.864 5.130 20 0 FKADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000550478969 568055976 /nfs/dbraw/zinc/05/59/76/568055976.db2.gz OAKCLSVLSDKXIO-QRWLVFNGSA-N 1 2 368.864 5.130 20 0 FKADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000550478970 568055986 /nfs/dbraw/zinc/05/59/86/568055986.db2.gz OAKCLSVLSDKXIO-YWZLYKJASA-N 1 2 368.864 5.130 20 0 FKADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000550478970 568055985 /nfs/dbraw/zinc/05/59/85/568055985.db2.gz OAKCLSVLSDKXIO-YWZLYKJASA-N 1 2 368.864 5.130 20 0 FKADLO Fc1ccc([C@H]([NH2+]Cc2ccsc2)c2ccc(Br)o2)cc1 ZINC000550622279 568083650 /nfs/dbraw/zinc/08/36/50/568083650.db2.gz KSJPXEQCGYVKNY-INIZCTEOSA-N 1 2 366.255 5.122 20 0 FKADLO Fc1ccc([C@@H]([NH2+]Cc2ccsc2)c2ccc(Br)o2)cc1 ZINC000550622280 568083611 /nfs/dbraw/zinc/08/36/11/568083611.db2.gz KSJPXEQCGYVKNY-MRXNPFEDSA-N 1 2 366.255 5.122 20 0 FKADLO CCc1cccc(C)c1NC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000550720986 568101406 /nfs/dbraw/zinc/10/14/06/568101406.db2.gz QYYBOQCVOKDHNK-UHFFFAOYSA-N 1 2 372.472 5.117 20 0 FKADLO CC(C)(C)C1=CCN(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000550812332 568107139 /nfs/dbraw/zinc/10/71/39/568107139.db2.gz GICQTRWBTIAJMW-UHFFFAOYSA-N 1 2 351.450 5.084 20 0 FKADLO CC(F)(F)c1ccc(C[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000550857781 568115528 /nfs/dbraw/zinc/11/55/28/568115528.db2.gz YLQDYGGBSUROOL-FQEVSTJZSA-N 1 2 374.381 5.351 20 0 FKADLO CC(F)(F)c1ccc(C[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000550857782 568115499 /nfs/dbraw/zinc/11/54/99/568115499.db2.gz YLQDYGGBSUROOL-HXUWFJFHSA-N 1 2 374.381 5.351 20 0 FKADLO CCc1noc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccc1Cl ZINC000550858967 568115915 /nfs/dbraw/zinc/11/59/15/568115915.db2.gz NRSPOJOSXMKYRI-NRFANRHFSA-N 1 2 354.881 5.386 20 0 FKADLO CCc1noc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1ccccc1Cl ZINC000550858972 568115956 /nfs/dbraw/zinc/11/59/56/568115956.db2.gz NRSPOJOSXMKYRI-OAQYLSRUSA-N 1 2 354.881 5.386 20 0 FKADLO CC(C)Oc1cccc([C@H]([NH2+]CCc2csc(C(C)C)n2)C(F)F)c1 ZINC000550885611 568116942 /nfs/dbraw/zinc/11/69/42/568116942.db2.gz IHBRDXYSKGGXTC-KRWDZBQOSA-N 1 2 368.493 5.192 20 0 FKADLO CC(C)Oc1cccc([C@@H]([NH2+]CCc2csc(C(C)C)n2)C(F)F)c1 ZINC000550885612 568116835 /nfs/dbraw/zinc/11/68/35/568116835.db2.gz IHBRDXYSKGGXTC-QGZVFWFLSA-N 1 2 368.493 5.192 20 0 FKADLO CC(C)([NH2+]Cc1nc(-c2ccc(Cl)cc2)no1)c1ccc(Cl)cc1 ZINC000550977547 568121566 /nfs/dbraw/zinc/12/15/66/568121566.db2.gz GJVZILQUPVVZJP-UHFFFAOYSA-N 1 2 362.260 5.068 20 0 FKADLO FC(F)(F)Cn1cc[nH+]c1CNc1cccc(-c2cccc(Cl)c2)c1 ZINC000550983066 568126164 /nfs/dbraw/zinc/12/61/64/568126164.db2.gz JYQYAJOVKNHLPD-UHFFFAOYSA-N 1 2 365.786 5.378 20 0 FKADLO CCC[N@@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1Br ZINC000551028131 568133699 /nfs/dbraw/zinc/13/36/99/568133699.db2.gz SCXPZKWYHNCNOO-CYBMUJFWSA-N 1 2 363.299 5.288 20 0 FKADLO CCC[N@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1Br ZINC000551028131 568133698 /nfs/dbraw/zinc/13/36/98/568133698.db2.gz SCXPZKWYHNCNOO-CYBMUJFWSA-N 1 2 363.299 5.288 20 0 FKADLO CCC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1Br ZINC000551028133 568133655 /nfs/dbraw/zinc/13/36/55/568133655.db2.gz SCXPZKWYHNCNOO-ZDUSSCGKSA-N 1 2 363.299 5.288 20 0 FKADLO CCC[N@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1Br ZINC000551028133 568133654 /nfs/dbraw/zinc/13/36/54/568133654.db2.gz SCXPZKWYHNCNOO-ZDUSSCGKSA-N 1 2 363.299 5.288 20 0 FKADLO Cc1ccc2snc(C(=O)Nc3cccc(Oc4cc[nH+]cc4)c3)c2c1 ZINC000551035180 568134388 /nfs/dbraw/zinc/13/43/88/568134388.db2.gz KBCNKWQBVGMMOM-UHFFFAOYSA-N 1 2 361.426 5.044 20 0 FKADLO CCc1nc(C(C)C)ccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000551035357 568134384 /nfs/dbraw/zinc/13/43/84/568134384.db2.gz XGWDFEUWZITWTH-UHFFFAOYSA-N 1 2 361.445 5.207 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccc(F)c2ccccc21 ZINC000551063578 568139062 /nfs/dbraw/zinc/13/90/62/568139062.db2.gz VXJAVKBPHGCPAV-CABCVRRESA-N 1 2 361.420 5.441 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063579 568139027 /nfs/dbraw/zinc/13/90/27/568139027.db2.gz VXJAVKBPHGCPAV-GJZGRUSLSA-N 1 2 361.420 5.441 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063580 568139016 /nfs/dbraw/zinc/13/90/16/568139016.db2.gz VXJAVKBPHGCPAV-HUUCEWRRSA-N 1 2 361.420 5.441 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000551063581 568139101 /nfs/dbraw/zinc/13/91/01/568139101.db2.gz VXJAVKBPHGCPAV-LSDHHAIUSA-N 1 2 361.420 5.441 20 0 FKADLO c1c2ccccc2oc1Cc1noc(-c2ccccc2Oc2cc[nH+]cc2)n1 ZINC000551182695 568160832 /nfs/dbraw/zinc/16/08/32/568160832.db2.gz IYJANFUJTRILNV-UHFFFAOYSA-N 1 2 369.380 5.261 20 0 FKADLO Cc1ccc2nc(C[NH2+][C@H](c3ccsc3)c3ccc(Cl)cc3)cn2c1 ZINC000551184890 568157715 /nfs/dbraw/zinc/15/77/15/568157715.db2.gz JHMANJTXUYBZFT-FQEVSTJZSA-N 1 2 367.905 5.237 20 0 FKADLO Cc1ccc2nc(C[NH2+][C@@H](c3ccsc3)c3ccc(Cl)cc3)cn2c1 ZINC000551184891 568157704 /nfs/dbraw/zinc/15/77/04/568157704.db2.gz JHMANJTXUYBZFT-HXUWFJFHSA-N 1 2 367.905 5.237 20 0 FKADLO Cc1nc(C2([NH2+]Cc3ccc(-c4ccc(Cl)cc4)cc3)CCCC2)no1 ZINC000551185061 568157729 /nfs/dbraw/zinc/15/77/29/568157729.db2.gz MYRDUWCIPDWFCR-UHFFFAOYSA-N 1 2 367.880 5.258 20 0 FKADLO CCc1nc([C@@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cs1 ZINC000551185295 568157718 /nfs/dbraw/zinc/15/77/18/568157718.db2.gz QVYDSEJFUPUOIY-LLVKDONJSA-N 1 2 363.939 5.333 20 0 FKADLO CCc1nc([C@H](C)[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)cs1 ZINC000551185296 568157761 /nfs/dbraw/zinc/15/77/61/568157761.db2.gz QVYDSEJFUPUOIY-NSHDSACASA-N 1 2 363.939 5.333 20 0 FKADLO COc1ccncc1C[NH2+][C@@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000551227005 568179153 /nfs/dbraw/zinc/17/91/53/568179153.db2.gz LCTASCFUOCPXQY-NRFANRHFSA-N 1 2 370.855 5.070 20 0 FKADLO COc1ccncc1C[NH2+][C@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000551227013 568179135 /nfs/dbraw/zinc/17/91/35/568179135.db2.gz LCTASCFUOCPXQY-OAQYLSRUSA-N 1 2 370.855 5.070 20 0 FKADLO COc1ccncc1C[NH2+][C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000551229682 568179436 /nfs/dbraw/zinc/17/94/36/568179436.db2.gz ZNNZQUKEBHHQEF-FQEVSTJZSA-N 1 2 373.283 5.276 20 0 FKADLO COc1ccncc1C[NH2+][C@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000551229683 568179407 /nfs/dbraw/zinc/17/94/07/568179407.db2.gz ZNNZQUKEBHHQEF-HXUWFJFHSA-N 1 2 373.283 5.276 20 0 FKADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)cs1 ZINC000551232054 568179514 /nfs/dbraw/zinc/17/95/14/568179514.db2.gz XAYSIQICDFOCAB-AWEZNQCLSA-N 1 2 372.921 5.461 20 0 FKADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)cs1 ZINC000551232059 568179557 /nfs/dbraw/zinc/17/95/57/568179557.db2.gz XAYSIQICDFOCAB-CQSZACIVSA-N 1 2 372.921 5.461 20 0 FKADLO Cn1ccnc1[C@@H]([NH2+]Cc1cc2ccccc2s1)c1ccccc1Cl ZINC000551241187 568181428 /nfs/dbraw/zinc/18/14/28/568181428.db2.gz SBRMEUFUGRJTSX-IBGZPJMESA-N 1 2 367.905 5.167 20 0 FKADLO Cn1ccnc1[C@H]([NH2+]Cc1cc2ccccc2s1)c1ccccc1Cl ZINC000551241197 568181409 /nfs/dbraw/zinc/18/14/09/568181409.db2.gz SBRMEUFUGRJTSX-LJQANCHMSA-N 1 2 367.905 5.167 20 0 FKADLO CC(C)c1nnc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)s1 ZINC000551244421 568186956 /nfs/dbraw/zinc/18/69/56/568186956.db2.gz CMVXAPWLEIUQNA-UHFFFAOYSA-N 1 2 357.910 5.272 20 0 FKADLO CC[C@H](C)c1ccc([C@@H]([NH2+][C@H](C)c2cc(C)on2)c2cccs2)cc1 ZINC000551267785 568189183 /nfs/dbraw/zinc/18/91/83/568189183.db2.gz JCRANQIYZXVKPT-CMPZQBNXSA-N 1 2 354.519 5.998 20 0 FKADLO CC[C@H](C)c1ccc([C@H]([NH2+][C@@H](C)c2cc(C)on2)c2cccs2)cc1 ZINC000551267786 568189148 /nfs/dbraw/zinc/18/91/48/568189148.db2.gz JCRANQIYZXVKPT-HTZUNMPGSA-N 1 2 354.519 5.998 20 0 FKADLO CC[C@H](C)c1ccc([C@H]([NH2+][C@H](C)c2cc(C)on2)c2cccs2)cc1 ZINC000551267787 568189162 /nfs/dbraw/zinc/18/91/62/568189162.db2.gz JCRANQIYZXVKPT-PXARDIRTSA-N 1 2 354.519 5.998 20 0 FKADLO CC[C@H](C)c1ccc([C@@H]([NH2+][C@@H](C)c2cc(C)on2)c2cccs2)cc1 ZINC000551267788 568189134 /nfs/dbraw/zinc/18/91/34/568189134.db2.gz JCRANQIYZXVKPT-WDUKFBBWSA-N 1 2 354.519 5.998 20 0 FKADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccc(F)cc2Cl)cc1 ZINC000551267942 568189122 /nfs/dbraw/zinc/18/91/22/568189122.db2.gz YDGFFZGOUWYDST-LHSJRXKWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccc(F)cc2Cl)cc1 ZINC000551267943 568189131 /nfs/dbraw/zinc/18/91/31/568189131.db2.gz YDGFFZGOUWYDST-QKKBWIMNSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccc(F)cc2Cl)cc1 ZINC000551267944 568189188 /nfs/dbraw/zinc/18/91/88/568189188.db2.gz YDGFFZGOUWYDST-SPLOXXLWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccc(F)cc2Cl)cc1 ZINC000551267945 568189167 /nfs/dbraw/zinc/18/91/67/568189167.db2.gz YDGFFZGOUWYDST-SZNDQCEHSA-N 1 2 372.846 5.762 20 0 FKADLO Oc1ccc2c(c1)[C@H](Nc1cccc(-c3[nH+]cc4n3CCCC4)c1)CCC2 ZINC000551277573 568195701 /nfs/dbraw/zinc/19/57/01/568195701.db2.gz GQMVPPUSPXDADI-JOCHJYFZSA-N 1 2 359.473 5.082 20 0 FKADLO Oc1ccc2c(c1)[C@@H](Nc1cccc(-c3[nH+]cc4n3CCCC4)c1)CCC2 ZINC000551277578 568195689 /nfs/dbraw/zinc/19/56/89/568195689.db2.gz GQMVPPUSPXDADI-QFIPXVFZSA-N 1 2 359.473 5.082 20 0 FKADLO CC(C)Oc1cccc([C@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C(F)F)c1 ZINC000551279696 568196002 /nfs/dbraw/zinc/19/60/02/568196002.db2.gz ILAMAYMPCPJATH-PPSBMQLTSA-N 1 2 369.496 5.353 20 0 FKADLO CC(C)Oc1cccc([C@@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C(F)F)c1 ZINC000551279700 568196051 /nfs/dbraw/zinc/19/60/51/568196051.db2.gz ILAMAYMPCPJATH-XUJQIHCRSA-N 1 2 369.496 5.353 20 0 FKADLO C[C@@H]([NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccncc1F ZINC000551280018 568196124 /nfs/dbraw/zinc/19/61/24/568196124.db2.gz LBEKEQADUYDZOG-PXAZEXFGSA-N 1 2 371.456 5.212 20 0 FKADLO C[C@H]([NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccncc1F ZINC000551280019 568196148 /nfs/dbraw/zinc/19/61/48/568196148.db2.gz LBEKEQADUYDZOG-SJCJKPOMSA-N 1 2 371.456 5.212 20 0 FKADLO C[C@@H]([NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccncc1F ZINC000551280020 568196181 /nfs/dbraw/zinc/19/61/81/568196181.db2.gz LBEKEQADUYDZOG-SJKOYZFVSA-N 1 2 371.456 5.212 20 0 FKADLO C[C@H]([NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccncc1F ZINC000551280021 568196184 /nfs/dbraw/zinc/19/61/84/568196184.db2.gz LBEKEQADUYDZOG-YVEFUNNKSA-N 1 2 371.456 5.212 20 0 FKADLO Cc1cc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)ccc1F ZINC000551282775 568196343 /nfs/dbraw/zinc/19/63/43/568196343.db2.gz DGRNQEGXXVGWKY-LHSJRXKWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1cc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)ccc1F ZINC000551282776 568196307 /nfs/dbraw/zinc/19/63/07/568196307.db2.gz DGRNQEGXXVGWKY-QKKBWIMNSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1cc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)ccc1F ZINC000551282777 568196341 /nfs/dbraw/zinc/19/63/41/568196341.db2.gz DGRNQEGXXVGWKY-SPLOXXLWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1cc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)ccc1F ZINC000551282778 568196335 /nfs/dbraw/zinc/19/63/35/568196335.db2.gz DGRNQEGXXVGWKY-SZNDQCEHSA-N 1 2 372.846 5.762 20 0 FKADLO CSc1cccc([C@H]([NH2+][C@@H](C)c2cc(C)on2)c2ccc(F)c(F)c2)c1 ZINC000551283086 568196400 /nfs/dbraw/zinc/19/64/00/568196400.db2.gz HOTYOGIOXUFBHU-RBZFPXEDSA-N 1 2 374.456 5.423 20 0 FKADLO CSc1cccc([C@@H]([NH2+][C@@H](C)c2cc(C)on2)c2ccc(F)c(F)c2)c1 ZINC000551283087 568196357 /nfs/dbraw/zinc/19/63/57/568196357.db2.gz HOTYOGIOXUFBHU-RNODOKPDSA-N 1 2 374.456 5.423 20 0 FKADLO CSc1cccc([C@H]([NH2+][C@H](C)c2cc(C)on2)c2ccc(F)c(F)c2)c1 ZINC000551283088 568196409 /nfs/dbraw/zinc/19/64/09/568196409.db2.gz HOTYOGIOXUFBHU-XCLFUZPHSA-N 1 2 374.456 5.423 20 0 FKADLO CSc1cccc([C@@H]([NH2+][C@H](C)c2cc(C)on2)c2ccc(F)c(F)c2)c1 ZINC000551283089 568196353 /nfs/dbraw/zinc/19/63/53/568196353.db2.gz HOTYOGIOXUFBHU-ZUOKHONESA-N 1 2 374.456 5.423 20 0 FKADLO Oc1ccc2c(c1)[C@@H](Nc1ccc(-c3cn4c([nH+]3)CCCC4)cc1)CCC2 ZINC000551295736 568203052 /nfs/dbraw/zinc/20/30/52/568203052.db2.gz AJSGLZHDHDUXKX-NRFANRHFSA-N 1 2 359.473 5.082 20 0 FKADLO Oc1ccc2c(c1)[C@H](Nc1ccc(-c3cn4c([nH+]3)CCCC4)cc1)CCC2 ZINC000551295737 568203037 /nfs/dbraw/zinc/20/30/37/568203037.db2.gz AJSGLZHDHDUXKX-OAQYLSRUSA-N 1 2 359.473 5.082 20 0 FKADLO Oc1ccc2c(c1)[C@H](Nc1ccc(-c3[nH+]cc4n3CCCC4)cc1)CCC2 ZINC000551297292 568203210 /nfs/dbraw/zinc/20/32/10/568203210.db2.gz SBVFDPGFKJWIFH-JOCHJYFZSA-N 1 2 359.473 5.082 20 0 FKADLO Oc1ccc2c(c1)[C@@H](Nc1ccc(-c3[nH+]cc4n3CCCC4)cc1)CCC2 ZINC000551297293 568203165 /nfs/dbraw/zinc/20/31/65/568203165.db2.gz SBVFDPGFKJWIFH-QFIPXVFZSA-N 1 2 359.473 5.082 20 0 FKADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(Oc3cccc4ccccc43)c2)no1 ZINC000551306216 568203644 /nfs/dbraw/zinc/20/36/44/568203644.db2.gz HKSJBGWFAZKBEC-KRWDZBQOSA-N 1 2 358.441 5.779 20 0 FKADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(Oc3cccc4ccccc43)c2)no1 ZINC000551306217 568203591 /nfs/dbraw/zinc/20/35/91/568203591.db2.gz HKSJBGWFAZKBEC-QGZVFWFLSA-N 1 2 358.441 5.779 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@H](COc2c(C)cccc2C)c2ccccc2)no1 ZINC000551313425 568203882 /nfs/dbraw/zinc/20/38/82/568203882.db2.gz MDUXVKYBWDZJTG-GHTZIAJQSA-N 1 2 350.462 5.071 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@@H](COc2c(C)cccc2C)c2ccccc2)no1 ZINC000551313427 568203916 /nfs/dbraw/zinc/20/39/16/568203916.db2.gz MDUXVKYBWDZJTG-NQIIRXRSSA-N 1 2 350.462 5.071 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@@H](COc2c(C)cccc2C)c2ccccc2)no1 ZINC000551313428 568203890 /nfs/dbraw/zinc/20/38/90/568203890.db2.gz MDUXVKYBWDZJTG-RXVVDRJESA-N 1 2 350.462 5.071 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@H](COc2c(C)cccc2C)c2ccccc2)no1 ZINC000551313429 568203913 /nfs/dbraw/zinc/20/39/13/568203913.db2.gz MDUXVKYBWDZJTG-WIYYLYMNSA-N 1 2 350.462 5.071 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)no1 ZINC000551316797 568202131 /nfs/dbraw/zinc/20/21/31/568202131.db2.gz NGXNVXXMOLVVIJ-BFUOFWGJSA-N 1 2 361.272 5.730 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)no1 ZINC000551316798 568202729 /nfs/dbraw/zinc/20/27/29/568202729.db2.gz NGXNVXXMOLVVIJ-DJJJIMSYSA-N 1 2 361.272 5.730 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)no1 ZINC000551316799 568202954 /nfs/dbraw/zinc/20/29/54/568202954.db2.gz NGXNVXXMOLVVIJ-ORAYPTAESA-N 1 2 361.272 5.730 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)no1 ZINC000551316800 568203062 /nfs/dbraw/zinc/20/30/62/568203062.db2.gz NGXNVXXMOLVVIJ-YJYMSZOUSA-N 1 2 361.272 5.730 20 0 FKADLO Cc1ccc([C@H](C)[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)o1 ZINC000551319474 568210339 /nfs/dbraw/zinc/21/03/39/568210339.db2.gz PJSVTLHXDVLNTN-AWEZNQCLSA-N 1 2 370.493 5.889 20 0 FKADLO Cc1ccc([C@@H](C)[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)o1 ZINC000551319475 568210297 /nfs/dbraw/zinc/21/02/97/568210297.db2.gz PJSVTLHXDVLNTN-CQSZACIVSA-N 1 2 370.493 5.889 20 0 FKADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551374027 568224290 /nfs/dbraw/zinc/22/42/90/568224290.db2.gz ICDGDVSZLUDTHB-LLVKDONJSA-N 1 2 373.216 5.056 20 0 FKADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551374027 568224289 /nfs/dbraw/zinc/22/42/89/568224289.db2.gz ICDGDVSZLUDTHB-LLVKDONJSA-N 1 2 373.216 5.056 20 0 FKADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551374028 568224323 /nfs/dbraw/zinc/22/43/23/568224323.db2.gz ICDGDVSZLUDTHB-NSHDSACASA-N 1 2 373.216 5.056 20 0 FKADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551374028 568224322 /nfs/dbraw/zinc/22/43/22/568224322.db2.gz ICDGDVSZLUDTHB-NSHDSACASA-N 1 2 373.216 5.056 20 0 FKADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(C(F)(F)F)cn2)s1 ZINC000551382388 568224860 /nfs/dbraw/zinc/22/48/60/568224860.db2.gz XGVWRMKBQWOJLL-UHFFFAOYSA-N 1 2 366.408 5.266 20 0 FKADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(C(F)(F)F)cn2)s1 ZINC000551382388 568224859 /nfs/dbraw/zinc/22/48/59/568224859.db2.gz XGVWRMKBQWOJLL-UHFFFAOYSA-N 1 2 366.408 5.266 20 0 FKADLO FC(F)(F)c1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)nc1 ZINC000551396295 568228299 /nfs/dbraw/zinc/22/82/99/568228299.db2.gz ZEXNSARCLCUBDQ-UHFFFAOYSA-N 1 2 361.194 5.186 20 0 FKADLO FC(F)(F)CC1CC[NH+](Cc2ncc(-c3ccc(Cl)cc3)o2)CC1 ZINC000551401658 568225903 /nfs/dbraw/zinc/22/59/03/568225903.db2.gz MCUYKUWFBWHBMI-UHFFFAOYSA-N 1 2 358.791 5.159 20 0 FKADLO CC(C)c1ccc(-c2noc(C[NH+]3CCC(CC(F)(F)F)CC3)n2)cc1 ZINC000551401747 568225881 /nfs/dbraw/zinc/22/58/81/568225881.db2.gz OXMOJPUHWHMJKZ-UHFFFAOYSA-N 1 2 367.415 5.024 20 0 FKADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1 ZINC000551406433 568225971 /nfs/dbraw/zinc/22/59/71/568225971.db2.gz HLGJMOSOWNLMSC-JTQLQIEISA-N 1 2 366.305 5.214 20 0 FKADLO Cc1cnc([C@H](C)[N@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1 ZINC000551406433 568225970 /nfs/dbraw/zinc/22/59/70/568225970.db2.gz HLGJMOSOWNLMSC-JTQLQIEISA-N 1 2 366.305 5.214 20 0 FKADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1 ZINC000551406434 568225953 /nfs/dbraw/zinc/22/59/53/568225953.db2.gz HLGJMOSOWNLMSC-SNVBAGLBSA-N 1 2 366.305 5.214 20 0 FKADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1 ZINC000551406434 568225952 /nfs/dbraw/zinc/22/59/52/568225952.db2.gz HLGJMOSOWNLMSC-SNVBAGLBSA-N 1 2 366.305 5.214 20 0 FKADLO COCC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)c(Cl)c1 ZINC000551417648 568226429 /nfs/dbraw/zinc/22/64/29/568226429.db2.gz DWVWTIMZERUNPS-HNNXBMFYSA-N 1 2 371.308 5.146 20 0 FKADLO COCC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)c(Cl)c1 ZINC000551417649 568226400 /nfs/dbraw/zinc/22/64/00/568226400.db2.gz DWVWTIMZERUNPS-OAHLLOKOSA-N 1 2 371.308 5.146 20 0 FKADLO COc1ccc(-c2cnc(C[NH2+]C3(c4ccc(Cl)cc4)CCC3)o2)cc1 ZINC000551448283 568229902 /nfs/dbraw/zinc/22/99/02/568229902.db2.gz NPZMPBPZRKKHQQ-UHFFFAOYSA-N 1 2 368.864 5.173 20 0 FKADLO FC1(c2cccnc2)CC[NH+](Cc2nc(C3CCCCC3)cs2)CC1 ZINC000551463124 568230546 /nfs/dbraw/zinc/23/05/46/568230546.db2.gz AYCJJQQPEKBSGS-UHFFFAOYSA-N 1 2 359.514 5.047 20 0 FKADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)nc2ccccc12 ZINC000551529385 568231350 /nfs/dbraw/zinc/23/13/50/568231350.db2.gz FTQSZVJPVDGTLM-AWEZNQCLSA-N 1 2 369.896 5.230 20 0 FKADLO Cc1nc(C[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)nc2ccccc12 ZINC000551529386 568231346 /nfs/dbraw/zinc/23/13/46/568231346.db2.gz FTQSZVJPVDGTLM-CQSZACIVSA-N 1 2 369.896 5.230 20 0 FKADLO CC[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1Br ZINC000551530007 568231344 /nfs/dbraw/zinc/23/13/44/568231344.db2.gz LWOHPHWVBLGOGI-GOSISDBHSA-N 1 2 371.278 5.345 20 0 FKADLO CC[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1Br ZINC000551530008 568231338 /nfs/dbraw/zinc/23/13/38/568231338.db2.gz LWOHPHWVBLGOGI-SFHVURJKSA-N 1 2 371.278 5.345 20 0 FKADLO Clc1ccc(-c2ncc(C[NH2+]Cc3csc(C4CC4)n3)s2)cc1 ZINC000551535953 568231804 /nfs/dbraw/zinc/23/18/04/568231804.db2.gz FOICSFVOQKAUDL-UHFFFAOYSA-N 1 2 361.923 5.087 20 0 FKADLO C[N@@H+](Cc1nccn1C(F)F)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000551552643 568231911 /nfs/dbraw/zinc/23/19/11/568231911.db2.gz OUCRQTHVLCGDEC-UHFFFAOYSA-N 1 2 361.823 5.231 20 0 FKADLO C[N@H+](Cc1nccn1C(F)F)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000551552643 568231910 /nfs/dbraw/zinc/23/19/10/568231910.db2.gz OUCRQTHVLCGDEC-UHFFFAOYSA-N 1 2 361.823 5.231 20 0 FKADLO CCOc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)cc1Cl ZINC000551573588 568233088 /nfs/dbraw/zinc/23/30/88/568233088.db2.gz WLBQKPNSTJWCRH-NRFANRHFSA-N 1 2 370.855 5.152 20 0 FKADLO CCOc1ccc(C[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)cc1Cl ZINC000551573589 568233120 /nfs/dbraw/zinc/23/31/20/568233120.db2.gz WLBQKPNSTJWCRH-OAQYLSRUSA-N 1 2 370.855 5.152 20 0 FKADLO Cc1cc2[nH+]cn([C@H](C)c3nc(-c4ccncc4Cl)cs3)c2cc1C ZINC000551582443 568232457 /nfs/dbraw/zinc/23/24/57/568232457.db2.gz RYOXXUDCLXSWDO-CYBMUJFWSA-N 1 2 368.893 5.434 20 0 FKADLO Cc1cc2[nH+]cn([C@@H](C)c3nc(-c4ccncc4Cl)cs3)c2cc1C ZINC000551582444 568232440 /nfs/dbraw/zinc/23/24/40/568232440.db2.gz RYOXXUDCLXSWDO-ZDUSSCGKSA-N 1 2 368.893 5.434 20 0 FKADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)s1 ZINC000551593942 568236770 /nfs/dbraw/zinc/23/67/70/568236770.db2.gz QUPVSSVZXXVCKS-UHFFFAOYSA-N 1 2 371.937 5.446 20 0 FKADLO Cc1nc(C(C)C)oc1C(=O)Nc1ccc2[nH]c(C3CCCCC3)[nH+]c2c1 ZINC000551686600 568240667 /nfs/dbraw/zinc/24/06/67/568240667.db2.gz JKLYBJLDFIKENF-UHFFFAOYSA-N 1 2 366.465 5.283 20 0 FKADLO FC(F)(F)c1ccc(C[NH+](Cc2cccs2)Cc2cccs2)nc1 ZINC000551694371 568241247 /nfs/dbraw/zinc/24/12/47/568241247.db2.gz WHRQXXNGHMAFHS-UHFFFAOYSA-N 1 2 368.449 5.426 20 0 FKADLO Cc1cc(C(=O)Nc2ccc3[nH+]c(C)[nH]c3c2)c(C)n1C1CCCCC1 ZINC000551696449 568241260 /nfs/dbraw/zinc/24/12/60/568241260.db2.gz DBVGRMVZKUVXIH-UHFFFAOYSA-N 1 2 350.466 5.047 20 0 FKADLO Cc1cc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c(C)n1C1CCCCC1 ZINC000551696449 568241259 /nfs/dbraw/zinc/24/12/59/568241259.db2.gz DBVGRMVZKUVXIH-UHFFFAOYSA-N 1 2 350.466 5.047 20 0 FKADLO CC(C)(C)c1nc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000551705649 568242811 /nfs/dbraw/zinc/24/28/11/568242811.db2.gz HUHNNVHQMIDXHX-UHFFFAOYSA-N 1 2 354.441 5.238 20 0 FKADLO Fc1ccc(-c2nc(C[NH+]3CCC(CC(F)(F)F)CC3)cs2)cc1 ZINC000551708041 568243508 /nfs/dbraw/zinc/24/35/08/568243508.db2.gz FHGYYTHMMLSWNG-UHFFFAOYSA-N 1 2 358.404 5.114 20 0 FKADLO Fc1ccccc1-c1nc(C[NH+]2CCC(CC(F)(F)F)CC2)cs1 ZINC000551708446 568243566 /nfs/dbraw/zinc/24/35/66/568243566.db2.gz SHMRCFKTLXPITI-UHFFFAOYSA-N 1 2 358.404 5.114 20 0 FKADLO Cc1cnc(C[N@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1 ZINC000551710100 568244127 /nfs/dbraw/zinc/24/41/27/568244127.db2.gz OUGDKTNAFCWIBF-UHFFFAOYSA-N 1 2 368.346 5.121 20 0 FKADLO Cc1cnc(C[N@@H+](C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1 ZINC000551710100 568244126 /nfs/dbraw/zinc/24/41/26/568244126.db2.gz OUGDKTNAFCWIBF-UHFFFAOYSA-N 1 2 368.346 5.121 20 0 FKADLO FC(F)(F)CC1CC[NH+](Cc2coc(-c3cccc(Cl)c3)n2)CC1 ZINC000551711372 568244219 /nfs/dbraw/zinc/24/42/19/568244219.db2.gz VAZNWIZORMGETN-UHFFFAOYSA-N 1 2 358.791 5.159 20 0 FKADLO FC(F)(F)CC[N@@H+](Cc1ccccc1)Cc1ccc(C(F)(F)F)cn1 ZINC000551734501 568245539 /nfs/dbraw/zinc/24/55/39/568245539.db2.gz IBFQGSRFNUXBBO-UHFFFAOYSA-N 1 2 362.317 5.055 20 0 FKADLO FC(F)(F)CC[N@H+](Cc1ccccc1)Cc1ccc(C(F)(F)F)cn1 ZINC000551734501 568245538 /nfs/dbraw/zinc/24/55/38/568245538.db2.gz IBFQGSRFNUXBBO-UHFFFAOYSA-N 1 2 362.317 5.055 20 0 FKADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780524 568246394 /nfs/dbraw/zinc/24/63/94/568246394.db2.gz GBIFOWHWMNGKJP-BFHYXJOUSA-N 1 2 364.921 5.171 20 0 FKADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780525 568246404 /nfs/dbraw/zinc/24/64/04/568246404.db2.gz GBIFOWHWMNGKJP-IHRRRGAJSA-N 1 2 364.921 5.171 20 0 FKADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780526 568246380 /nfs/dbraw/zinc/24/63/80/568246380.db2.gz GBIFOWHWMNGKJP-MELADBBJSA-N 1 2 364.921 5.171 20 0 FKADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)[nH]1 ZINC000551780527 568246399 /nfs/dbraw/zinc/24/63/99/568246399.db2.gz GBIFOWHWMNGKJP-MJBXVCDLSA-N 1 2 364.921 5.171 20 0 FKADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000551795431 568249079 /nfs/dbraw/zinc/24/90/79/568249079.db2.gz OIZYPGJHMMKXMY-AVRDEDQJSA-N 1 2 363.505 5.039 20 0 FKADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000551795432 568249067 /nfs/dbraw/zinc/24/90/67/568249067.db2.gz OIZYPGJHMMKXMY-GCJKJVERSA-N 1 2 363.505 5.039 20 0 FKADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000551795433 568249058 /nfs/dbraw/zinc/24/90/58/568249058.db2.gz OIZYPGJHMMKXMY-PGRDOPGGSA-N 1 2 363.505 5.039 20 0 FKADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000551795434 568249064 /nfs/dbraw/zinc/24/90/64/568249064.db2.gz OIZYPGJHMMKXMY-XMSQKQJNSA-N 1 2 363.505 5.039 20 0 FKADLO CCc1cnc(C[N@@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551803758 568250716 /nfs/dbraw/zinc/25/07/16/568250716.db2.gz BYCJWWYFOHVPRJ-UHFFFAOYSA-N 1 2 363.939 5.114 20 0 FKADLO CCc1cnc(C[N@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)s1 ZINC000551803758 568250715 /nfs/dbraw/zinc/25/07/15/568250715.db2.gz BYCJWWYFOHVPRJ-UHFFFAOYSA-N 1 2 363.939 5.114 20 0 FKADLO CC(C)(C)c1ncc(C[NH+](Cc2cccs2)Cc2cccs2)cn1 ZINC000551805405 568250876 /nfs/dbraw/zinc/25/08/76/568250876.db2.gz SIBONRDNOZSENT-UHFFFAOYSA-N 1 2 357.548 5.100 20 0 FKADLO COCc1cnc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)s1 ZINC000551813127 568251020 /nfs/dbraw/zinc/25/10/20/568251020.db2.gz RLZDUSFZPQXHQG-AWEZNQCLSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1cnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)s1 ZINC000551813127 568251019 /nfs/dbraw/zinc/25/10/19/568251019.db2.gz RLZDUSFZPQXHQG-AWEZNQCLSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1cnc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)s1 ZINC000551813128 568251102 /nfs/dbraw/zinc/25/11/02/568251102.db2.gz RLZDUSFZPQXHQG-CQSZACIVSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1cnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)s1 ZINC000551813128 568251101 /nfs/dbraw/zinc/25/11/01/568251101.db2.gz RLZDUSFZPQXHQG-CQSZACIVSA-N 1 2 352.931 5.162 20 0 FKADLO CCOc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)cc1Cl ZINC000551813258 568251159 /nfs/dbraw/zinc/25/11/59/568251159.db2.gz KMWRSDMZMNKUFK-SECBINFHSA-N 1 2 364.820 5.065 20 0 FKADLO CCOc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)cc1Cl ZINC000551813263 568251137 /nfs/dbraw/zinc/25/11/37/568251137.db2.gz KMWRSDMZMNKUFK-VIFPVBQESA-N 1 2 364.820 5.065 20 0 FKADLO C[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1cc2cc(Cl)ccc2o1 ZINC000551818157 568251480 /nfs/dbraw/zinc/25/14/80/568251480.db2.gz UUUZYRJVFIWMHP-HNNXBMFYSA-N 1 2 365.864 5.182 20 0 FKADLO C[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1cc2cc(Cl)ccc2o1 ZINC000551818161 568251456 /nfs/dbraw/zinc/25/14/56/568251456.db2.gz UUUZYRJVFIWMHP-OAHLLOKOSA-N 1 2 365.864 5.182 20 0 FKADLO CC(C)(C)c1ncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)cn1 ZINC000551822764 568251561 /nfs/dbraw/zinc/25/15/61/568251561.db2.gz JZEGDPWVTLKRBN-UHFFFAOYSA-N 1 2 364.320 5.250 20 0 FKADLO C[C@@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)c1cscn1 ZINC000551999960 568253805 /nfs/dbraw/zinc/25/38/05/568253805.db2.gz WLNXOHMFGCRWQO-LLVKDONJSA-N 1 2 363.280 5.016 20 0 FKADLO C[C@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)c1cscn1 ZINC000551999961 568253774 /nfs/dbraw/zinc/25/37/74/568253774.db2.gz WLNXOHMFGCRWQO-NSHDSACASA-N 1 2 363.280 5.016 20 0 FKADLO CSCc1cnc(C[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)s1 ZINC000552032685 568256641 /nfs/dbraw/zinc/25/66/41/568256641.db2.gz CTFWITOUWHPKCW-GOSISDBHSA-N 1 2 368.518 5.068 20 0 FKADLO CSCc1cnc(C[NH+]2CCC([C@H](F)c3ccccc3F)CC2)s1 ZINC000552032686 568256686 /nfs/dbraw/zinc/25/66/86/568256686.db2.gz CTFWITOUWHPKCW-SFHVURJKSA-N 1 2 368.518 5.068 20 0 FKADLO CC(C)OCCOCc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552065642 568255248 /nfs/dbraw/zinc/25/52/48/568255248.db2.gz IOAAXGOYIYDGDU-NRFANRHFSA-N 1 2 371.525 5.085 20 0 FKADLO CC(C)OCCOCc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552065643 568255278 /nfs/dbraw/zinc/25/52/78/568255278.db2.gz IOAAXGOYIYDGDU-OAQYLSRUSA-N 1 2 371.525 5.085 20 0 FKADLO c1c[nH+]c([C@@H](Nc2ccc(-c3cnc(C4CC4)o3)cc2)C2CCCCC2)[nH]1 ZINC000552066956 568255313 /nfs/dbraw/zinc/25/53/13/568255313.db2.gz VZTGVXABRGSXJN-FQEVSTJZSA-N 1 2 362.477 5.676 20 0 FKADLO c1c[nH+]c([C@H](Nc2ccc(-c3cnc(C4CC4)o3)cc2)C2CCCCC2)[nH]1 ZINC000552066957 568255354 /nfs/dbraw/zinc/25/53/54/568255354.db2.gz VZTGVXABRGSXJN-HXUWFJFHSA-N 1 2 362.477 5.676 20 0 FKADLO COC(=O)c1csc([C@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000552070260 568255346 /nfs/dbraw/zinc/25/53/46/568255346.db2.gz GFIXZMYKBGRHAR-JTQLQIEISA-N 1 2 370.301 5.181 20 0 FKADLO COC(=O)c1csc([C@@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000552070261 568255304 /nfs/dbraw/zinc/25/53/04/568255304.db2.gz GFIXZMYKBGRHAR-SNVBAGLBSA-N 1 2 370.301 5.181 20 0 FKADLO CC(=O)N(c1nc(C[N@H+]2CC(C)(C)[C@@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072013 568255333 /nfs/dbraw/zinc/25/53/33/568255333.db2.gz OUFJPVIHGJMNCP-IBGZPJMESA-N 1 2 371.550 5.003 20 0 FKADLO CC(=O)N(c1nc(C[N@@H+]2CC(C)(C)[C@@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072013 568255332 /nfs/dbraw/zinc/25/53/32/568255332.db2.gz OUFJPVIHGJMNCP-IBGZPJMESA-N 1 2 371.550 5.003 20 0 FKADLO CC(=O)N(c1nc(C[N@H+]2CC(C)(C)[C@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072014 568255339 /nfs/dbraw/zinc/25/53/39/568255339.db2.gz OUFJPVIHGJMNCP-LJQANCHMSA-N 1 2 371.550 5.003 20 0 FKADLO CC(=O)N(c1nc(C[N@@H+]2CC(C)(C)[C@H]2C(C)C)cs1)c1ccc(C)cc1 ZINC000552072014 568255338 /nfs/dbraw/zinc/25/53/38/568255338.db2.gz OUFJPVIHGJMNCP-LJQANCHMSA-N 1 2 371.550 5.003 20 0 FKADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2c(C)cc(Cl)cc2C)cs1 ZINC000552077540 568255738 /nfs/dbraw/zinc/25/57/38/568255738.db2.gz OSZIFDDZRPAFAK-CQSZACIVSA-N 1 2 352.931 5.143 20 0 FKADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2c(C)cc(Cl)cc2C)cs1 ZINC000552077540 568255737 /nfs/dbraw/zinc/25/57/37/568255737.db2.gz OSZIFDDZRPAFAK-CQSZACIVSA-N 1 2 352.931 5.143 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc2c(ccc3ccccc23)o1 ZINC000552091920 568257801 /nfs/dbraw/zinc/25/78/01/568257801.db2.gz AWYJGUCHGHOCPI-OLZOCXBDSA-N 1 2 352.384 5.671 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1c(F)cncc1F ZINC000552091921 568257788 /nfs/dbraw/zinc/25/77/88/568257788.db2.gz AWYJGUCHGHOCPI-QWHCGFSZSA-N 1 2 352.384 5.671 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc2c(ccc3ccccc23)o1 ZINC000552091922 568257743 /nfs/dbraw/zinc/25/77/43/568257743.db2.gz AWYJGUCHGHOCPI-STQMWFEESA-N 1 2 352.384 5.671 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(Cl)c(Cl)c1Cl ZINC000552093434 568257753 /nfs/dbraw/zinc/25/77/53/568257753.db2.gz JGRITCFXCOIVHN-HTQZYQBOSA-N 1 2 365.638 5.732 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1Cl)c1c(F)cncc1F ZINC000552093435 568257784 /nfs/dbraw/zinc/25/77/84/568257784.db2.gz JGRITCFXCOIVHN-JGVFFNPUSA-N 1 2 365.638 5.732 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)c(Cl)c1Cl ZINC000552093436 568257776 /nfs/dbraw/zinc/25/77/76/568257776.db2.gz JGRITCFXCOIVHN-SFYZADRCSA-N 1 2 365.638 5.732 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)c(Cl)c1Cl ZINC000552093437 568257730 /nfs/dbraw/zinc/25/77/30/568257730.db2.gz JGRITCFXCOIVHN-YUMQZZPRSA-N 1 2 365.638 5.732 20 0 FKADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2nc(C(C)C)oc2C)c1 ZINC000552094854 568257872 /nfs/dbraw/zinc/25/78/72/568257872.db2.gz XIWOZFMAUPEWTK-UHFFFAOYSA-N 1 2 366.465 5.022 20 0 FKADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000552099354 568257909 /nfs/dbraw/zinc/25/79/09/568257909.db2.gz GNNLFJJKOVDSMB-LLVKDONJSA-N 1 2 374.428 5.025 20 0 FKADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000552099355 568257912 /nfs/dbraw/zinc/25/79/12/568257912.db2.gz GNNLFJJKOVDSMB-NSHDSACASA-N 1 2 374.428 5.025 20 0 FKADLO C[C@@H](c1ccccc1)N(C(=O)CCn1c2ccccc2[nH+]c1C1CC1)C1CC1 ZINC000552125055 568258840 /nfs/dbraw/zinc/25/88/40/568258840.db2.gz DQVZBTCEQJNICW-KRWDZBQOSA-N 1 2 373.500 5.056 20 0 FKADLO C[C@H](c1ccccc1)N(C(=O)CCn1c2ccccc2[nH+]c1C1CC1)C1CC1 ZINC000552125056 568258869 /nfs/dbraw/zinc/25/88/69/568258869.db2.gz DQVZBTCEQJNICW-QGZVFWFLSA-N 1 2 373.500 5.056 20 0 FKADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2cnc(-c3ccccn3)s2)c(F)c1 ZINC000552190303 568261832 /nfs/dbraw/zinc/26/18/32/568261832.db2.gz HVDLCKAPFZREHV-IBGZPJMESA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2cnc(-c3ccccn3)s2)c(F)c1 ZINC000552190303 568261831 /nfs/dbraw/zinc/26/18/31/568261831.db2.gz HVDLCKAPFZREHV-IBGZPJMESA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2cnc(-c3ccccn3)s2)c(F)c1 ZINC000552190304 568261826 /nfs/dbraw/zinc/26/18/26/568261826.db2.gz HVDLCKAPFZREHV-LJQANCHMSA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2cnc(-c3ccccn3)s2)c(F)c1 ZINC000552190304 568261825 /nfs/dbraw/zinc/26/18/25/568261825.db2.gz HVDLCKAPFZREHV-LJQANCHMSA-N 1 2 371.456 5.211 20 0 FKADLO Cc1cc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)ccc1Cl ZINC000552207866 568260674 /nfs/dbraw/zinc/26/06/74/568260674.db2.gz IYPGBKFOWQFTSD-UHFFFAOYSA-N 1 2 365.864 5.101 20 0 FKADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccc2c(c1)CCCC2 ZINC000552207916 568260699 /nfs/dbraw/zinc/26/06/99/568260699.db2.gz LGUUMBGFVABBHY-UHFFFAOYSA-N 1 2 371.484 5.018 20 0 FKADLO CCCc1ccc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)cc1 ZINC000552207966 568260672 /nfs/dbraw/zinc/26/06/72/568260672.db2.gz NIAUILLMSZKTRO-UHFFFAOYSA-N 1 2 359.473 5.091 20 0 FKADLO Cc1cc(Cl)ccc1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000552208063 568260648 /nfs/dbraw/zinc/26/06/48/568260648.db2.gz ORSZTMBXDCRCBT-UHFFFAOYSA-N 1 2 365.864 5.101 20 0 FKADLO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000552235278 568265583 /nfs/dbraw/zinc/26/55/83/568265583.db2.gz DYMFWBSMQYGUNR-HTAPYJJXSA-N 1 2 365.496 5.198 20 0 FKADLO CC(C)Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000552235279 568265588 /nfs/dbraw/zinc/26/55/88/568265588.db2.gz DYMFWBSMQYGUNR-JTSKRJEESA-N 1 2 365.496 5.198 20 0 FKADLO CC(C)Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000552235280 568265573 /nfs/dbraw/zinc/26/55/73/568265573.db2.gz DYMFWBSMQYGUNR-VGOFRKELSA-N 1 2 365.496 5.198 20 0 FKADLO c1cc(C2CCC2)ccc1C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000552242856 568263359 /nfs/dbraw/zinc/26/33/59/568263359.db2.gz GJPMJIBBBPQCMS-FQEVSTJZSA-N 1 2 351.494 5.332 20 0 FKADLO c1cc(C2CCC2)ccc1C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000552242856 568263358 /nfs/dbraw/zinc/26/33/58/568263358.db2.gz GJPMJIBBBPQCMS-FQEVSTJZSA-N 1 2 351.494 5.332 20 0 FKADLO c1cc(C2CCC2)ccc1C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000552242857 568263409 /nfs/dbraw/zinc/26/34/09/568263409.db2.gz GJPMJIBBBPQCMS-HXUWFJFHSA-N 1 2 351.494 5.332 20 0 FKADLO c1cc(C2CCC2)ccc1C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000552242857 568263408 /nfs/dbraw/zinc/26/34/08/568263408.db2.gz GJPMJIBBBPQCMS-HXUWFJFHSA-N 1 2 351.494 5.332 20 0 FKADLO CC[N@@H+](Cc1ncc(CSC)s1)Cc1cccc(-c2ccncc2)c1 ZINC000552243244 568263345 /nfs/dbraw/zinc/26/33/45/568263345.db2.gz TWHBMBSAQOQSJP-UHFFFAOYSA-N 1 2 369.559 5.090 20 0 FKADLO CC[N@H+](Cc1ncc(CSC)s1)Cc1cccc(-c2ccncc2)c1 ZINC000552243244 568263344 /nfs/dbraw/zinc/26/33/44/568263344.db2.gz TWHBMBSAQOQSJP-UHFFFAOYSA-N 1 2 369.559 5.090 20 0 FKADLO FC(F)(F)COc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552290394 568267609 /nfs/dbraw/zinc/26/76/09/568267609.db2.gz IKAHQFRFDXWXII-INIZCTEOSA-N 1 2 353.388 5.084 20 0 FKADLO FC(F)(F)COc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552290395 568267576 /nfs/dbraw/zinc/26/75/76/568267576.db2.gz IKAHQFRFDXWXII-MRXNPFEDSA-N 1 2 353.388 5.084 20 0 FKADLO Cc1cc2cc(C[NH2+][C@H](c3cccnc3)c3ccc(F)cc3F)ccc2[nH]1 ZINC000552298223 568268205 /nfs/dbraw/zinc/26/82/05/568268205.db2.gz WNXJDWRSGWNQRP-JOCHJYFZSA-N 1 2 363.411 5.029 20 0 FKADLO Cc1cc2cc(C[NH2+][C@@H](c3cccnc3)c3ccc(F)cc3F)ccc2[nH]1 ZINC000552298224 568268351 /nfs/dbraw/zinc/26/83/51/568268351.db2.gz WNXJDWRSGWNQRP-QFIPXVFZSA-N 1 2 363.411 5.029 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1OC(F)F)c1c(F)cncc1F ZINC000552328052 568274945 /nfs/dbraw/zinc/27/49/45/568274945.db2.gz LPAUMPJEXVKIKN-DTWKUNHWSA-N 1 2 362.754 5.026 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(Cl)ccc1OC(F)F ZINC000552328053 568274937 /nfs/dbraw/zinc/27/49/37/568274937.db2.gz LPAUMPJEXVKIKN-IUCAKERBSA-N 1 2 362.754 5.026 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(Cl)ccc1OC(F)F ZINC000552328054 568274949 /nfs/dbraw/zinc/27/49/49/568274949.db2.gz LPAUMPJEXVKIKN-RKDXNWHRSA-N 1 2 362.754 5.026 20 0 FKADLO COc1cc(F)c([C@@H](C)[NH2+]Cc2cc(Cl)sc2Cl)cc1OC ZINC000552384708 568276464 /nfs/dbraw/zinc/27/64/64/568276464.db2.gz MXVWGCNEPXJYOY-MRVPVSSYSA-N 1 2 364.269 5.062 20 0 FKADLO COc1cc(F)c([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)cc1OC ZINC000552384709 568276500 /nfs/dbraw/zinc/27/65/00/568276500.db2.gz MXVWGCNEPXJYOY-QMMMGPOBSA-N 1 2 364.269 5.062 20 0 FKADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1ccc(OCc2cccnc2)cc1 ZINC000552407751 568278943 /nfs/dbraw/zinc/27/89/43/568278943.db2.gz BRXIVLKQUPSTSD-MRXNPFEDSA-N 1 2 373.431 5.521 20 0 FKADLO Cc1cccc(C[NH+](Cc2ccc([C@H]3C[C@@H]3C)o2)Cc2cccc(C)n2)n1 ZINC000552487291 568295598 /nfs/dbraw/zinc/29/55/98/568295598.db2.gz IWVGKSLOCGBWJC-AOMKIAJQSA-N 1 2 361.489 5.012 20 0 FKADLO Cc1cccc(C[NH+](Cc2ccc([C@@H]3C[C@@H]3C)o2)Cc2cccc(C)n2)n1 ZINC000552487294 568295642 /nfs/dbraw/zinc/29/56/42/568295642.db2.gz IWVGKSLOCGBWJC-KSFYIVLOSA-N 1 2 361.489 5.012 20 0 FKADLO Cc1cccc(C[NH+](Cc2ccc([C@@H]3C[C@H]3C)o2)Cc2cccc(C)n2)n1 ZINC000552487296 568295759 /nfs/dbraw/zinc/29/57/59/568295759.db2.gz IWVGKSLOCGBWJC-OPAMFIHVSA-N 1 2 361.489 5.012 20 0 FKADLO Cc1cccc(C[NH+](Cc2ccc([C@H]3C[C@H]3C)o2)Cc2cccc(C)n2)n1 ZINC000552487297 568295769 /nfs/dbraw/zinc/29/57/69/568295769.db2.gz IWVGKSLOCGBWJC-ZHRRBRCNSA-N 1 2 361.489 5.012 20 0 FKADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2cnc(-c3ccncc3)s2)c(F)c1 ZINC000552497863 568290349 /nfs/dbraw/zinc/29/03/49/568290349.db2.gz WZMDSKQCBCITKA-IBGZPJMESA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2cnc(-c3ccncc3)s2)c(F)c1 ZINC000552497863 568290347 /nfs/dbraw/zinc/29/03/47/568290347.db2.gz WZMDSKQCBCITKA-IBGZPJMESA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2cnc(-c3ccncc3)s2)c(F)c1 ZINC000552497864 568290387 /nfs/dbraw/zinc/29/03/87/568290387.db2.gz WZMDSKQCBCITKA-LJQANCHMSA-N 1 2 371.456 5.211 20 0 FKADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2cnc(-c3ccncc3)s2)c(F)c1 ZINC000552497864 568290386 /nfs/dbraw/zinc/29/03/86/568290386.db2.gz WZMDSKQCBCITKA-LJQANCHMSA-N 1 2 371.456 5.211 20 0 FKADLO O=C(CC/C=C/c1ccccc1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000552529120 568270264 /nfs/dbraw/zinc/27/02/64/568270264.db2.gz AIUPEAUOTXCNSK-UUILKARUSA-N 1 2 371.484 5.319 20 0 FKADLO CC[C@H](C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000552536118 568270633 /nfs/dbraw/zinc/27/06/33/568270633.db2.gz PRANQUJPVKXCKP-IBGZPJMESA-N 1 2 359.473 5.019 20 0 FKADLO CC[C@@H](C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000552536119 568270750 /nfs/dbraw/zinc/27/07/50/568270750.db2.gz PRANQUJPVKXCKP-LJQANCHMSA-N 1 2 359.473 5.019 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2Cl)cc1 ZINC000552568365 568272534 /nfs/dbraw/zinc/27/25/34/568272534.db2.gz MOBBIJZCISNZEN-XCLFUZPHSA-N 1 2 372.921 5.554 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2Cl)cc1 ZINC000552568366 568272587 /nfs/dbraw/zinc/27/25/87/568272587.db2.gz MOBBIJZCISNZEN-ZUOKHONESA-N 1 2 372.921 5.554 20 0 FKADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000552569037 568272596 /nfs/dbraw/zinc/27/25/96/568272596.db2.gz BTORVMAAMKMUIL-AUUYWEPGSA-N 1 2 350.487 5.293 20 0 FKADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000552569038 568272551 /nfs/dbraw/zinc/27/25/51/568272551.db2.gz BTORVMAAMKMUIL-IFXJQAMLSA-N 1 2 350.487 5.293 20 0 FKADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000552569039 568272555 /nfs/dbraw/zinc/27/25/55/568272555.db2.gz BTORVMAAMKMUIL-KUHUBIRLSA-N 1 2 350.487 5.293 20 0 FKADLO Cc1nc([C@H](C)[NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000552569040 568272519 /nfs/dbraw/zinc/27/25/19/568272519.db2.gz BTORVMAAMKMUIL-LIRRHRJNSA-N 1 2 350.487 5.293 20 0 FKADLO Cc1c(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)cccc1-c1ncco1 ZINC000552575145 568273379 /nfs/dbraw/zinc/27/33/79/568273379.db2.gz ZEJIMKVZWGSMSP-UHFFFAOYSA-N 1 2 371.396 5.090 20 0 FKADLO CC(C)c1nnc(C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)s1 ZINC000552579230 568273574 /nfs/dbraw/zinc/27/35/74/568273574.db2.gz YGCSRMHXTFLJGP-CYBMUJFWSA-N 1 2 353.944 5.032 20 0 FKADLO CC(C)c1nnc(C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)s1 ZINC000552579231 568273587 /nfs/dbraw/zinc/27/35/87/568273587.db2.gz YGCSRMHXTFLJGP-ZDUSSCGKSA-N 1 2 353.944 5.032 20 0 FKADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2Cl)o1)c1nc(C(C)(C)C)cs1 ZINC000552641346 568281585 /nfs/dbraw/zinc/28/15/85/568281585.db2.gz QLQGEDYMRBGIMS-CYBMUJFWSA-N 1 2 374.937 6.205 20 0 FKADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2Cl)o1)c1nc(C(C)(C)C)cs1 ZINC000552641348 568281573 /nfs/dbraw/zinc/28/15/73/568281573.db2.gz QLQGEDYMRBGIMS-ZDUSSCGKSA-N 1 2 374.937 6.205 20 0 FKADLO Cc1c(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cccc1-c1ncco1 ZINC000552710455 568278760 /nfs/dbraw/zinc/27/87/60/568278760.db2.gz VFSKEUFUYJJHGE-UHFFFAOYSA-N 1 2 371.396 5.090 20 0 FKADLO CC(C)c1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3cccnc3)cs2)cc1 ZINC000552834359 568292556 /nfs/dbraw/zinc/29/25/56/568292556.db2.gz WAPYYNAIQIAWHJ-INIZCTEOSA-N 1 2 351.519 5.522 20 0 FKADLO CC(C)c1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3cccnc3)cs2)cc1 ZINC000552834359 568292554 /nfs/dbraw/zinc/29/25/54/568292554.db2.gz WAPYYNAIQIAWHJ-INIZCTEOSA-N 1 2 351.519 5.522 20 0 FKADLO CC(C)c1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3cccnc3)cs2)cc1 ZINC000552834360 568292477 /nfs/dbraw/zinc/29/24/77/568292477.db2.gz WAPYYNAIQIAWHJ-MRXNPFEDSA-N 1 2 351.519 5.522 20 0 FKADLO CC(C)c1ccc(-c2nc(C[N@H+](C)[C@H](C)c3cccnc3)cs2)cc1 ZINC000552834360 568292476 /nfs/dbraw/zinc/29/24/76/568292476.db2.gz WAPYYNAIQIAWHJ-MRXNPFEDSA-N 1 2 351.519 5.522 20 0 FKADLO Cc1cc(C)c(NC(=O)Cc2cccc(OCc3ccccc3C)c2)c(C)[nH+]1 ZINC000552847304 568293581 /nfs/dbraw/zinc/29/35/81/568293581.db2.gz SCUNQADXEUKQOM-UHFFFAOYSA-N 1 2 374.484 5.075 20 0 FKADLO C[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1OC(F)F ZINC000552864066 568296786 /nfs/dbraw/zinc/29/67/86/568296786.db2.gz RHYFWUXAYGNUMW-GFCCVEGCSA-N 1 2 352.450 5.253 20 0 FKADLO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1OC(F)F ZINC000552864067 568296754 /nfs/dbraw/zinc/29/67/54/568296754.db2.gz RHYFWUXAYGNUMW-LBPRGKRZSA-N 1 2 352.450 5.253 20 0 FKADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)cs1 ZINC000552883323 568299810 /nfs/dbraw/zinc/29/98/10/568299810.db2.gz XUFJHVBJBAZPJU-GFCCVEGCSA-N 1 2 360.429 5.373 20 0 FKADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)cs1 ZINC000552883324 568299815 /nfs/dbraw/zinc/29/98/15/568299815.db2.gz XUFJHVBJBAZPJU-LBPRGKRZSA-N 1 2 360.429 5.373 20 0 FKADLO Cc1nc([C@H](C)[NH2+][C@H](COc2ccccc2F)c2ccccc2)cs1 ZINC000552904318 568301182 /nfs/dbraw/zinc/30/11/82/568301182.db2.gz FYKGEJHZYMDSKI-KBXCAEBGSA-N 1 2 356.466 5.062 20 0 FKADLO Cc1nc([C@@H](C)[NH2+][C@@H](COc2ccccc2F)c2ccccc2)cs1 ZINC000552904319 568301201 /nfs/dbraw/zinc/30/12/01/568301201.db2.gz FYKGEJHZYMDSKI-KDOFPFPSSA-N 1 2 356.466 5.062 20 0 FKADLO Cc1nc([C@H](C)[NH2+][C@@H](COc2ccccc2F)c2ccccc2)cs1 ZINC000552904320 568301184 /nfs/dbraw/zinc/30/11/84/568301184.db2.gz FYKGEJHZYMDSKI-KSSFIOAISA-N 1 2 356.466 5.062 20 0 FKADLO Cc1nc([C@@H](C)[NH2+][C@H](COc2ccccc2F)c2ccccc2)cs1 ZINC000552904321 568301208 /nfs/dbraw/zinc/30/12/08/568301208.db2.gz FYKGEJHZYMDSKI-RDTXWAMCSA-N 1 2 356.466 5.062 20 0 FKADLO Cc1[nH]ncc1C[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000552911481 568298133 /nfs/dbraw/zinc/29/81/33/568298133.db2.gz BYLRHBPANSALLX-FQEVSTJZSA-N 1 2 373.472 5.010 20 0 FKADLO Cc1[nH]ncc1C[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000552911482 568298101 /nfs/dbraw/zinc/29/81/01/568298101.db2.gz BYLRHBPANSALLX-HXUWFJFHSA-N 1 2 373.472 5.010 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccc(C)cc2)cc1 ZINC000552918215 568298242 /nfs/dbraw/zinc/29/82/42/568298242.db2.gz CBKABWZEESIQDQ-BTYIYWSLSA-N 1 2 352.503 5.209 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2csc(C)n2)c2ccc(C)cc2)cc1 ZINC000552918216 568298267 /nfs/dbraw/zinc/29/82/67/568298267.db2.gz CBKABWZEESIQDQ-QVKFZJNVSA-N 1 2 352.503 5.209 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2csc(C)n2)c2ccc(C)cc2)cc1 ZINC000552918217 568298237 /nfs/dbraw/zinc/29/82/37/568298237.db2.gz CBKABWZEESIQDQ-VFNWGFHPSA-N 1 2 352.503 5.209 20 0 FKADLO COc1ccc([C@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccc(C)cc2)cc1 ZINC000552918218 568298254 /nfs/dbraw/zinc/29/82/54/568298254.db2.gz CBKABWZEESIQDQ-YCRPNKLZSA-N 1 2 352.503 5.209 20 0 FKADLO Cc1ccncc1[C@H](C)[NH2+][C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000552918928 568298219 /nfs/dbraw/zinc/29/82/19/568298219.db2.gz WIXYRZOQSIPIEK-LHSJRXKWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000552918932 568298214 /nfs/dbraw/zinc/29/82/14/568298214.db2.gz WIXYRZOQSIPIEK-QKKBWIMNSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000552918933 568298260 /nfs/dbraw/zinc/29/82/60/568298260.db2.gz WIXYRZOQSIPIEK-SPLOXXLWSA-N 1 2 372.846 5.762 20 0 FKADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000552918935 568298224 /nfs/dbraw/zinc/29/82/24/568298224.db2.gz WIXYRZOQSIPIEK-SZNDQCEHSA-N 1 2 372.846 5.762 20 0 FKADLO CCCOc1ccc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2OC)cc1 ZINC000552922417 568298252 /nfs/dbraw/zinc/29/82/52/568298252.db2.gz ZDODNNJETRCEFS-GAJHUEQPSA-N 1 2 365.473 5.517 20 0 FKADLO CCCOc1ccc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2OC)cc1 ZINC000552922418 568298240 /nfs/dbraw/zinc/29/82/40/568298240.db2.gz ZDODNNJETRCEFS-HXOBKFHXSA-N 1 2 365.473 5.517 20 0 FKADLO CCCOc1ccc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2OC)cc1 ZINC000552922419 568298305 /nfs/dbraw/zinc/29/83/05/568298305.db2.gz ZDODNNJETRCEFS-SBUREZEXSA-N 1 2 365.473 5.517 20 0 FKADLO CCCOc1ccc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2OC)cc1 ZINC000552922420 568298322 /nfs/dbraw/zinc/29/83/22/568298322.db2.gz ZDODNNJETRCEFS-UZUQRXQVSA-N 1 2 365.473 5.517 20 0 FKADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)nc2ccccc12 ZINC000552928161 568299344 /nfs/dbraw/zinc/29/93/44/568299344.db2.gz VCCLOEOLFPECMV-UHFFFAOYSA-N 1 2 358.272 5.024 20 0 FKADLO CCC[C@H]([NH2+]Cc1nc([C@@H](C)OCC)no1)c1ccc(Cl)c(Cl)c1 ZINC000552946916 568298313 /nfs/dbraw/zinc/29/83/13/568298313.db2.gz BGFAEICGOMTOJN-ABAIWWIYSA-N 1 2 372.296 5.105 20 0 FKADLO CCC[C@@H]([NH2+]Cc1nc([C@@H](C)OCC)no1)c1ccc(Cl)c(Cl)c1 ZINC000552946917 568298292 /nfs/dbraw/zinc/29/82/92/568298292.db2.gz BGFAEICGOMTOJN-IAQYHMDHSA-N 1 2 372.296 5.105 20 0 FKADLO CCC[C@H]([NH2+]Cc1nc([C@H](C)OCC)no1)c1ccc(Cl)c(Cl)c1 ZINC000552946918 568298298 /nfs/dbraw/zinc/29/82/98/568298298.db2.gz BGFAEICGOMTOJN-NHYWBVRUSA-N 1 2 372.296 5.105 20 0 FKADLO CCC[C@@H]([NH2+]Cc1nc([C@H](C)OCC)no1)c1ccc(Cl)c(Cl)c1 ZINC000552946919 568298375 /nfs/dbraw/zinc/29/83/75/568298375.db2.gz BGFAEICGOMTOJN-XHDPSFHLSA-N 1 2 372.296 5.105 20 0 FKADLO CC([NH2+]Cc1ncc(-c2cccc(F)c2)o1)(c1ccccc1)c1ccccc1 ZINC000552969089 568301480 /nfs/dbraw/zinc/30/14/80/568301480.db2.gz HEPPOENDUBRRQR-UHFFFAOYSA-N 1 2 372.443 5.534 20 0 FKADLO CC([NH2+]Cc1ncc(-c2ccccc2F)o1)(c1ccccc1)c1ccccc1 ZINC000552969106 568301477 /nfs/dbraw/zinc/30/14/77/568301477.db2.gz HPODZVMDNNYQDU-UHFFFAOYSA-N 1 2 372.443 5.534 20 0 FKADLO Fc1cccc(F)c1-c1nc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)co1 ZINC000553002744 568307373 /nfs/dbraw/zinc/30/73/73/568307373.db2.gz HJYWWTZAWXBCPD-UHFFFAOYSA-N 1 2 360.791 5.052 20 0 FKADLO COc1ccccc1[C@@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1ccco1 ZINC000553002922 568307430 /nfs/dbraw/zinc/30/74/30/568307430.db2.gz PWCRZELEOZCIEO-DENIHFKCSA-N 1 2 351.421 5.184 20 0 FKADLO COc1ccccc1[C@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1ccco1 ZINC000553002923 568307444 /nfs/dbraw/zinc/30/74/44/568307444.db2.gz PWCRZELEOZCIEO-KNQAVFIVSA-N 1 2 351.421 5.184 20 0 FKADLO COc1ccccc1[C@@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccco1 ZINC000553002924 568307427 /nfs/dbraw/zinc/30/74/27/568307427.db2.gz PWCRZELEOZCIEO-SIKLNZKXSA-N 1 2 351.421 5.184 20 0 FKADLO COc1ccccc1[C@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccco1 ZINC000553002925 568307435 /nfs/dbraw/zinc/30/74/35/568307435.db2.gz PWCRZELEOZCIEO-UGKGYDQZSA-N 1 2 351.421 5.184 20 0 FKADLO Clc1cccc2c(N[C@H](c3nccs3)c3ccccc3)cc[nH+]c12 ZINC000553033203 568310064 /nfs/dbraw/zinc/31/00/64/568310064.db2.gz UBXRCJMKISYNNM-KRWDZBQOSA-N 1 2 351.862 5.546 20 0 FKADLO Clc1cccc2c(N[C@@H](c3nccs3)c3ccccc3)cc[nH+]c12 ZINC000553033204 568310074 /nfs/dbraw/zinc/31/00/74/568310074.db2.gz UBXRCJMKISYNNM-QGZVFWFLSA-N 1 2 351.862 5.546 20 0 FKADLO Cc1[nH+]c2ccccc2n1C1CCN(C(=O)CCCCC(C)(C)C)CC1 ZINC000553204227 568319107 /nfs/dbraw/zinc/31/91/07/568319107.db2.gz IUKSGTPHCBFVKC-UHFFFAOYSA-N 1 2 355.526 5.115 20 0 FKADLO c1nc(C[NH2+][C@H](COc2ccccc2)c2ccccc2)oc1-c1ccccc1 ZINC000553294052 568323739 /nfs/dbraw/zinc/32/37/39/568323739.db2.gz VMZPKDUSGFIDJO-JOCHJYFZSA-N 1 2 370.452 5.252 20 0 FKADLO c1nc(C[NH2+][C@@H](COc2ccccc2)c2ccccc2)oc1-c1ccccc1 ZINC000553294053 568323763 /nfs/dbraw/zinc/32/37/63/568323763.db2.gz VMZPKDUSGFIDJO-QFIPXVFZSA-N 1 2 370.452 5.252 20 0 FKADLO CCS[C@H](C)c1noc(C[NH2+]C(C)(C)c2ccc(C(C)(C)C)cc2)n1 ZINC000553305032 568328371 /nfs/dbraw/zinc/32/83/71/568328371.db2.gz GGFVSVBCPFSTTH-CQSZACIVSA-N 1 2 361.555 5.206 20 0 FKADLO Clc1ccc(-c2cnc(C[NH2+]C3(c4ccc(Cl)cc4)CC3)o2)cc1 ZINC000553337938 568335548 /nfs/dbraw/zinc/33/55/48/568335548.db2.gz BQUUOZRPGRLFIH-UHFFFAOYSA-N 1 2 359.256 5.427 20 0 FKADLO CCOc1ccc(-c2nc(C[NH2+]C3(c4ccc(Cl)cc4)CC3)co2)cc1 ZINC000553338090 568335570 /nfs/dbraw/zinc/33/55/70/568335570.db2.gz QXRRPTDUJIJFMO-UHFFFAOYSA-N 1 2 368.864 5.173 20 0 FKADLO Clc1ccc(C2([NH2+]Cc3csc(-c4ccoc4)n3)CC2)cc1Cl ZINC000553356573 568342556 /nfs/dbraw/zinc/34/25/56/568342556.db2.gz WRFDNPRLTSIVMB-UHFFFAOYSA-N 1 2 365.285 5.489 20 0 FKADLO Fc1cccc(N2CCCC2)c1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000553379135 568342048 /nfs/dbraw/zinc/34/20/48/568342048.db2.gz IAAKNLVIKKZLNQ-UHFFFAOYSA-N 1 2 353.268 5.023 20 0 FKADLO O=C(C[C@H](c1[nH]cc[nH+]1)c1ccccc1)N1CCCCC[C@H]1c1ccccc1 ZINC000553497427 568394853 /nfs/dbraw/zinc/39/48/53/568394853.db2.gz PQZJSFZMMOCRKX-VXKWHMMOSA-N 1 2 373.500 5.076 20 0 FKADLO O=C(C[C@@H](c1[nH]cc[nH+]1)c1ccccc1)N1CCCCC[C@H]1c1ccccc1 ZINC000553497429 568394819 /nfs/dbraw/zinc/39/48/19/568394819.db2.gz PQZJSFZMMOCRKX-YADHBBJMSA-N 1 2 373.500 5.076 20 0 FKADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)c1coc2ccc(C(C)C)cc12 ZINC000553548956 568395556 /nfs/dbraw/zinc/39/55/56/568395556.db2.gz MCXRHRMNJGKMHC-IBGZPJMESA-N 1 2 365.477 5.140 20 0 FKADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)c1coc2ccc(C(C)C)cc12 ZINC000553548957 568395558 /nfs/dbraw/zinc/39/55/58/568395558.db2.gz MCXRHRMNJGKMHC-LJQANCHMSA-N 1 2 365.477 5.140 20 0 FKADLO Cc1cccc(F)c1NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000553634608 568396103 /nfs/dbraw/zinc/39/61/03/568396103.db2.gz BDNKLRMWINSSLW-UHFFFAOYSA-N 1 2 356.784 5.227 20 0 FKADLO c1nc(C2CCCCC2)sc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000553722610 568395971 /nfs/dbraw/zinc/39/59/71/568395971.db2.gz QUFWIAXRFGPBRP-UHFFFAOYSA-N 1 2 353.491 5.136 20 0 FKADLO COc1cc(C)c(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c(C)c1C ZINC000553731106 568399911 /nfs/dbraw/zinc/39/99/11/568399911.db2.gz LSDTVVZHLPIZRX-UHFFFAOYSA-N 1 2 362.429 5.060 20 0 FKADLO Clc1ccc(C2([NH2+]Cc3ncc(-c4cccs4)o3)CC2)cc1Cl ZINC000553806419 568400618 /nfs/dbraw/zinc/40/06/18/568400618.db2.gz SBZMTVKRMIOPQU-UHFFFAOYSA-N 1 2 365.285 5.489 20 0 FKADLO CC(C)Cc1noc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2cccs2)n1 ZINC000553864737 568401273 /nfs/dbraw/zinc/40/12/73/568401273.db2.gz NOEGXKCTDWWNKZ-INIZCTEOSA-N 1 2 355.507 5.093 20 0 FKADLO CC(C)Cc1noc(C[N@H+](Cc2ccccc2)[C@@H](C)c2cccs2)n1 ZINC000553864737 568401272 /nfs/dbraw/zinc/40/12/72/568401272.db2.gz NOEGXKCTDWWNKZ-INIZCTEOSA-N 1 2 355.507 5.093 20 0 FKADLO CC(C)Cc1noc(C[N@@H+](Cc2ccccc2)[C@H](C)c2cccs2)n1 ZINC000553864738 568401307 /nfs/dbraw/zinc/40/13/07/568401307.db2.gz NOEGXKCTDWWNKZ-MRXNPFEDSA-N 1 2 355.507 5.093 20 0 FKADLO CC(C)Cc1noc(C[N@H+](Cc2ccccc2)[C@H](C)c2cccs2)n1 ZINC000553864738 568401306 /nfs/dbraw/zinc/40/13/06/568401306.db2.gz NOEGXKCTDWWNKZ-MRXNPFEDSA-N 1 2 355.507 5.093 20 0 FKADLO CC[C@](C)([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1nc(C)cs1 ZINC000553889187 568401527 /nfs/dbraw/zinc/40/15/27/568401527.db2.gz PPLPIIAHJUSMNH-HNNXBMFYSA-N 1 2 364.383 5.164 20 0 FKADLO CC[C@@](C)([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1nc(C)cs1 ZINC000553889192 568401569 /nfs/dbraw/zinc/40/15/69/568401569.db2.gz PPLPIIAHJUSMNH-OAHLLOKOSA-N 1 2 364.383 5.164 20 0 FKADLO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000553928020 568401980 /nfs/dbraw/zinc/40/19/80/568401980.db2.gz OADJZCHLQUHISQ-IBGZPJMESA-N 1 2 353.510 5.362 20 0 FKADLO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000553928020 568401979 /nfs/dbraw/zinc/40/19/79/568401979.db2.gz OADJZCHLQUHISQ-IBGZPJMESA-N 1 2 353.510 5.362 20 0 FKADLO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000553928024 568402008 /nfs/dbraw/zinc/40/20/08/568402008.db2.gz OADJZCHLQUHISQ-LJQANCHMSA-N 1 2 353.510 5.362 20 0 FKADLO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000553928024 568402007 /nfs/dbraw/zinc/40/20/07/568402007.db2.gz OADJZCHLQUHISQ-LJQANCHMSA-N 1 2 353.510 5.362 20 0 FKADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553987409 568402533 /nfs/dbraw/zinc/40/25/33/568402533.db2.gz OIHOWVCZUJABNN-BLLLJJGKSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553987409 568402532 /nfs/dbraw/zinc/40/25/32/568402532.db2.gz OIHOWVCZUJABNN-BLLLJJGKSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553987413 568402480 /nfs/dbraw/zinc/40/24/80/568402480.db2.gz OIHOWVCZUJABNN-LRDDRELGSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553987413 568402479 /nfs/dbraw/zinc/40/24/79/568402479.db2.gz OIHOWVCZUJABNN-LRDDRELGSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553987414 568402487 /nfs/dbraw/zinc/40/24/87/568402487.db2.gz OIHOWVCZUJABNN-MLGOLLRUSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553987414 568402486 /nfs/dbraw/zinc/40/24/86/568402486.db2.gz OIHOWVCZUJABNN-MLGOLLRUSA-N 1 2 373.909 5.596 20 0 FKADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553987415 568402496 /nfs/dbraw/zinc/40/24/96/568402496.db2.gz OIHOWVCZUJABNN-WBMJQRKESA-N 1 2 373.909 5.596 20 0 FKADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553987415 568402495 /nfs/dbraw/zinc/40/24/95/568402495.db2.gz OIHOWVCZUJABNN-WBMJQRKESA-N 1 2 373.909 5.596 20 0 FKADLO Cc1ccccc1-c1noc([C@@H](C)[N@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000553988013 568402507 /nfs/dbraw/zinc/40/25/07/568402507.db2.gz VRSNKISFTYGMNN-PBHICJAKSA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@@H](C)[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000553988013 568402506 /nfs/dbraw/zinc/40/25/06/568402506.db2.gz VRSNKISFTYGMNN-PBHICJAKSA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@@H](C)[N@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000553988014 568402519 /nfs/dbraw/zinc/40/25/19/568402519.db2.gz VRSNKISFTYGMNN-RHSMWYFYSA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@@H](C)[N@@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000553988014 568402518 /nfs/dbraw/zinc/40/25/18/568402518.db2.gz VRSNKISFTYGMNN-RHSMWYFYSA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@H](C)[N@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000553988015 568402511 /nfs/dbraw/zinc/40/25/11/568402511.db2.gz VRSNKISFTYGMNN-WMLDXEAASA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@H](C)[N@@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000553988015 568402510 /nfs/dbraw/zinc/40/25/10/568402510.db2.gz VRSNKISFTYGMNN-WMLDXEAASA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@H](C)[N@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000553988016 568402515 /nfs/dbraw/zinc/40/25/15/568402515.db2.gz VRSNKISFTYGMNN-YOEHRIQHSA-N 1 2 353.491 5.251 20 0 FKADLO Cc1ccccc1-c1noc([C@H](C)[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000553988016 568402514 /nfs/dbraw/zinc/40/25/14/568402514.db2.gz VRSNKISFTYGMNN-YOEHRIQHSA-N 1 2 353.491 5.251 20 0 FKADLO CC1(C)C[N@@H+](Cc2nnc(-c3cccc(Cl)c3)o2)[C@H]1c1cccs1 ZINC000553992099 568402576 /nfs/dbraw/zinc/40/25/76/568402576.db2.gz WNLILKMMTSDWSX-INIZCTEOSA-N 1 2 359.882 5.035 20 0 FKADLO CC1(C)C[N@H+](Cc2nnc(-c3cccc(Cl)c3)o2)[C@H]1c1cccs1 ZINC000553992099 568402575 /nfs/dbraw/zinc/40/25/75/568402575.db2.gz WNLILKMMTSDWSX-INIZCTEOSA-N 1 2 359.882 5.035 20 0 FKADLO CC1(C)C[N@@H+](Cc2nnc(-c3cccc(Cl)c3)o2)[C@@H]1c1cccs1 ZINC000553992100 568402589 /nfs/dbraw/zinc/40/25/89/568402589.db2.gz WNLILKMMTSDWSX-MRXNPFEDSA-N 1 2 359.882 5.035 20 0 FKADLO CC1(C)C[N@H+](Cc2nnc(-c3cccc(Cl)c3)o2)[C@@H]1c1cccs1 ZINC000553992100 568402588 /nfs/dbraw/zinc/40/25/88/568402588.db2.gz WNLILKMMTSDWSX-MRXNPFEDSA-N 1 2 359.882 5.035 20 0 FKADLO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C)c1nc(-c2ccccc2)cs1 ZINC000554087434 568399297 /nfs/dbraw/zinc/39/92/97/568399297.db2.gz BTXQPYVRLTXBLN-JMERFSKESA-N 1 2 354.450 5.122 20 0 FKADLO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C)c1nc(-c2ccccc2)cs1 ZINC000554087435 568399251 /nfs/dbraw/zinc/39/92/51/568399251.db2.gz BTXQPYVRLTXBLN-QUJCMNEKSA-N 1 2 354.450 5.122 20 0 FKADLO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@H]1C)c1nc(-c2ccccc2)cs1 ZINC000554087436 568399299 /nfs/dbraw/zinc/39/92/99/568399299.db2.gz BTXQPYVRLTXBLN-WTOJCKNJSA-N 1 2 354.450 5.122 20 0 FKADLO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C)c1nc(-c2ccccc2)cs1 ZINC000554087437 568399245 /nfs/dbraw/zinc/39/92/45/568399245.db2.gz BTXQPYVRLTXBLN-XEKQOVJPSA-N 1 2 354.450 5.122 20 0 FKADLO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000554092601 568399350 /nfs/dbraw/zinc/39/93/50/568399350.db2.gz QMFVAXXHPCMMTO-GOSISDBHSA-N 1 2 367.317 5.456 20 0 FKADLO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000554092602 568399384 /nfs/dbraw/zinc/39/93/84/568399384.db2.gz QMFVAXXHPCMMTO-SFHVURJKSA-N 1 2 367.317 5.456 20 0 FKADLO Cc1ccc(C(=O)N2CCC[C@H](c3ccccc3)C2)cc1Oc1cc[nH+]cc1 ZINC000554154500 568399327 /nfs/dbraw/zinc/39/93/27/568399327.db2.gz WHEYBPDUBMLSGX-NRFANRHFSA-N 1 2 372.468 5.202 20 0 FKADLO Cc1ccc(C(=O)N2CCC[C@@H](c3ccccc3)C2)cc1Oc1cc[nH+]cc1 ZINC000554154505 568399352 /nfs/dbraw/zinc/39/93/52/568399352.db2.gz WHEYBPDUBMLSGX-OAQYLSRUSA-N 1 2 372.468 5.202 20 0 FKADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cccc(SCc3ccccc3)c2)n1 ZINC000554252735 568403918 /nfs/dbraw/zinc/40/39/18/568403918.db2.gz BWPJFISOIHSXCU-HXUWFJFHSA-N 1 2 365.502 5.007 20 0 FKADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cccc(SCc3ccccc3)c2)n1 ZINC000554252735 568403917 /nfs/dbraw/zinc/40/39/17/568403917.db2.gz BWPJFISOIHSXCU-HXUWFJFHSA-N 1 2 365.502 5.007 20 0 FKADLO Clc1ccc(/C=C/C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554276913 568404283 /nfs/dbraw/zinc/40/42/83/568404283.db2.gz KMXOKLWCWXMGBE-WRFKIARRSA-N 1 2 357.885 5.231 20 0 FKADLO Clc1ccc(/C=C/C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554276913 568404282 /nfs/dbraw/zinc/40/42/82/568404282.db2.gz KMXOKLWCWXMGBE-WRFKIARRSA-N 1 2 357.885 5.231 20 0 FKADLO Clc1ccc(/C=C\C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554276914 568404275 /nfs/dbraw/zinc/40/42/75/568404275.db2.gz KMXOKLWCWXMGBE-XDXAGZTOSA-N 1 2 357.885 5.231 20 0 FKADLO Clc1ccc(/C=C\C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000554276914 568404274 /nfs/dbraw/zinc/40/42/74/568404274.db2.gz KMXOKLWCWXMGBE-XDXAGZTOSA-N 1 2 357.885 5.231 20 0 FKADLO OCC[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccc(Cl)cc1 ZINC000554291809 568404371 /nfs/dbraw/zinc/40/43/71/568404371.db2.gz HZTXBKCPGKAYSQ-GOSISDBHSA-N 1 2 364.942 5.058 20 0 FKADLO OCC[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccc(Cl)cc1 ZINC000554291810 568404415 /nfs/dbraw/zinc/40/44/15/568404415.db2.gz HZTXBKCPGKAYSQ-SFHVURJKSA-N 1 2 364.942 5.058 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000554309056 568404452 /nfs/dbraw/zinc/40/44/52/568404452.db2.gz NPLVPSPGBRMHGG-INIZCTEOSA-N 1 2 359.420 5.023 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000554309056 568404451 /nfs/dbraw/zinc/40/44/51/568404451.db2.gz NPLVPSPGBRMHGG-INIZCTEOSA-N 1 2 359.420 5.023 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000554309057 568404430 /nfs/dbraw/zinc/40/44/30/568404430.db2.gz NPLVPSPGBRMHGG-MRXNPFEDSA-N 1 2 359.420 5.023 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000554309057 568404429 /nfs/dbraw/zinc/40/44/29/568404429.db2.gz NPLVPSPGBRMHGG-MRXNPFEDSA-N 1 2 359.420 5.023 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554309485 568404436 /nfs/dbraw/zinc/40/44/36/568404436.db2.gz RMJGWNHZVUERPT-OXQOHEQNSA-N 1 2 370.562 5.590 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554309485 568404435 /nfs/dbraw/zinc/40/44/35/568404435.db2.gz RMJGWNHZVUERPT-OXQOHEQNSA-N 1 2 370.562 5.590 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554309486 568404442 /nfs/dbraw/zinc/40/44/42/568404442.db2.gz RMJGWNHZVUERPT-UZLBHIALSA-N 1 2 370.562 5.590 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554309486 568404441 /nfs/dbraw/zinc/40/44/41/568404441.db2.gz RMJGWNHZVUERPT-UZLBHIALSA-N 1 2 370.562 5.590 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554309666 568404480 /nfs/dbraw/zinc/40/44/80/568404480.db2.gz ARKQYBLAOWJQIF-FQEVSTJZSA-N 1 2 356.535 5.202 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554309666 568404479 /nfs/dbraw/zinc/40/44/79/568404479.db2.gz ARKQYBLAOWJQIF-FQEVSTJZSA-N 1 2 356.535 5.202 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554309667 568404433 /nfs/dbraw/zinc/40/44/33/568404433.db2.gz ARKQYBLAOWJQIF-HXUWFJFHSA-N 1 2 356.535 5.202 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554309667 568404432 /nfs/dbraw/zinc/40/44/32/568404432.db2.gz ARKQYBLAOWJQIF-HXUWFJFHSA-N 1 2 356.535 5.202 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554310184 568404459 /nfs/dbraw/zinc/40/44/59/568404459.db2.gz CCBGSXLXCAXLIT-FOIQADDNSA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554310184 568404458 /nfs/dbraw/zinc/40/44/58/568404458.db2.gz CCBGSXLXCAXLIT-FOIQADDNSA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554310189 568404446 /nfs/dbraw/zinc/40/44/46/568404446.db2.gz CCBGSXLXCAXLIT-MGPUTAFESA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@H](C)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554310189 568404445 /nfs/dbraw/zinc/40/44/45/568404445.db2.gz CCBGSXLXCAXLIT-MGPUTAFESA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554310191 568404462 /nfs/dbraw/zinc/40/44/62/568404462.db2.gz CCBGSXLXCAXLIT-QRWLVFNGSA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554310191 568404461 /nfs/dbraw/zinc/40/44/61/568404461.db2.gz CCBGSXLXCAXLIT-QRWLVFNGSA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554310193 568404467 /nfs/dbraw/zinc/40/44/67/568404467.db2.gz CCBGSXLXCAXLIT-YWZLYKJASA-N 1 2 370.562 5.283 20 0 FKADLO CCc1cccc(CC)c1NC(=O)[C@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554310193 568404466 /nfs/dbraw/zinc/40/44/66/568404466.db2.gz CCBGSXLXCAXLIT-YWZLYKJASA-N 1 2 370.562 5.283 20 0 FKADLO COc1cc([C@H](C)[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)c(F)cn1 ZINC000554350021 568404908 /nfs/dbraw/zinc/40/49/08/568404908.db2.gz XLNGEODSVQCLKI-BDAKNGLRSA-N 1 2 361.219 5.087 20 0 FKADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)c(F)cn1 ZINC000554350022 568404872 /nfs/dbraw/zinc/40/48/72/568404872.db2.gz XLNGEODSVQCLKI-DTWKUNHWSA-N 1 2 361.219 5.087 20 0 FKADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)c(F)cn1 ZINC000554350023 568404869 /nfs/dbraw/zinc/40/48/69/568404869.db2.gz XLNGEODSVQCLKI-IUCAKERBSA-N 1 2 361.219 5.087 20 0 FKADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)c(F)cn1 ZINC000554350024 568404895 /nfs/dbraw/zinc/40/48/95/568404895.db2.gz XLNGEODSVQCLKI-RKDXNWHRSA-N 1 2 361.219 5.087 20 0 FKADLO C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000554369927 568405189 /nfs/dbraw/zinc/40/51/89/568405189.db2.gz FIRUUTVCGLGCTD-INIZCTEOSA-N 1 2 370.456 5.578 20 0 FKADLO C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000554369928 568405205 /nfs/dbraw/zinc/40/52/05/568405205.db2.gz FIRUUTVCGLGCTD-MRXNPFEDSA-N 1 2 370.456 5.578 20 0 FKADLO CCc1nc(C)c([C@H](C)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)s1 ZINC000554370071 568405207 /nfs/dbraw/zinc/40/52/07/568405207.db2.gz HMUWJYFUYRJJCD-AWEZNQCLSA-N 1 2 366.534 5.387 20 0 FKADLO CCc1nc(C)c([C@@H](C)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)s1 ZINC000554370072 568405201 /nfs/dbraw/zinc/40/52/01/568405201.db2.gz HMUWJYFUYRJJCD-CQSZACIVSA-N 1 2 366.534 5.387 20 0 FKADLO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@H](c1ncc[nH]1)C1CCCCC1 ZINC000554374353 568405292 /nfs/dbraw/zinc/40/52/92/568405292.db2.gz UQVHRGXWQSRPSO-INIZCTEOSA-N 1 2 373.369 5.118 20 0 FKADLO Fc1cc(C(F)(F)F)c(F)cc1C[NH2+][C@@H](c1ncc[nH]1)C1CCCCC1 ZINC000554374355 568405348 /nfs/dbraw/zinc/40/53/48/568405348.db2.gz UQVHRGXWQSRPSO-MRXNPFEDSA-N 1 2 373.369 5.118 20 0 FKADLO COC[C@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1ccccc1 ZINC000554377150 568405393 /nfs/dbraw/zinc/40/53/93/568405393.db2.gz JJURGSDATZABDM-KRWDZBQOSA-N 1 2 364.470 5.034 20 0 FKADLO COC[C@@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1ccccc1 ZINC000554377151 568405396 /nfs/dbraw/zinc/40/53/96/568405396.db2.gz JJURGSDATZABDM-QGZVFWFLSA-N 1 2 364.470 5.034 20 0 FKADLO C[C@@H](c1ccccc1)N(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000554447244 568407054 /nfs/dbraw/zinc/40/70/54/568407054.db2.gz VOYCOJLCEYTRSO-KRWDZBQOSA-N 1 2 373.456 5.631 20 0 FKADLO C[C@H](c1ccccc1)N(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000554447245 568407056 /nfs/dbraw/zinc/40/70/56/568407056.db2.gz VOYCOJLCEYTRSO-QGZVFWFLSA-N 1 2 373.456 5.631 20 0 FKADLO CSc1cccc([C@H]([NH2+]Cc2ncccc2F)c2ccc(F)c(F)c2)c1 ZINC000554484554 568405935 /nfs/dbraw/zinc/40/59/35/568405935.db2.gz MEMQBFGJWLXWLI-FQEVSTJZSA-N 1 2 374.431 5.100 20 0 FKADLO CSc1cccc([C@@H]([NH2+]Cc2ncccc2F)c2ccc(F)c(F)c2)c1 ZINC000554484555 568405925 /nfs/dbraw/zinc/40/59/25/568405925.db2.gz MEMQBFGJWLXWLI-HXUWFJFHSA-N 1 2 374.431 5.100 20 0 FKADLO CC(C)(NC(=O)c1cccc(Oc2cc[nH+]cc2)c1)c1ccc(Cl)cc1 ZINC000554489880 568406289 /nfs/dbraw/zinc/40/62/89/568406289.db2.gz WHXUGHMIIPPMJS-UHFFFAOYSA-N 1 2 366.848 5.192 20 0 FKADLO C[C@@H]1C[C@@]1([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccc(Cl)cc1 ZINC000554565980 568407778 /nfs/dbraw/zinc/40/77/78/568407778.db2.gz KEQUSZPVQOVSMW-BLVKFPJESA-N 1 2 374.271 5.068 20 0 FKADLO C[C@H]1C[C@@]1([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccc(Cl)cc1 ZINC000554565981 568407787 /nfs/dbraw/zinc/40/77/87/568407787.db2.gz KEQUSZPVQOVSMW-BUXKBTBVSA-N 1 2 374.271 5.068 20 0 FKADLO C[C@@H]1C[C@]1([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccc(Cl)cc1 ZINC000554565982 568407782 /nfs/dbraw/zinc/40/77/82/568407782.db2.gz KEQUSZPVQOVSMW-CWTRNNRKSA-N 1 2 374.271 5.068 20 0 FKADLO C[C@H]1C[C@]1([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccc(Cl)cc1 ZINC000554565983 568407791 /nfs/dbraw/zinc/40/77/91/568407791.db2.gz KEQUSZPVQOVSMW-HXPMCKFVSA-N 1 2 374.271 5.068 20 0 FKADLO CC(C)n1ccc(C[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)n1 ZINC000554587235 568408084 /nfs/dbraw/zinc/40/80/84/568408084.db2.gz MXXBJVVOCQEIQO-FQEVSTJZSA-N 1 2 357.860 5.136 20 0 FKADLO CC(C)n1ccc(C[NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)n1 ZINC000554587240 568408053 /nfs/dbraw/zinc/40/80/53/568408053.db2.gz MXXBJVVOCQEIQO-HXUWFJFHSA-N 1 2 357.860 5.136 20 0 FKADLO FC(F)c1ccnc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)n1 ZINC000554721294 568408954 /nfs/dbraw/zinc/40/89/54/568408954.db2.gz LXPBLSALHJHVFJ-UHFFFAOYSA-N 1 2 365.836 5.086 20 0 FKADLO Cc1cc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c(Cl)cc1F ZINC000554760416 568409570 /nfs/dbraw/zinc/40/95/70/568409570.db2.gz ZVWFMKXSVQXJJY-UHFFFAOYSA-N 1 2 356.784 5.227 20 0 FKADLO Clc1ccc(-c2nc(CNc3ccc(-n4cc[nH+]c4)cc3)cs2)cc1 ZINC000554775040 568409732 /nfs/dbraw/zinc/40/97/32/568409732.db2.gz SXGMETZLEHWQFM-UHFFFAOYSA-N 1 2 366.877 5.261 20 0 FKADLO CC(C)c1nc2cc(NC(=O)c3ccccc3Oc3cc[nH+]cc3)ccc2o1 ZINC000554784891 568409927 /nfs/dbraw/zinc/40/99/27/568409927.db2.gz IAGDRCOSRUUFQE-UHFFFAOYSA-N 1 2 373.412 5.391 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554853661 568410718 /nfs/dbraw/zinc/41/07/18/568410718.db2.gz GXNMMNZAEYGQQD-JLTOFOAXSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554853661 568410717 /nfs/dbraw/zinc/41/07/17/568410717.db2.gz GXNMMNZAEYGQQD-JLTOFOAXSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554853662 568410722 /nfs/dbraw/zinc/41/07/22/568410722.db2.gz GXNMMNZAEYGQQD-VBKZILBWSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554853662 568410721 /nfs/dbraw/zinc/41/07/21/568410721.db2.gz GXNMMNZAEYGQQD-VBKZILBWSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554853663 568410701 /nfs/dbraw/zinc/41/07/01/568410701.db2.gz GXNMMNZAEYGQQD-VLIAUNLRSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554853663 568410700 /nfs/dbraw/zinc/41/07/00/568410700.db2.gz GXNMMNZAEYGQQD-VLIAUNLRSA-N 1 2 371.843 5.022 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554853664 568410706 /nfs/dbraw/zinc/41/07/06/568410706.db2.gz GXNMMNZAEYGQQD-XOBRGWDASA-N 1 2 371.843 5.022 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554853664 568410705 /nfs/dbraw/zinc/41/07/05/568410705.db2.gz GXNMMNZAEYGQQD-XOBRGWDASA-N 1 2 371.843 5.022 20 0 FKADLO C[C@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1noc(Cc2ccccc2)n1 ZINC000554861232 568410757 /nfs/dbraw/zinc/41/07/57/568410757.db2.gz LLWPKXPDOOPUMD-JXFKEZNVSA-N 1 2 361.489 5.124 20 0 FKADLO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1noc(Cc2ccccc2)n1 ZINC000554861241 568410781 /nfs/dbraw/zinc/41/07/81/568410781.db2.gz LLWPKXPDOOPUMD-OXJNMPFZSA-N 1 2 361.489 5.124 20 0 FKADLO C[C@@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1noc(Cc2ccccc2)n1 ZINC000554861244 568410761 /nfs/dbraw/zinc/41/07/61/568410761.db2.gz LLWPKXPDOOPUMD-OXQOHEQNSA-N 1 2 361.489 5.124 20 0 FKADLO C[C@@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1noc(Cc2ccccc2)n1 ZINC000554861245 568410803 /nfs/dbraw/zinc/41/08/03/568410803.db2.gz LLWPKXPDOOPUMD-UZLBHIALSA-N 1 2 361.489 5.124 20 0 FKADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000554875620 568410847 /nfs/dbraw/zinc/41/08/47/568410847.db2.gz KCGGWIZZBVMQPJ-GOSISDBHSA-N 1 2 359.901 5.335 20 0 FKADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000554875620 568410846 /nfs/dbraw/zinc/41/08/46/568410846.db2.gz KCGGWIZZBVMQPJ-GOSISDBHSA-N 1 2 359.901 5.335 20 0 FKADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000554875621 568410868 /nfs/dbraw/zinc/41/08/68/568410868.db2.gz KCGGWIZZBVMQPJ-SFHVURJKSA-N 1 2 359.901 5.335 20 0 FKADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000554875621 568410867 /nfs/dbraw/zinc/41/08/67/568410867.db2.gz KCGGWIZZBVMQPJ-SFHVURJKSA-N 1 2 359.901 5.335 20 0 FKADLO Cc1ccc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)nc1 ZINC000554882704 568411099 /nfs/dbraw/zinc/41/10/99/568411099.db2.gz MXGJFIORVBUPBD-UHFFFAOYSA-N 1 2 372.299 5.294 20 0 FKADLO Cc1ccc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)nc1 ZINC000554882704 568411098 /nfs/dbraw/zinc/41/10/98/568411098.db2.gz MXGJFIORVBUPBD-UHFFFAOYSA-N 1 2 372.299 5.294 20 0 FKADLO Cc1cccc(C[NH2+][C@H](c2ccccc2)c2cc(Cl)ccc2Cl)n1 ZINC000554900421 568411330 /nfs/dbraw/zinc/41/13/30/568411330.db2.gz YMAZXKZLDGHSOI-HXUWFJFHSA-N 1 2 357.284 5.576 20 0 FKADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000554921416 568411418 /nfs/dbraw/zinc/41/14/18/568411418.db2.gz USTWECBSSYNVTI-KRWDZBQOSA-N 1 2 364.276 5.278 20 0 FKADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000554921417 568411412 /nfs/dbraw/zinc/41/14/12/568411412.db2.gz USTWECBSSYNVTI-QGZVFWFLSA-N 1 2 364.276 5.278 20 0 FKADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2cccc(-c3ccc(OC(C)C)cc3)c2)o1 ZINC000554934218 568411437 /nfs/dbraw/zinc/41/14/37/568411437.db2.gz DMALMLQNKYUQNP-INIZCTEOSA-N 1 2 365.477 5.025 20 0 FKADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2cccc(-c3ccc(OC(C)C)cc3)c2)o1 ZINC000554934218 568411436 /nfs/dbraw/zinc/41/14/36/568411436.db2.gz DMALMLQNKYUQNP-INIZCTEOSA-N 1 2 365.477 5.025 20 0 FKADLO Cc1nnc(C[N@H+](C)[C@H](C)c2cccc(-c3ccc(OC(C)C)cc3)c2)o1 ZINC000554934219 568411465 /nfs/dbraw/zinc/41/14/65/568411465.db2.gz DMALMLQNKYUQNP-MRXNPFEDSA-N 1 2 365.477 5.025 20 0 FKADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2cccc(-c3ccc(OC(C)C)cc3)c2)o1 ZINC000554934219 568411464 /nfs/dbraw/zinc/41/14/64/568411464.db2.gz DMALMLQNKYUQNP-MRXNPFEDSA-N 1 2 365.477 5.025 20 0 FKADLO CC(C)(C)c1cc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2F)no1 ZINC000554935493 568411462 /nfs/dbraw/zinc/41/14/62/568411462.db2.gz QDYHXCSNKLRAHU-HXUWFJFHSA-N 1 2 352.453 5.185 20 0 FKADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000554935920 568411497 /nfs/dbraw/zinc/41/14/97/568411497.db2.gz ZGQRBYHVGXSDLV-INIZCTEOSA-N 1 2 364.489 5.499 20 0 FKADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000554935922 568411442 /nfs/dbraw/zinc/41/14/42/568411442.db2.gz ZGQRBYHVGXSDLV-MRXNPFEDSA-N 1 2 364.489 5.499 20 0 FKADLO Cn1c(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)nc2ccccc21 ZINC000554945871 568407176 /nfs/dbraw/zinc/40/71/76/568407176.db2.gz LGZMKEJBGMIFLZ-LJQANCHMSA-N 1 2 360.288 5.121 20 0 FKADLO Cc1cccc(OCc2nnc(SCc3ccc(C(C)C)[nH+]c3C)o2)c1 ZINC000554981670 568407724 /nfs/dbraw/zinc/40/77/24/568407724.db2.gz MYZQIHLLCYEERF-UHFFFAOYSA-N 1 2 369.490 5.076 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)no1 ZINC000554991885 568408512 /nfs/dbraw/zinc/40/85/12/568408512.db2.gz YXWKTEZGETVGRC-NEPJUHHUSA-N 1 2 361.898 5.480 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)no1 ZINC000554991889 568408470 /nfs/dbraw/zinc/40/84/70/568408470.db2.gz YXWKTEZGETVGRC-NWDGAFQWSA-N 1 2 361.898 5.480 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)no1 ZINC000554991891 568408494 /nfs/dbraw/zinc/40/84/94/568408494.db2.gz YXWKTEZGETVGRC-RYUDHWBXSA-N 1 2 361.898 5.480 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)no1 ZINC000554991892 568408462 /nfs/dbraw/zinc/40/84/62/568408462.db2.gz YXWKTEZGETVGRC-VXGBXAGGSA-N 1 2 361.898 5.480 20 0 FKADLO Cc1nc(C[NH2+]C(C)(C)c2ccc(C)nc2)oc1-c1ccc(Cl)cc1 ZINC000554997091 568409563 /nfs/dbraw/zinc/40/95/63/568409563.db2.gz OEUYAKBOHIZKSR-UHFFFAOYSA-N 1 2 355.869 5.032 20 0 FKADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1nccc2ccccc21 ZINC000554998007 568410042 /nfs/dbraw/zinc/41/00/42/568410042.db2.gz FQARZOGPHZOEFH-ZDUSSCGKSA-N 1 2 357.284 5.882 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(CCCc2ccccc2)o1 ZINC000555034477 568415364 /nfs/dbraw/zinc/41/53/64/568415364.db2.gz FXWUFRNMZLDHLV-UHFFFAOYSA-N 1 2 367.518 5.364 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2ccc(Cl)s2)o1 ZINC000555037874 568415547 /nfs/dbraw/zinc/41/55/47/568415547.db2.gz PUSCUNQNOKNLME-UHFFFAOYSA-N 1 2 365.911 5.571 20 0 FKADLO CCc1nnc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)o1 ZINC000555065398 568416576 /nfs/dbraw/zinc/41/65/76/568416576.db2.gz GGECJDBGQFQXHS-SFHVURJKSA-N 1 2 367.415 5.062 20 0 FKADLO O=C(N[C@H]1CCc2sc(Cl)cc21)c1ccccc1Oc1cc[nH+]cc1 ZINC000555110976 568417562 /nfs/dbraw/zinc/41/75/62/568417562.db2.gz BJMOFFXBKIKDES-HNNXBMFYSA-N 1 2 370.861 5.006 20 0 FKADLO O=C(N[C@@H]1CCc2sc(Cl)cc21)c1ccccc1Oc1cc[nH+]cc1 ZINC000555110977 568417488 /nfs/dbraw/zinc/41/74/88/568417488.db2.gz BJMOFFXBKIKDES-OAHLLOKOSA-N 1 2 370.861 5.006 20 0 FKADLO O=C(N[C@@H]1CCc2sc(Cl)cc21)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000555111620 568417543 /nfs/dbraw/zinc/41/75/43/568417543.db2.gz YEFNTKZMGQWLBJ-MRXNPFEDSA-N 1 2 370.861 5.006 20 0 FKADLO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164542 568418850 /nfs/dbraw/zinc/41/88/50/568418850.db2.gz SNROKBNZZUUFHD-HRAATJIYSA-N 1 2 353.897 5.131 20 0 FKADLO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164554 568418937 /nfs/dbraw/zinc/41/89/37/568418937.db2.gz SNROKBNZZUUFHD-IERDGZPVSA-N 1 2 353.897 5.131 20 0 FKADLO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164558 568418891 /nfs/dbraw/zinc/41/88/91/568418891.db2.gz SNROKBNZZUUFHD-IIBYNOLFSA-N 1 2 353.897 5.131 20 0 FKADLO Cc1ccc(C)c([C@H](C)[NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c1 ZINC000555164561 568418879 /nfs/dbraw/zinc/41/88/79/568418879.db2.gz SNROKBNZZUUFHD-KKSFZXQISA-N 1 2 353.897 5.131 20 0 FKADLO FC(F)(F)c1cnc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)s1 ZINC000555338953 568413071 /nfs/dbraw/zinc/41/30/71/568413071.db2.gz RDDAXKPPAKWVRU-QDMKHBRRSA-N 1 2 352.425 5.073 20 0 FKADLO FC(F)(F)c1cnc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)s1 ZINC000555338953 568413070 /nfs/dbraw/zinc/41/30/70/568413070.db2.gz RDDAXKPPAKWVRU-QDMKHBRRSA-N 1 2 352.425 5.073 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000555378201 568413716 /nfs/dbraw/zinc/41/37/16/568413716.db2.gz VRXRRDAKJDFIJD-NXEZZACHSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000555378206 568413733 /nfs/dbraw/zinc/41/37/33/568413733.db2.gz VRXRRDAKJDFIJD-UWVGGRQHSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1c(F)cccc1Cl ZINC000555378207 568413676 /nfs/dbraw/zinc/41/36/76/568413676.db2.gz VRXRRDAKJDFIJD-VHSXEESVSA-N 1 2 357.654 5.048 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000555378208 568413700 /nfs/dbraw/zinc/41/37/00/568413700.db2.gz VRXRRDAKJDFIJD-ZJUUUORDSA-N 1 2 357.654 5.048 20 0 FKADLO Fc1cccc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)c1Cl ZINC000555415297 568413856 /nfs/dbraw/zinc/41/38/56/568413856.db2.gz NMNIAUCVYMSSKY-LJQANCHMSA-N 1 2 361.247 5.407 20 0 FKADLO C[C@H]([NH2+]Cc1cccc(-c2ccncc2)c1)c1nc(C2CCCCC2)no1 ZINC000555434765 568414056 /nfs/dbraw/zinc/41/40/56/568414056.db2.gz FBBOYMLBTJFUHO-INIZCTEOSA-N 1 2 362.477 5.030 20 0 FKADLO C[C@@H]([NH2+]Cc1cccc(-c2ccncc2)c1)c1nc(C2CCCCC2)no1 ZINC000555434766 568414067 /nfs/dbraw/zinc/41/40/67/568414067.db2.gz FBBOYMLBTJFUHO-MRXNPFEDSA-N 1 2 362.477 5.030 20 0 FKADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ncc(CSC)s3)oc21 ZINC000555510829 568415265 /nfs/dbraw/zinc/41/52/65/568415265.db2.gz DJYBSVGANAOMLW-GFCCVEGCSA-N 1 2 362.520 5.002 20 0 FKADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3ncc(CSC)s3)oc21 ZINC000555510831 568415226 /nfs/dbraw/zinc/41/52/26/568415226.db2.gz DJYBSVGANAOMLW-LBPRGKRZSA-N 1 2 362.520 5.002 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](c2cccs2)c2ccc(F)cc2)s1 ZINC000555511619 568415656 /nfs/dbraw/zinc/41/56/56/568415656.db2.gz IEYLXPAESQJUBE-QGZVFWFLSA-N 1 2 364.536 5.086 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccccc2Oc2ccccc2C)s1 ZINC000555548863 568414005 /nfs/dbraw/zinc/41/40/05/568414005.db2.gz LPGQJDJMZAGAME-UHFFFAOYSA-N 1 2 370.543 5.397 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccccc2Oc2cccc(C)c2)s1 ZINC000555549306 568413942 /nfs/dbraw/zinc/41/39/42/568413942.db2.gz YVYFGRISZSEKRJ-UHFFFAOYSA-N 1 2 370.543 5.397 20 0 FKADLO Cc1c2cccc(Cl)c2sc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000555553321 568414343 /nfs/dbraw/zinc/41/43/43/568414343.db2.gz QPKIMMYPRUNZMZ-LLVKDONJSA-N 1 2 363.914 5.394 20 0 FKADLO Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000555553327 568414294 /nfs/dbraw/zinc/41/42/94/568414294.db2.gz QPKIMMYPRUNZMZ-NSHDSACASA-N 1 2 363.914 5.394 20 0 FKADLO Cc1cc(Cl)cc(CNc2cccc(C[N@@H+](C)Cc3cscn3)c2)c1 ZINC000555563754 568419998 /nfs/dbraw/zinc/41/99/98/568419998.db2.gz REMTUAVLKLNQAQ-UHFFFAOYSA-N 1 2 371.937 5.349 20 0 FKADLO Cc1cc(Cl)cc(CNc2cccc(C[N@H+](C)Cc3cscn3)c2)c1 ZINC000555563754 568419996 /nfs/dbraw/zinc/41/99/96/568419996.db2.gz REMTUAVLKLNQAQ-UHFFFAOYSA-N 1 2 371.937 5.349 20 0 FKADLO CSCc1cnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)s1 ZINC000555576540 568420623 /nfs/dbraw/zinc/42/06/23/568420623.db2.gz RBVQTMGOJHFOIJ-INIZCTEOSA-N 1 2 358.935 5.286 20 0 FKADLO CSCc1cnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)s1 ZINC000555576541 568420676 /nfs/dbraw/zinc/42/06/76/568420676.db2.gz RBVQTMGOJHFOIJ-MRXNPFEDSA-N 1 2 358.935 5.286 20 0 FKADLO CSCc1cnc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)s1 ZINC000555583479 568420971 /nfs/dbraw/zinc/42/09/71/568420971.db2.gz NEDGXKIPIJOMEQ-UHFFFAOYSA-N 1 2 373.374 5.482 20 0 FKADLO Cc1c2cccc(Cl)c2sc1CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000555586883 568421039 /nfs/dbraw/zinc/42/10/39/568421039.db2.gz IWSYQLFXJXXWQM-UHFFFAOYSA-N 1 2 368.893 5.115 20 0 FKADLO O=C(c1csc(-c2ccc(Cl)cc2)c1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000555626695 568421917 /nfs/dbraw/zinc/42/19/17/568421917.db2.gz XXFLSFLUQLETLU-INIZCTEOSA-N 1 2 371.893 5.159 20 0 FKADLO O=C(c1csc(-c2ccc(Cl)cc2)c1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000555626696 568421936 /nfs/dbraw/zinc/42/19/36/568421936.db2.gz XXFLSFLUQLETLU-MRXNPFEDSA-N 1 2 371.893 5.159 20 0 FKADLO Cc1ccc(C[NH2+]C2(c3nc(-c4ccccc4F)c(C)s3)CCC2)o1 ZINC000555646453 568422040 /nfs/dbraw/zinc/42/20/40/568422040.db2.gz YWEXLOZXDBITSK-UHFFFAOYSA-N 1 2 356.466 5.328 20 0 FKADLO Cc1sc(C2([NH2+]Cc3ccc(C)cn3)CCC2)nc1-c1ccccc1F ZINC000555646484 568422049 /nfs/dbraw/zinc/42/20/49/568422049.db2.gz ZNODSQMJIOXLAZ-UHFFFAOYSA-N 1 2 367.493 5.130 20 0 FKADLO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ncc(Br)s1 ZINC000555707932 568423460 /nfs/dbraw/zinc/42/34/60/568423460.db2.gz XUEHDSYHKRDHPU-ZETCQYMHSA-N 1 2 366.111 5.063 20 0 FKADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2occc2C(C)C)c1 ZINC000555853867 568425317 /nfs/dbraw/zinc/42/53/17/568425317.db2.gz MVYJLWUMRQJEOR-UHFFFAOYSA-N 1 2 351.450 5.319 20 0 FKADLO Cc1sc(C[NH2+][C@H](C)c2ccncc2F)nc1-c1ccc(Cl)cc1 ZINC000556075495 568428145 /nfs/dbraw/zinc/42/81/45/568428145.db2.gz AAQCJLDMCMHKRI-LLVKDONJSA-N 1 2 361.873 5.157 20 0 FKADLO Cc1sc(C[NH2+][C@@H](C)c2ccncc2F)nc1-c1ccc(Cl)cc1 ZINC000556075500 568428164 /nfs/dbraw/zinc/42/81/64/568428164.db2.gz AAQCJLDMCMHKRI-NSHDSACASA-N 1 2 361.873 5.157 20 0 FKADLO C[C@H]([NH2+]Cc1nc(-c2c(F)cccc2F)cs1)c1ccccc1Cl ZINC000556112915 568429064 /nfs/dbraw/zinc/42/90/64/568429064.db2.gz DYPASFIZPHUMKH-NSHDSACASA-N 1 2 364.848 5.593 20 0 FKADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cccc(C2CC2)c1 ZINC000556155460 568424248 /nfs/dbraw/zinc/42/42/48/568424248.db2.gz MEJAGSDZBMDOJE-KRWDZBQOSA-N 1 2 355.485 5.652 20 0 FKADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cccc(C2CC2)c1 ZINC000556155461 568424531 /nfs/dbraw/zinc/42/45/31/568424531.db2.gz MEJAGSDZBMDOJE-QGZVFWFLSA-N 1 2 355.485 5.652 20 0 FKADLO Clc1ccccc1-c1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)o1 ZINC000556189335 568426924 /nfs/dbraw/zinc/42/69/24/568426924.db2.gz DQYJXZOYECBAIM-JOCHJYFZSA-N 1 2 363.844 6.072 20 0 FKADLO Clc1ccccc1-c1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)o1 ZINC000556189344 568426893 /nfs/dbraw/zinc/42/68/93/568426893.db2.gz DQYJXZOYECBAIM-QFIPXVFZSA-N 1 2 363.844 6.072 20 0 FKADLO Cc1cc2cc([C@@H](C)[NH2+][C@H](C)c3ncc(Br)cn3)oc2cc1C ZINC000556209218 568440012 /nfs/dbraw/zinc/44/00/12/568440012.db2.gz YAGQNQNSGMCJHT-CHWSQXEVSA-N 1 2 374.282 5.014 20 0 FKADLO Cc1cc2cc([C@@H](C)[NH2+][C@@H](C)c3ncc(Br)cn3)oc2cc1C ZINC000556209225 568440007 /nfs/dbraw/zinc/44/00/07/568440007.db2.gz YAGQNQNSGMCJHT-OLZOCXBDSA-N 1 2 374.282 5.014 20 0 FKADLO Cc1cc2cc([C@H](C)[NH2+][C@H](C)c3ncc(Br)cn3)oc2cc1C ZINC000556209227 568440055 /nfs/dbraw/zinc/44/00/55/568440055.db2.gz YAGQNQNSGMCJHT-QWHCGFSZSA-N 1 2 374.282 5.014 20 0 FKADLO Cc1cc2cc([C@H](C)[NH2+][C@@H](C)c3ncc(Br)cn3)oc2cc1C ZINC000556209228 568440103 /nfs/dbraw/zinc/44/01/03/568440103.db2.gz YAGQNQNSGMCJHT-STQMWFEESA-N 1 2 374.282 5.014 20 0 FKADLO CC[C@@H](C)Oc1cccc(N[C@H](c2[nH+]ccn2C)c2ccccc2Cl)c1 ZINC000556218373 568429816 /nfs/dbraw/zinc/42/98/16/568429816.db2.gz SAGRDMZEQCFGEW-QRWLVFNGSA-N 1 2 369.896 5.452 20 0 FKADLO CC[C@H](C)Oc1cccc(N[C@H](c2[nH+]ccn2C)c2ccccc2Cl)c1 ZINC000556218374 568429731 /nfs/dbraw/zinc/42/97/31/568429731.db2.gz SAGRDMZEQCFGEW-YWZLYKJASA-N 1 2 369.896 5.452 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1cn2ccccc2n1 ZINC000556235653 568430317 /nfs/dbraw/zinc/43/03/17/568430317.db2.gz DBHFKKYWLPYENX-GHMZBOCLSA-N 1 2 352.240 5.192 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1cn2ccccc2n1)c1cc(F)c(Cl)cc1Cl ZINC000556235654 568430342 /nfs/dbraw/zinc/43/03/42/568430342.db2.gz DBHFKKYWLPYENX-MNOVXSKESA-N 1 2 352.240 5.192 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cn2ccccc2n1 ZINC000556235655 568430327 /nfs/dbraw/zinc/43/03/27/568430327.db2.gz DBHFKKYWLPYENX-QWRGUYRKSA-N 1 2 352.240 5.192 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cn2ccccc2n1 ZINC000556235656 568430267 /nfs/dbraw/zinc/43/02/67/568430267.db2.gz DBHFKKYWLPYENX-WDEREUQCSA-N 1 2 352.240 5.192 20 0 FKADLO COc1cccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)c1 ZINC000556246496 568430794 /nfs/dbraw/zinc/43/07/94/568430794.db2.gz HYLMQTMZAYRFDX-LHSJRXKWSA-N 1 2 370.855 5.323 20 0 FKADLO COc1cccc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)c1 ZINC000556246497 568430736 /nfs/dbraw/zinc/43/07/36/568430736.db2.gz HYLMQTMZAYRFDX-QKKBWIMNSA-N 1 2 370.855 5.323 20 0 FKADLO COc1cccc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)c1 ZINC000556246498 568430721 /nfs/dbraw/zinc/43/07/21/568430721.db2.gz HYLMQTMZAYRFDX-SPLOXXLWSA-N 1 2 370.855 5.323 20 0 FKADLO COc1cccc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)c1 ZINC000556246499 568430796 /nfs/dbraw/zinc/43/07/96/568430796.db2.gz HYLMQTMZAYRFDX-SZNDQCEHSA-N 1 2 370.855 5.323 20 0 FKADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccncc1F ZINC000556263569 568431338 /nfs/dbraw/zinc/43/13/38/568431338.db2.gz ZSPDUWANGCCZEN-RNODOKPDSA-N 1 2 358.819 5.453 20 0 FKADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccncc1F ZINC000556263572 568431353 /nfs/dbraw/zinc/43/13/53/568431353.db2.gz ZSPDUWANGCCZEN-XCLFUZPHSA-N 1 2 358.819 5.453 20 0 FKADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccncc1F ZINC000556263574 568431326 /nfs/dbraw/zinc/43/13/26/568431326.db2.gz ZSPDUWANGCCZEN-ZUOKHONESA-N 1 2 358.819 5.453 20 0 FKADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(-c2cc(F)ccc2Cl)n1 ZINC000556320336 568432659 /nfs/dbraw/zinc/43/26/59/568432659.db2.gz GLHXTTAXCIICFP-UHFFFAOYSA-N 1 2 370.815 5.051 20 0 FKADLO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)c2ccsc21)c1noc(Cc2ccccc2)n1 ZINC000556422339 568435078 /nfs/dbraw/zinc/43/50/78/568435078.db2.gz RGOKKGAMHRBXHV-CKEIUWERSA-N 1 2 353.491 5.011 20 0 FKADLO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)c1noc(Cc2ccccc2)n1 ZINC000556422341 568435154 /nfs/dbraw/zinc/43/51/54/568435154.db2.gz RGOKKGAMHRBXHV-CPUCHLNUSA-N 1 2 353.491 5.011 20 0 FKADLO C[C@H]([NH2+][C@@H]1CC[C@@H](C)c2ccsc21)c1noc(Cc2ccccc2)n1 ZINC000556422344 568435156 /nfs/dbraw/zinc/43/51/56/568435156.db2.gz RGOKKGAMHRBXHV-JKIFEVAISA-N 1 2 353.491 5.011 20 0 FKADLO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)c1noc(Cc2ccccc2)n1 ZINC000556422346 568435034 /nfs/dbraw/zinc/43/50/34/568435034.db2.gz RGOKKGAMHRBXHV-KEYYUXOJSA-N 1 2 353.491 5.011 20 0 FKADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)nc1 ZINC000556492642 568436313 /nfs/dbraw/zinc/43/63/13/568436313.db2.gz QLLLIGVITFGRRG-HNNXBMFYSA-N 1 2 363.408 5.047 20 0 FKADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)nc1 ZINC000556492642 568436312 /nfs/dbraw/zinc/43/63/12/568436312.db2.gz QLLLIGVITFGRRG-HNNXBMFYSA-N 1 2 363.408 5.047 20 0 FKADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc1 ZINC000556492643 568436244 /nfs/dbraw/zinc/43/62/44/568436244.db2.gz QLLLIGVITFGRRG-OAHLLOKOSA-N 1 2 363.408 5.047 20 0 FKADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc1 ZINC000556492643 568436242 /nfs/dbraw/zinc/43/62/42/568436242.db2.gz QLLLIGVITFGRRG-OAHLLOKOSA-N 1 2 363.408 5.047 20 0 FKADLO FC(F)(F)c1cccc(C2([NH2+]Cc3csc(-c4ccco4)n3)CC2)c1 ZINC000556503393 568436454 /nfs/dbraw/zinc/43/64/54/568436454.db2.gz WIJZWANKXZVJKJ-UHFFFAOYSA-N 1 2 364.392 5.201 20 0 FKADLO C[C@@H](c1nc2ccccc2n1C(F)F)[NH+]1CCC(CC(F)(F)F)CC1 ZINC000556505259 568436350 /nfs/dbraw/zinc/43/63/50/568436350.db2.gz GOKIXUPQNFIAFP-NSHDSACASA-N 1 2 361.358 5.157 20 0 FKADLO FC(F)(F)CC1CC[NH+](Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000556505424 568436423 /nfs/dbraw/zinc/43/64/23/568436423.db2.gz HKUCGIXBSYNLPZ-UHFFFAOYSA-N 1 2 358.791 5.159 20 0 FKADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(CC(F)(F)F)CC1 ZINC000556508315 568436483 /nfs/dbraw/zinc/43/64/83/568436483.db2.gz LUINQSNGFNYNQZ-OAHLLOKOSA-N 1 2 370.459 5.110 20 0 FKADLO Clc1cnc(C[N@@H+](Cc2cccs2)C2Cc3ccccc3C2)s1 ZINC000556517131 568436725 /nfs/dbraw/zinc/43/67/25/568436725.db2.gz CGFDTJFFHKDYIY-UHFFFAOYSA-N 1 2 360.935 5.028 20 0 FKADLO Clc1cnc(C[N@H+](Cc2cccs2)C2Cc3ccccc3C2)s1 ZINC000556517131 568436724 /nfs/dbraw/zinc/43/67/24/568436724.db2.gz CGFDTJFFHKDYIY-UHFFFAOYSA-N 1 2 360.935 5.028 20 0 FKADLO CC(C)C[N@@H+](Cc1nccn1CC(F)(F)F)[C@@H](C)c1ccccc1Cl ZINC000556522497 568436839 /nfs/dbraw/zinc/43/68/39/568436839.db2.gz HXGMVQAAHWTCSJ-AWEZNQCLSA-N 1 2 373.850 5.318 20 0 FKADLO CC(C)C[N@H+](Cc1nccn1CC(F)(F)F)[C@@H](C)c1ccccc1Cl ZINC000556522497 568436838 /nfs/dbraw/zinc/43/68/38/568436838.db2.gz HXGMVQAAHWTCSJ-AWEZNQCLSA-N 1 2 373.850 5.318 20 0 FKADLO CC(C)C[N@@H+](Cc1nccn1CC(F)(F)F)[C@H](C)c1ccccc1Cl ZINC000556522501 568436892 /nfs/dbraw/zinc/43/68/92/568436892.db2.gz HXGMVQAAHWTCSJ-CQSZACIVSA-N 1 2 373.850 5.318 20 0 FKADLO CC(C)C[N@H+](Cc1nccn1CC(F)(F)F)[C@H](C)c1ccccc1Cl ZINC000556522501 568436891 /nfs/dbraw/zinc/43/68/91/568436891.db2.gz HXGMVQAAHWTCSJ-CQSZACIVSA-N 1 2 373.850 5.318 20 0 FKADLO FC1(c2cccnc2)CC[NH+](Cc2csc(C3CCCCC3)n2)CC1 ZINC000556544395 568437077 /nfs/dbraw/zinc/43/70/77/568437077.db2.gz YNUOMRCPDIXMEE-UHFFFAOYSA-N 1 2 359.514 5.047 20 0 FKADLO Fc1ccccc1-c1cnc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)o1 ZINC000556544516 568437032 /nfs/dbraw/zinc/43/70/32/568437032.db2.gz DXUMHXSOITVUIN-UHFFFAOYSA-N 1 2 356.828 5.303 20 0 FKADLO Cc1cc(-c2noc(C[NH2+]C3(c4ccc(Cl)cc4)CCC3)n2)ccc1F ZINC000556544679 568437037 /nfs/dbraw/zinc/43/70/37/568437037.db2.gz ADLJXPOFCBLYMB-UHFFFAOYSA-N 1 2 371.843 5.007 20 0 FKADLO Cc1ccc(Sc2ccc(NC(=O)C[C@H](C)n3cc[nH+]c3)cc2)cc1C ZINC000556687451 568444026 /nfs/dbraw/zinc/44/40/26/568444026.db2.gz WCIGHILHNHRUQQ-KRWDZBQOSA-N 1 2 365.502 5.241 20 0 FKADLO Cc1ccc(Sc2ccc(NC(=O)C[C@@H](C)n3cc[nH+]c3)cc2)cc1C ZINC000556687452 568443993 /nfs/dbraw/zinc/44/39/93/568443993.db2.gz WCIGHILHNHRUQQ-QGZVFWFLSA-N 1 2 365.502 5.241 20 0 FKADLO O=c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)[nH]c2ccsc21 ZINC000556813512 568445161 /nfs/dbraw/zinc/44/51/61/568445161.db2.gz ZCIHSWKSRKKMAI-KRWDZBQOSA-N 1 2 373.909 5.071 20 0 FKADLO O=c1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)[nH]c2ccsc21 ZINC000556813513 568445061 /nfs/dbraw/zinc/44/50/61/568445061.db2.gz ZCIHSWKSRKKMAI-QGZVFWFLSA-N 1 2 373.909 5.071 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccccc2Cl)cc1 ZINC000556885974 568446232 /nfs/dbraw/zinc/44/62/32/568446232.db2.gz KBTYODDHVZIYMV-OPAMFIHVSA-N 1 2 366.892 5.492 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccccc2Cl)cc1 ZINC000556885975 568446200 /nfs/dbraw/zinc/44/62/00/568446200.db2.gz KBTYODDHVZIYMV-ZHRRBRCNSA-N 1 2 366.892 5.492 20 0 FKADLO Cc1csc(-c2ccc(N[C@H](c3[nH]cc[nH+]3)C3CCCCC3)cc2)n1 ZINC000556894782 568446514 /nfs/dbraw/zinc/44/65/14/568446514.db2.gz FUCWHCZWTAUWPF-SFHVURJKSA-N 1 2 352.507 5.575 20 0 FKADLO c1c[nH+]c([C@@H](Nc2ccc(COC3CCCC3)cc2)C2CCCCC2)[nH]1 ZINC000556895268 568446698 /nfs/dbraw/zinc/44/66/98/568446698.db2.gz MTBLXOJFRCUBHP-NRFANRHFSA-N 1 2 353.510 5.602 20 0 FKADLO c1c[nH+]c([C@H](Nc2ccc(COC3CCCC3)cc2)C2CCCCC2)[nH]1 ZINC000556895270 568446664 /nfs/dbraw/zinc/44/66/64/568446664.db2.gz MTBLXOJFRCUBHP-OAQYLSRUSA-N 1 2 353.510 5.602 20 0 FKADLO Cc1oc(C2CC2)nc1C(=O)Nc1ccc2[nH]c(C3CCCCC3)[nH+]c2c1 ZINC000556895613 568446617 /nfs/dbraw/zinc/44/66/17/568446617.db2.gz QEJREBNIQDBBFC-UHFFFAOYSA-N 1 2 364.449 5.037 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@@H](c1cccnc1)c1ccc(F)cc1F ZINC000556913396 568447197 /nfs/dbraw/zinc/44/71/97/568447197.db2.gz UICJDXOZYCKXFB-FQEVSTJZSA-N 1 2 374.431 5.100 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@H](c1cccnc1)c1ccc(F)cc1F ZINC000556913397 568447169 /nfs/dbraw/zinc/44/71/69/568447169.db2.gz UICJDXOZYCKXFB-HXUWFJFHSA-N 1 2 374.431 5.100 20 0 FKADLO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000556913746 568447220 /nfs/dbraw/zinc/44/72/20/568447220.db2.gz ULISOENCLWXFCC-BJOHPYRUSA-N 1 2 358.700 5.182 20 0 FKADLO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000556913754 568447211 /nfs/dbraw/zinc/44/72/11/568447211.db2.gz ULISOENCLWXFCC-PSLIRLAXSA-N 1 2 358.700 5.182 20 0 FKADLO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000556913756 568447174 /nfs/dbraw/zinc/44/71/74/568447174.db2.gz ULISOENCLWXFCC-RFAUZJTJSA-N 1 2 358.700 5.182 20 0 FKADLO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000556913759 568447179 /nfs/dbraw/zinc/44/71/79/568447179.db2.gz ULISOENCLWXFCC-VFZGTOFNSA-N 1 2 358.700 5.182 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Oc2ccccc2)c(F)c1 ZINC000556916979 568447406 /nfs/dbraw/zinc/44/74/06/568447406.db2.gz ZOYKYYZMHJZLGL-KBPBESRZSA-N 1 2 372.390 5.703 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Oc2ccccc2)c(F)c1 ZINC000556916981 568447454 /nfs/dbraw/zinc/44/74/54/568447454.db2.gz ZOYKYYZMHJZLGL-KGLIPLIRSA-N 1 2 372.390 5.703 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1c(F)cncc1F ZINC000556916986 568447409 /nfs/dbraw/zinc/44/74/09/568447409.db2.gz ZOYKYYZMHJZLGL-UONOGXRCSA-N 1 2 372.390 5.703 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(Oc2ccccc2)c(F)c1 ZINC000556916988 568447490 /nfs/dbraw/zinc/44/74/90/568447490.db2.gz ZOYKYYZMHJZLGL-ZIAGYGMSSA-N 1 2 372.390 5.703 20 0 FKADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2sccc2Cl)c1 ZINC000556918852 568447641 /nfs/dbraw/zinc/44/76/41/568447641.db2.gz FQQFCKSKKSJAIC-UHFFFAOYSA-N 1 2 359.882 5.317 20 0 FKADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1CCc1ccccc1 ZINC000556923488 568447825 /nfs/dbraw/zinc/44/78/25/568447825.db2.gz URNBHQXAXSKMDC-UHFFFAOYSA-N 1 2 367.452 5.114 20 0 FKADLO CC(C)(CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000557031941 568441222 /nfs/dbraw/zinc/44/12/22/568441222.db2.gz QWDXDBNFSQIUOV-UHFFFAOYSA-N 1 2 373.500 5.193 20 0 FKADLO C[C@H](CC1CCCC1)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000557034196 568441131 /nfs/dbraw/zinc/44/11/31/568441131.db2.gz AZLLEIUALPNESX-MRXNPFEDSA-N 1 2 351.494 5.041 20 0 FKADLO CC[C@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000557034368 568441143 /nfs/dbraw/zinc/44/11/43/568441143.db2.gz GFECDATVYXUOIG-GOSISDBHSA-N 1 2 373.500 5.409 20 0 FKADLO CC[C@@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000557034371 568441191 /nfs/dbraw/zinc/44/11/91/568441191.db2.gz GFECDATVYXUOIG-SFHVURJKSA-N 1 2 373.500 5.409 20 0 FKADLO Cc1cccc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)c1Cl ZINC000557035603 568441273 /nfs/dbraw/zinc/44/12/73/568441273.db2.gz PDHVYGYHPGRURD-UHFFFAOYSA-N 1 2 365.864 5.101 20 0 FKADLO O=C(CCCC1CCCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000557035913 568441348 /nfs/dbraw/zinc/44/13/48/568441348.db2.gz RRYZNHSPYZCWQK-UHFFFAOYSA-N 1 2 351.494 5.185 20 0 FKADLO c1nc(-c2ccncc2)sc1CNc1cccc([NH+]2CCCCCC2)c1 ZINC000557035980 568441344 /nfs/dbraw/zinc/44/13/44/568441344.db2.gz GDVOWRDYNVPFTP-UHFFFAOYSA-N 1 2 364.518 5.198 20 0 FKADLO CC(C)(C)c1ccc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)cc1 ZINC000557036479 568441336 /nfs/dbraw/zinc/44/13/36/568441336.db2.gz REGHDHZLJIWSEF-UHFFFAOYSA-N 1 2 373.500 5.436 20 0 FKADLO Cc1cc(-c2ncco2)ccc1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000557037343 568441322 /nfs/dbraw/zinc/44/13/22/568441322.db2.gz IQLSGCMNKBKZBS-UHFFFAOYSA-N 1 2 371.396 5.090 20 0 FKADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc(Cl)sc3Cl)co2)cc1 ZINC000557118810 568442942 /nfs/dbraw/zinc/44/29/42/568442942.db2.gz UWIHPUWPDMTDLL-UHFFFAOYSA-N 1 2 353.274 5.308 20 0 FKADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)n1 ZINC000557179166 568445193 /nfs/dbraw/zinc/44/51/93/568445193.db2.gz MXKPJHHFNBITEX-SECBINFHSA-N 1 2 368.289 5.264 20 0 FKADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)n1 ZINC000557179169 568445308 /nfs/dbraw/zinc/44/53/08/568445308.db2.gz MXKPJHHFNBITEX-VIFPVBQESA-N 1 2 368.289 5.264 20 0 FKADLO Cc1ccc(C(=O)N2CCC=C(c3ccccc3)C2)cc1Oc1cc[nH+]cc1 ZINC000557183587 568445827 /nfs/dbraw/zinc/44/58/27/568445827.db2.gz KKZZDMJMLGFQGM-UHFFFAOYSA-N 1 2 370.452 5.112 20 0 FKADLO C[C@@H]([NH2+]Cc1cc(-c2ccco2)on1)c1cc(F)c(Cl)cc1Cl ZINC000557185293 568447354 /nfs/dbraw/zinc/44/73/54/568447354.db2.gz RWAFYMXUVPSCDR-SECBINFHSA-N 1 2 355.196 5.231 20 0 FKADLO C[C@H]([NH2+]Cc1cc(-c2ccco2)on1)c1cc(F)c(Cl)cc1Cl ZINC000557185299 568447510 /nfs/dbraw/zinc/44/75/10/568447510.db2.gz RWAFYMXUVPSCDR-VIFPVBQESA-N 1 2 355.196 5.231 20 0 FKADLO CCOc1ccc([C@@H]([NH2+]Cc2ncc(C)s2)c2cccc(Cl)c2)cc1 ZINC000557198678 568444631 /nfs/dbraw/zinc/44/46/31/568444631.db2.gz TZPAAXYGENRLBF-HXUWFJFHSA-N 1 2 372.921 5.383 20 0 FKADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)s1 ZINC000557202979 568455601 /nfs/dbraw/zinc/45/56/01/568455601.db2.gz LPWCIYHSAQRXBO-HNNXBMFYSA-N 1 2 357.548 5.385 20 0 FKADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)s1 ZINC000557202979 568455600 /nfs/dbraw/zinc/45/56/00/568455600.db2.gz LPWCIYHSAQRXBO-HNNXBMFYSA-N 1 2 357.548 5.385 20 0 FKADLO Cc1cnc(C[N@H+](C)[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)s1 ZINC000557202984 568455595 /nfs/dbraw/zinc/45/55/95/568455595.db2.gz LPWCIYHSAQRXBO-OAHLLOKOSA-N 1 2 357.548 5.385 20 0 FKADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)s1 ZINC000557202984 568455594 /nfs/dbraw/zinc/45/55/94/568455594.db2.gz LPWCIYHSAQRXBO-OAHLLOKOSA-N 1 2 357.548 5.385 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccc(F)cc2)cc1 ZINC000557264026 568456918 /nfs/dbraw/zinc/45/69/18/568456918.db2.gz WKWJDHJJUISUHU-RBZFPXEDSA-N 1 2 356.466 5.039 20 0 FKADLO COc1ccc([C@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccc(F)cc2)cc1 ZINC000557264027 568456908 /nfs/dbraw/zinc/45/69/08/568456908.db2.gz WKWJDHJJUISUHU-RNODOKPDSA-N 1 2 356.466 5.039 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2csc(C)n2)c2ccc(F)cc2)cc1 ZINC000557264028 568456986 /nfs/dbraw/zinc/45/69/86/568456986.db2.gz WKWJDHJJUISUHU-XCLFUZPHSA-N 1 2 356.466 5.039 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2csc(C)n2)c2ccc(F)cc2)cc1 ZINC000557264029 568456938 /nfs/dbraw/zinc/45/69/38/568456938.db2.gz WKWJDHJJUISUHU-ZUOKHONESA-N 1 2 356.466 5.039 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)cs1 ZINC000557271012 568456928 /nfs/dbraw/zinc/45/69/28/568456928.db2.gz ZHMZDOPFACPYIC-BXKDBHETSA-N 1 2 357.306 5.358 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)cs1 ZINC000557271020 568456950 /nfs/dbraw/zinc/45/69/50/568456950.db2.gz ZHMZDOPFACPYIC-CABZTGNLSA-N 1 2 357.306 5.358 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)cs1 ZINC000557271022 568456960 /nfs/dbraw/zinc/45/69/60/568456960.db2.gz ZHMZDOPFACPYIC-JOYOIKCWSA-N 1 2 357.306 5.358 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)cs1 ZINC000557271024 568456903 /nfs/dbraw/zinc/45/69/03/568456903.db2.gz ZHMZDOPFACPYIC-SKDRFNHKSA-N 1 2 357.306 5.358 20 0 FKADLO FC(F)(F)c1ccc(-c2nc(C[NH+]3Cc4ccccc4C3)cs2)cc1 ZINC000557282037 568457234 /nfs/dbraw/zinc/45/72/34/568457234.db2.gz MOXUKKREBAAGAN-UHFFFAOYSA-N 1 2 360.404 5.345 20 0 FKADLO CC(C)[C@H]1N(C(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)CC12CCC2 ZINC000557372199 568450099 /nfs/dbraw/zinc/45/00/99/568450099.db2.gz XHDMYZOMCQWDAM-LJQANCHMSA-N 1 2 370.880 5.178 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384681 568450399 /nfs/dbraw/zinc/45/03/99/568450399.db2.gz CQSYPZCIXLVBGW-GHMZBOCLSA-N 1 2 367.802 5.636 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384683 568450408 /nfs/dbraw/zinc/45/04/08/568450408.db2.gz CQSYPZCIXLVBGW-QWRGUYRKSA-N 1 2 367.802 5.636 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1nc2ccccc2n1C(F)F ZINC000557384684 568450362 /nfs/dbraw/zinc/45/03/62/568450362.db2.gz CQSYPZCIXLVBGW-WDEREUQCSA-N 1 2 367.802 5.636 20 0 FKADLO Cc1cccc(-c2noc(C[NH2+]C3(c4ccc(Cl)c(Cl)c4)CC3)n2)c1 ZINC000557485194 568452735 /nfs/dbraw/zinc/45/27/35/568452735.db2.gz WWUHOCRDVSPRLE-UHFFFAOYSA-N 1 2 374.271 5.131 20 0 FKADLO Clc1ccc2c(c1)OCCC[C@@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000557508542 568453546 /nfs/dbraw/zinc/45/35/46/568453546.db2.gz QUOUINIJVDNKHV-HKUYNNGSSA-N 1 2 370.905 5.389 20 0 FKADLO Clc1ccc2c(c1)OCCC[C@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000557508545 568453483 /nfs/dbraw/zinc/45/34/83/568453483.db2.gz QUOUINIJVDNKHV-IEBWSBKVSA-N 1 2 370.905 5.389 20 0 FKADLO Clc1ccc2c(c1)OCCC[C@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000557508547 568453480 /nfs/dbraw/zinc/45/34/80/568453480.db2.gz QUOUINIJVDNKHV-MJGOQNOKSA-N 1 2 370.905 5.389 20 0 FKADLO Clc1ccc2c(c1)OCCC[C@@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000557508549 568453505 /nfs/dbraw/zinc/45/35/05/568453505.db2.gz QUOUINIJVDNKHV-PKOBYXMFSA-N 1 2 370.905 5.389 20 0 FKADLO CC1(C)CCC[C@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000557520813 568453751 /nfs/dbraw/zinc/45/37/51/568453751.db2.gz LQZSTMBRQHBZNF-INIZCTEOSA-N 1 2 351.494 5.041 20 0 FKADLO CC1(C)CCC[C@@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000557520817 568453723 /nfs/dbraw/zinc/45/37/23/568453723.db2.gz LQZSTMBRQHBZNF-MRXNPFEDSA-N 1 2 351.494 5.041 20 0 FKADLO COc1cc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)ccc1OC1CCCC1 ZINC000557530817 568454289 /nfs/dbraw/zinc/45/42/89/568454289.db2.gz OZYHYCKXSQCLSK-HNNXBMFYSA-N 1 2 372.509 5.153 20 0 FKADLO COc1cc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)ccc1OC1CCCC1 ZINC000557530821 568454229 /nfs/dbraw/zinc/45/42/29/568454229.db2.gz OZYHYCKXSQCLSK-OAHLLOKOSA-N 1 2 372.509 5.153 20 0 FKADLO FC(F)(F)c1cccc(C2([NH2+]Cc3csc(-c4ccoc4)n3)CC2)c1 ZINC000557556425 568454595 /nfs/dbraw/zinc/45/45/95/568454595.db2.gz ZSAZQLUDRIEQHZ-UHFFFAOYSA-N 1 2 364.392 5.201 20 0 FKADLO CC(C)([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccc(F)c(F)c1 ZINC000557560392 568454897 /nfs/dbraw/zinc/45/48/97/568454897.db2.gz NKCVVWOMKBCDRI-UHFFFAOYSA-N 1 2 372.484 5.231 20 0 FKADLO CCO[C@H](C)c1nc(CN(C)c2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000557580510 568455257 /nfs/dbraw/zinc/45/52/57/568455257.db2.gz CPXJZOBFZIJRKN-GFCCVEGCSA-N 1 2 361.898 5.079 20 0 FKADLO CCO[C@@H](C)c1nc(CN(C)c2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000557580511 568455306 /nfs/dbraw/zinc/45/53/06/568455306.db2.gz CPXJZOBFZIJRKN-LBPRGKRZSA-N 1 2 361.898 5.079 20 0 FKADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2coc3ccc(C(C)C)cc23)[nH+]1 ZINC000557599815 568455476 /nfs/dbraw/zinc/45/54/76/568455476.db2.gz LFYKCSBQHCPHOT-UHFFFAOYSA-N 1 2 359.429 5.507 20 0 FKADLO Cc1ccc([C@@H](Nc2[nH+]ccc(C)c2Br)c2ccccn2)cc1 ZINC000557674730 568459053 /nfs/dbraw/zinc/45/90/53/568459053.db2.gz UYTWJYQLIMXEQZ-GOSISDBHSA-N 1 2 368.278 5.057 20 0 FKADLO Cc1ccc([C@H](Nc2[nH+]ccc(C)c2Br)c2ccccn2)cc1 ZINC000557674731 568459029 /nfs/dbraw/zinc/45/90/29/568459029.db2.gz UYTWJYQLIMXEQZ-SFHVURJKSA-N 1 2 368.278 5.057 20 0 FKADLO Cc1ccc2oc(C[NH2+][C@H](c3nccn3C)c3ccc(Cl)cc3)cc2c1 ZINC000557679073 568459138 /nfs/dbraw/zinc/45/91/38/568459138.db2.gz DGFOAZNFAJUMIQ-FQEVSTJZSA-N 1 2 365.864 5.007 20 0 FKADLO Cc1ccc2oc(C[NH2+][C@@H](c3nccn3C)c3ccc(Cl)cc3)cc2c1 ZINC000557679075 568459159 /nfs/dbraw/zinc/45/91/59/568459159.db2.gz DGFOAZNFAJUMIQ-HXUWFJFHSA-N 1 2 365.864 5.007 20 0 FKADLO CC(C)n1ccc(C[NH2+]Cc2ccc(-c3cccc(Cl)c3Cl)o2)n1 ZINC000557700719 568459615 /nfs/dbraw/zinc/45/96/15/568459615.db2.gz FYYDDJJLALWZGY-UHFFFAOYSA-N 1 2 364.276 5.321 20 0 FKADLO CCCN(C(=O)c1cccc(Cn2cc[nH+]c2)c1)c1cccc2ccccc21 ZINC000557767234 568460725 /nfs/dbraw/zinc/46/07/25/568460725.db2.gz FTXHDBRBRHGCTE-UHFFFAOYSA-N 1 2 369.468 5.141 20 0 FKADLO CCn1cc[nH+]c1CN[C@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805996 568461367 /nfs/dbraw/zinc/46/13/67/568461367.db2.gz KDUJLRSGEVYJMH-NRFANRHFSA-N 1 2 353.897 5.052 20 0 FKADLO CCn1ccnc1C[NH2+][C@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805996 568461365 /nfs/dbraw/zinc/46/13/65/568461365.db2.gz KDUJLRSGEVYJMH-NRFANRHFSA-N 1 2 353.897 5.052 20 0 FKADLO CCn1cc[nH+]c1CN[C@@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805997 568461320 /nfs/dbraw/zinc/46/13/20/568461320.db2.gz KDUJLRSGEVYJMH-OAQYLSRUSA-N 1 2 353.897 5.052 20 0 FKADLO CCn1ccnc1C[NH2+][C@@H](c1cc(C)ccc1C)c1ccccc1Cl ZINC000557805997 568461318 /nfs/dbraw/zinc/46/13/18/568461318.db2.gz KDUJLRSGEVYJMH-OAQYLSRUSA-N 1 2 353.897 5.052 20 0 FKADLO Cc1csc([C@@H]([NH2+]Cc2cc(Cl)ccc2Br)C2CC2)n1 ZINC000557818276 568461598 /nfs/dbraw/zinc/46/15/98/568461598.db2.gz HBCVTAZZSHWJEO-AWEZNQCLSA-N 1 2 371.731 5.108 20 0 FKADLO Cc1csc([C@H]([NH2+]Cc2cc(Cl)ccc2Br)C2CC2)n1 ZINC000557818277 568461637 /nfs/dbraw/zinc/46/16/37/568461637.db2.gz HBCVTAZZSHWJEO-CQSZACIVSA-N 1 2 371.731 5.108 20 0 FKADLO Cc1ccc(OCc2nc(Cn3c[nH+]c4cc(C)c(C)cc43)cs2)cc1 ZINC000557982380 568465773 /nfs/dbraw/zinc/46/57/73/568465773.db2.gz OXULBKPUBSEDGS-UHFFFAOYSA-N 1 2 363.486 5.045 20 0 FKADLO Clc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)cs2)cc1 ZINC000558100849 568471714 /nfs/dbraw/zinc/47/17/14/568471714.db2.gz NUCISIYWBSFJSJ-GOSISDBHSA-N 1 2 355.894 5.196 20 0 FKADLO Clc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)cs2)cc1 ZINC000558100849 568471713 /nfs/dbraw/zinc/47/17/13/568471713.db2.gz NUCISIYWBSFJSJ-GOSISDBHSA-N 1 2 355.894 5.196 20 0 FKADLO Clc1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)cs2)cc1 ZINC000558100850 568471684 /nfs/dbraw/zinc/47/16/84/568471684.db2.gz NUCISIYWBSFJSJ-SFHVURJKSA-N 1 2 355.894 5.196 20 0 FKADLO Clc1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)cs2)cc1 ZINC000558100850 568471683 /nfs/dbraw/zinc/47/16/83/568471683.db2.gz NUCISIYWBSFJSJ-SFHVURJKSA-N 1 2 355.894 5.196 20 0 FKADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)sc1C ZINC000558102650 568471706 /nfs/dbraw/zinc/47/17/06/568471706.db2.gz VWTYEEPZHGKURO-UHFFFAOYSA-N 1 2 364.383 5.082 20 0 FKADLO C[C@@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1nccn1-c1ccccc1 ZINC000558119958 568472036 /nfs/dbraw/zinc/47/20/36/568472036.db2.gz PKNVGNBPHCNDGW-MRXNPFEDSA-N 1 2 366.534 5.227 20 0 FKADLO COC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1cccc(Cl)c1 ZINC000558121857 568472237 /nfs/dbraw/zinc/47/22/37/568472237.db2.gz KZZBSTVVGWXUKW-GFCCVEGCSA-N 1 2 350.698 5.186 20 0 FKADLO COC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1cccc(Cl)c1 ZINC000558121860 568472251 /nfs/dbraw/zinc/47/22/51/568472251.db2.gz KZZBSTVVGWXUKW-LBPRGKRZSA-N 1 2 350.698 5.186 20 0 FKADLO Fc1cncc(C[NH2+][C@@H](c2ccccc2)c2cc(Cl)ccc2Cl)c1 ZINC000558125560 568472213 /nfs/dbraw/zinc/47/22/13/568472213.db2.gz IFWDDFPOJIGQSP-IBGZPJMESA-N 1 2 361.247 5.407 20 0 FKADLO Fc1cncc(C[NH2+][C@H](c2ccccc2)c2cc(Cl)ccc2Cl)c1 ZINC000558125561 568472240 /nfs/dbraw/zinc/47/22/40/568472240.db2.gz IFWDDFPOJIGQSP-LJQANCHMSA-N 1 2 361.247 5.407 20 0 FKADLO C[C@H]([NH2+]Cc1ccc(C2CCCC2)cc1)c1nc(Cc2ccccc2)no1 ZINC000558159378 568472716 /nfs/dbraw/zinc/47/27/16/568472716.db2.gz YYQVBHNWOJKWDZ-KRWDZBQOSA-N 1 2 361.489 5.169 20 0 FKADLO C[C@@H]([NH2+]Cc1ccc(C2CCCC2)cc1)c1nc(Cc2ccccc2)no1 ZINC000558159380 568472723 /nfs/dbraw/zinc/47/27/23/568472723.db2.gz YYQVBHNWOJKWDZ-QGZVFWFLSA-N 1 2 361.489 5.169 20 0 FKADLO C[C@@H]1C[C@H]([NH2+][C@H](c2ccn(C)n2)c2ccc(Cl)cc2)c2ccccc21 ZINC000558162910 568472870 /nfs/dbraw/zinc/47/28/70/568472870.db2.gz HDDMQJPTWGWTFX-OREJSRFESA-N 1 2 351.881 5.001 20 0 FKADLO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c2ccccc21 ZINC000558162911 568472864 /nfs/dbraw/zinc/47/28/64/568472864.db2.gz HDDMQJPTWGWTFX-PUCZYUMASA-N 1 2 351.881 5.001 20 0 FKADLO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)c2ccccc21 ZINC000558162912 568472874 /nfs/dbraw/zinc/47/28/74/568472874.db2.gz HDDMQJPTWGWTFX-XMDBHEJHSA-N 1 2 351.881 5.001 20 0 FKADLO CC[N@@H+](Cc1ccc(C2CCCC2)cc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000558165691 568472813 /nfs/dbraw/zinc/47/28/13/568472813.db2.gz HJEVYVBJOVUAET-UHFFFAOYSA-N 1 2 361.489 5.015 20 0 FKADLO CC[N@H+](Cc1ccc(C2CCCC2)cc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000558165691 568472811 /nfs/dbraw/zinc/47/28/11/568472811.db2.gz HJEVYVBJOVUAET-UHFFFAOYSA-N 1 2 361.489 5.015 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000558181434 568473039 /nfs/dbraw/zinc/47/30/39/568473039.db2.gz JHEVGECQBUHVAM-GOSISDBHSA-N 1 2 354.425 5.072 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000558181434 568473038 /nfs/dbraw/zinc/47/30/38/568473038.db2.gz JHEVGECQBUHVAM-GOSISDBHSA-N 1 2 354.425 5.072 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000558181437 568473233 /nfs/dbraw/zinc/47/32/33/568473233.db2.gz JHEVGECQBUHVAM-SFHVURJKSA-N 1 2 354.425 5.072 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000558181437 568473232 /nfs/dbraw/zinc/47/32/32/568473232.db2.gz JHEVGECQBUHVAM-SFHVURJKSA-N 1 2 354.425 5.072 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000558181804 568473218 /nfs/dbraw/zinc/47/32/18/568473218.db2.gz SOYDBRDQUBDIGL-BLLLJJGKSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000558181804 568473217 /nfs/dbraw/zinc/47/32/17/568473217.db2.gz SOYDBRDQUBDIGL-BLLLJJGKSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000558181805 568473225 /nfs/dbraw/zinc/47/32/25/568473225.db2.gz SOYDBRDQUBDIGL-LRDDRELGSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000558181805 568473223 /nfs/dbraw/zinc/47/32/23/568473223.db2.gz SOYDBRDQUBDIGL-LRDDRELGSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000558181806 568473269 /nfs/dbraw/zinc/47/32/69/568473269.db2.gz SOYDBRDQUBDIGL-MLGOLLRUSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000558181806 568473268 /nfs/dbraw/zinc/47/32/68/568473268.db2.gz SOYDBRDQUBDIGL-MLGOLLRUSA-N 1 2 373.522 5.550 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000558181808 568473185 /nfs/dbraw/zinc/47/31/85/568473185.db2.gz SOYDBRDQUBDIGL-WBMJQRKESA-N 1 2 373.522 5.550 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000558181808 568473184 /nfs/dbraw/zinc/47/31/84/568473184.db2.gz SOYDBRDQUBDIGL-WBMJQRKESA-N 1 2 373.522 5.550 20 0 FKADLO COC[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccc(Cl)c1 ZINC000558184205 568473180 /nfs/dbraw/zinc/47/31/80/568473180.db2.gz RAWMMJYZMYRWDQ-GOSISDBHSA-N 1 2 364.942 5.322 20 0 FKADLO COC[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccc(Cl)c1 ZINC000558184206 568473235 /nfs/dbraw/zinc/47/32/35/568473235.db2.gz RAWMMJYZMYRWDQ-SFHVURJKSA-N 1 2 364.942 5.322 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(-c2ccccc2C)o1 ZINC000558186004 568473263 /nfs/dbraw/zinc/47/32/63/568473263.db2.gz ZZXJTYUUJZWTNE-IBGZPJMESA-N 1 2 350.462 5.242 20 0 FKADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncc(-c2ccccc2C)o1 ZINC000558186004 568473262 /nfs/dbraw/zinc/47/32/62/568473262.db2.gz ZZXJTYUUJZWTNE-IBGZPJMESA-N 1 2 350.462 5.242 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(-c2ccccc2C)o1 ZINC000558186008 568473272 /nfs/dbraw/zinc/47/32/72/568473272.db2.gz ZZXJTYUUJZWTNE-LJQANCHMSA-N 1 2 350.462 5.242 20 0 FKADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncc(-c2ccccc2C)o1 ZINC000558186008 568473271 /nfs/dbraw/zinc/47/32/71/568473271.db2.gz ZZXJTYUUJZWTNE-LJQANCHMSA-N 1 2 350.462 5.242 20 0 FKADLO CC[N@@H+](C)[C@@H](c1nc(CSc2ccc(Cl)cc2)no1)c1ccccc1 ZINC000558274514 568467560 /nfs/dbraw/zinc/46/75/60/568467560.db2.gz CXUNVKKUCCVUSQ-GOSISDBHSA-N 1 2 373.909 5.056 20 0 FKADLO CC[N@H+](C)[C@@H](c1nc(CSc2ccc(Cl)cc2)no1)c1ccccc1 ZINC000558274514 568467558 /nfs/dbraw/zinc/46/75/58/568467558.db2.gz CXUNVKKUCCVUSQ-GOSISDBHSA-N 1 2 373.909 5.056 20 0 FKADLO CC[N@@H+](C)[C@H](c1nc(CSc2ccc(Cl)cc2)no1)c1ccccc1 ZINC000558274515 568467576 /nfs/dbraw/zinc/46/75/76/568467576.db2.gz CXUNVKKUCCVUSQ-SFHVURJKSA-N 1 2 373.909 5.056 20 0 FKADLO CC[N@H+](C)[C@H](c1nc(CSc2ccc(Cl)cc2)no1)c1ccccc1 ZINC000558274515 568467574 /nfs/dbraw/zinc/46/75/74/568467574.db2.gz CXUNVKKUCCVUSQ-SFHVURJKSA-N 1 2 373.909 5.056 20 0 FKADLO CCc1ccc([C@H]2CCN(C(=O)c3cccc(Oc4cc[nH+]cc4)c3)C2)cc1 ZINC000558303033 568468490 /nfs/dbraw/zinc/46/84/90/568468490.db2.gz JZWSENSJEMTKMW-NRFANRHFSA-N 1 2 372.468 5.066 20 0 FKADLO CCc1ccc([C@@H]2CCN(C(=O)c3cccc(Oc4cc[nH+]cc4)c3)C2)cc1 ZINC000558303035 568468545 /nfs/dbraw/zinc/46/85/45/568468545.db2.gz JZWSENSJEMTKMW-OAQYLSRUSA-N 1 2 372.468 5.066 20 0 FKADLO CCc1ccc([C@H]2CCN(C(=O)c3ccccc3Oc3cc[nH+]cc3)C2)cc1 ZINC000558304107 568468550 /nfs/dbraw/zinc/46/85/50/568468550.db2.gz OEVNARCWHMEVDY-FQEVSTJZSA-N 1 2 372.468 5.066 20 0 FKADLO CCc1ccc([C@@H]2CCN(C(=O)c3ccccc3Oc3cc[nH+]cc3)C2)cc1 ZINC000558304113 568468561 /nfs/dbraw/zinc/46/85/61/568468561.db2.gz OEVNARCWHMEVDY-HXUWFJFHSA-N 1 2 372.468 5.066 20 0 FKADLO Cc1ccc(C(=O)Nc2ncsc2C(C)C)cc1Oc1cc[nH+]cc1 ZINC000558338672 568471022 /nfs/dbraw/zinc/47/10/22/568471022.db2.gz ANTPZBYMVIJIOH-UHFFFAOYSA-N 1 2 353.447 5.015 20 0 FKADLO COc1ccc([C@H]([NH2+]Cc2cc(Cl)sc2Cl)c2ccco2)cc1 ZINC000558340375 568471152 /nfs/dbraw/zinc/47/11/52/568471152.db2.gz LRXIZRMBKSEYQQ-INIZCTEOSA-N 1 2 368.285 5.536 20 0 FKADLO COc1ccc([C@@H]([NH2+]Cc2cc(Cl)sc2Cl)c2ccco2)cc1 ZINC000558340381 568471128 /nfs/dbraw/zinc/47/11/28/568471128.db2.gz LRXIZRMBKSEYQQ-MRXNPFEDSA-N 1 2 368.285 5.536 20 0 FKADLO C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C1 ZINC000558341818 568471134 /nfs/dbraw/zinc/47/11/34/568471134.db2.gz UMPYGGNCHCKXNI-DYESRHJHSA-N 1 2 374.488 5.092 20 0 FKADLO C[C@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C1 ZINC000558341821 568471119 /nfs/dbraw/zinc/47/11/19/568471119.db2.gz UMPYGGNCHCKXNI-LAUBAEHRSA-N 1 2 374.488 5.092 20 0 FKADLO C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C1 ZINC000558341824 568471124 /nfs/dbraw/zinc/47/11/24/568471124.db2.gz UMPYGGNCHCKXNI-UTKZUKDTSA-N 1 2 374.488 5.092 20 0 FKADLO C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C1 ZINC000558341828 568471195 /nfs/dbraw/zinc/47/11/95/568471195.db2.gz UMPYGGNCHCKXNI-UWJYYQICSA-N 1 2 374.488 5.092 20 0 FKADLO Cc1cc(OCC(=O)Nc2c(C)cccc2C(C)C)c2cccc(C)c2[nH+]1 ZINC000558345067 568471327 /nfs/dbraw/zinc/47/13/27/568471327.db2.gz QGUDGKYWDQNSMF-UHFFFAOYSA-N 1 2 362.473 5.301 20 0 FKADLO Cc1oc2ccccc2c1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000558393530 568479872 /nfs/dbraw/zinc/47/98/72/568479872.db2.gz PRZLWPRSWOTKBL-UHFFFAOYSA-N 1 2 371.440 5.193 20 0 FKADLO COc1ccccc1C[N@@H+](Cc1cccs1)Cc1ccc(Cl)cn1 ZINC000558408666 568480028 /nfs/dbraw/zinc/48/00/28/568480028.db2.gz PEFUHVOABKPGAK-UHFFFAOYSA-N 1 2 358.894 5.008 20 0 FKADLO COc1ccccc1C[N@H+](Cc1cccs1)Cc1ccc(Cl)cn1 ZINC000558408666 568480027 /nfs/dbraw/zinc/48/00/27/568480027.db2.gz PEFUHVOABKPGAK-UHFFFAOYSA-N 1 2 358.894 5.008 20 0 FKADLO CC[N@@H+](Cc1csc(COc2ccc(C)cc2)n1)[C@@H](C)c1cccnc1 ZINC000558424061 568480409 /nfs/dbraw/zinc/48/04/09/568480409.db2.gz ULBAFFQHFGEQIT-KRWDZBQOSA-N 1 2 367.518 5.009 20 0 FKADLO CC[N@H+](Cc1csc(COc2ccc(C)cc2)n1)[C@@H](C)c1cccnc1 ZINC000558424061 568480408 /nfs/dbraw/zinc/48/04/08/568480408.db2.gz ULBAFFQHFGEQIT-KRWDZBQOSA-N 1 2 367.518 5.009 20 0 FKADLO CC[N@@H+](Cc1csc(COc2ccc(C)cc2)n1)[C@H](C)c1cccnc1 ZINC000558424062 568480419 /nfs/dbraw/zinc/48/04/19/568480419.db2.gz ULBAFFQHFGEQIT-QGZVFWFLSA-N 1 2 367.518 5.009 20 0 FKADLO CC[N@H+](Cc1csc(COc2ccc(C)cc2)n1)[C@H](C)c1cccnc1 ZINC000558424062 568480418 /nfs/dbraw/zinc/48/04/18/568480418.db2.gz ULBAFFQHFGEQIT-QGZVFWFLSA-N 1 2 367.518 5.009 20 0 FKADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1cccc(OCc2ccccc2)c1 ZINC000558460333 568480749 /nfs/dbraw/zinc/48/07/49/568480749.db2.gz YDFAYMARAFGKHA-KRWDZBQOSA-N 1 2 364.489 5.402 20 0 FKADLO CCCC[C@H]([NH2+]Cc1nnc(CC)s1)c1ccc(Cl)cc1Cl ZINC000558500991 568481577 /nfs/dbraw/zinc/48/15/77/568481577.db2.gz ITLSNCMHTMCYCY-AWEZNQCLSA-N 1 2 358.338 5.428 20 0 FKADLO CCCC[C@@H]([NH2+]Cc1nnc(CC)s1)c1ccc(Cl)cc1Cl ZINC000558500997 568481553 /nfs/dbraw/zinc/48/15/53/568481553.db2.gz ITLSNCMHTMCYCY-CQSZACIVSA-N 1 2 358.338 5.428 20 0 FKADLO CCc1cccc(NC(=O)CCn2c3ccccc3[nH+]c2C2CC2)c1CC ZINC000558569235 568482561 /nfs/dbraw/zinc/48/25/61/568482561.db2.gz IMEWBYPQCBGLIO-UHFFFAOYSA-N 1 2 361.489 5.067 20 0 FKADLO C[C@H]1C[C@@]1([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627943 568483587 /nfs/dbraw/zinc/48/35/87/568483587.db2.gz LNAXRYJSSFYYCK-RBZFPXEDSA-N 1 2 356.828 5.159 20 0 FKADLO C[C@H]1C[C@]1([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627945 568483547 /nfs/dbraw/zinc/48/35/47/568483547.db2.gz LNAXRYJSSFYYCK-RNODOKPDSA-N 1 2 356.828 5.159 20 0 FKADLO C[C@@H]1C[C@@]1([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627947 568483558 /nfs/dbraw/zinc/48/35/58/568483558.db2.gz LNAXRYJSSFYYCK-XCLFUZPHSA-N 1 2 356.828 5.159 20 0 FKADLO C[C@@H]1C[C@]1([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccc(Cl)cc1 ZINC000558627950 568483564 /nfs/dbraw/zinc/48/35/64/568483564.db2.gz LNAXRYJSSFYYCK-ZUOKHONESA-N 1 2 356.828 5.159 20 0 FKADLO CCC(CC)N(C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000558663779 568475240 /nfs/dbraw/zinc/47/52/40/568475240.db2.gz GAOCFVJYFYZLQT-UHFFFAOYSA-N 1 2 366.509 5.071 20 0 FKADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)[C@H]1CCCc2ccccc21 ZINC000558670539 568475484 /nfs/dbraw/zinc/47/54/84/568475484.db2.gz KEXNLEOLSZDFFF-NRFANRHFSA-N 1 2 358.441 5.024 20 0 FKADLO Cc1cc(OC(C)C)ccc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000558688429 568475580 /nfs/dbraw/zinc/47/55/80/568475580.db2.gz JZVBQBYOKIBRHB-UHFFFAOYSA-N 1 2 362.429 5.222 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(OC3CCCCC3)nc2)cs1 ZINC000558694529 568475635 /nfs/dbraw/zinc/47/56/35/568475635.db2.gz DMTBWSPAVQODMH-HNNXBMFYSA-N 1 2 359.539 5.224 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(OC3CCCCC3)nc2)cs1 ZINC000558694531 568475676 /nfs/dbraw/zinc/47/56/76/568475676.db2.gz DMTBWSPAVQODMH-OAHLLOKOSA-N 1 2 359.539 5.224 20 0 FKADLO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1nc(-c2cccc(F)c2)no1 ZINC000558723176 568475893 /nfs/dbraw/zinc/47/58/93/568475893.db2.gz KRPWSNSCQWUFGU-MRXNPFEDSA-N 1 2 373.431 5.316 20 0 FKADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000558723373 568475928 /nfs/dbraw/zinc/47/59/28/568475928.db2.gz AACHYRLBIRVRBC-JTQLQIEISA-N 1 2 354.306 5.004 20 0 FKADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000558723373 568475927 /nfs/dbraw/zinc/47/59/27/568475927.db2.gz AACHYRLBIRVRBC-JTQLQIEISA-N 1 2 354.306 5.004 20 0 FKADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000558723374 568475861 /nfs/dbraw/zinc/47/58/61/568475861.db2.gz AACHYRLBIRVRBC-SNVBAGLBSA-N 1 2 354.306 5.004 20 0 FKADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000558723374 568475859 /nfs/dbraw/zinc/47/58/59/568475859.db2.gz AACHYRLBIRVRBC-SNVBAGLBSA-N 1 2 354.306 5.004 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000558725842 568475851 /nfs/dbraw/zinc/47/58/51/568475851.db2.gz QCUGYHSWOUDQSP-CYBMUJFWSA-N 1 2 367.449 5.283 20 0 FKADLO C[C@H](c1nnc(-c2ccccc2F)s1)[N@H+](C)Cc1cc2ccccc2o1 ZINC000558725842 568475849 /nfs/dbraw/zinc/47/58/49/568475849.db2.gz QCUGYHSWOUDQSP-CYBMUJFWSA-N 1 2 367.449 5.283 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000558725851 568475923 /nfs/dbraw/zinc/47/59/23/568475923.db2.gz QCUGYHSWOUDQSP-ZDUSSCGKSA-N 1 2 367.449 5.283 20 0 FKADLO C[C@@H](c1nnc(-c2ccccc2F)s1)[N@H+](C)Cc1cc2ccccc2o1 ZINC000558725851 568475922 /nfs/dbraw/zinc/47/59/22/568475922.db2.gz QCUGYHSWOUDQSP-ZDUSSCGKSA-N 1 2 367.449 5.283 20 0 FKADLO C[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1nc(C(C)(C)C)cs1 ZINC000558728818 568476088 /nfs/dbraw/zinc/47/60/88/568476088.db2.gz IJZLXYCNIUUFGX-GHMZBOCLSA-N 1 2 368.344 5.010 20 0 FKADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccc(Br)cn1 ZINC000558728822 568476103 /nfs/dbraw/zinc/47/61/03/568476103.db2.gz IJZLXYCNIUUFGX-MNOVXSKESA-N 1 2 368.344 5.010 20 0 FKADLO C[C@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1nc(C(C)(C)C)cs1 ZINC000558728824 568476050 /nfs/dbraw/zinc/47/60/50/568476050.db2.gz IJZLXYCNIUUFGX-QWRGUYRKSA-N 1 2 368.344 5.010 20 0 FKADLO Cc1ccc(C)c(C[N@H+](C)[C@@H](C)c2nnc(-c3ccccc3F)s2)c1 ZINC000558734177 568476158 /nfs/dbraw/zinc/47/61/58/568476158.db2.gz FZHIWVCRTGAXRF-HNNXBMFYSA-N 1 2 355.482 5.154 20 0 FKADLO Cc1ccc(C)c(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccccc3F)s2)c1 ZINC000558734177 568476156 /nfs/dbraw/zinc/47/61/56/568476156.db2.gz FZHIWVCRTGAXRF-HNNXBMFYSA-N 1 2 355.482 5.154 20 0 FKADLO Cc1ccc(C)c(C[N@H+](C)[C@H](C)c2nnc(-c3ccccc3F)s2)c1 ZINC000558734178 568476184 /nfs/dbraw/zinc/47/61/84/568476184.db2.gz FZHIWVCRTGAXRF-OAHLLOKOSA-N 1 2 355.482 5.154 20 0 FKADLO Cc1ccc(C)c(C[N@@H+](C)[C@H](C)c2nnc(-c3ccccc3F)s2)c1 ZINC000558734178 568476183 /nfs/dbraw/zinc/47/61/83/568476183.db2.gz FZHIWVCRTGAXRF-OAHLLOKOSA-N 1 2 355.482 5.154 20 0 FKADLO O=C(Nc1cccc(NC2CCCC2)c1)c1ccccc1Oc1cc[nH+]cc1 ZINC000558749741 568476469 /nfs/dbraw/zinc/47/64/69/568476469.db2.gz SPPHPKUVRJLEJW-UHFFFAOYSA-N 1 2 373.456 5.481 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2ccccc2Cl)n1C ZINC000558807260 568477709 /nfs/dbraw/zinc/47/77/09/568477709.db2.gz GNJYUEJVISQWFA-UHFFFAOYSA-N 1 2 372.925 5.255 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc2sc3ccccc3n12 ZINC000558807441 568477711 /nfs/dbraw/zinc/47/77/11/568477711.db2.gz NJEMHTXYVAXXAW-UHFFFAOYSA-N 1 2 354.504 5.063 20 0 FKADLO CCn1c(SCc2ccc(C(C)C)[nH+]c2C)nnc1-c1ccccc1 ZINC000558807769 568477728 /nfs/dbraw/zinc/47/77/28/568477728.db2.gz NNCKUBCSTPIMFY-UHFFFAOYSA-N 1 2 352.507 5.084 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nncn1-c1cccc(Cl)c1 ZINC000558809552 568477922 /nfs/dbraw/zinc/47/79/22/568477922.db2.gz KFUSAVIXPNYZIE-UHFFFAOYSA-N 1 2 358.898 5.040 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2ccccc2Cl)o1 ZINC000558825373 568478257 /nfs/dbraw/zinc/47/82/57/568478257.db2.gz HYXOQDNBRGRRAR-UHFFFAOYSA-N 1 2 359.882 5.509 20 0 FKADLO Cc1nnc(SCc2ccc(C(C)C)[nH+]c2C)n1CCc1cccs1 ZINC000558826539 568478358 /nfs/dbraw/zinc/47/83/58/568478358.db2.gz ZGBHAVXNPLMGOU-UHFFFAOYSA-N 1 2 372.563 5.010 20 0 FKADLO CCOc1ccccc1-c1nnc(SCc2ccc(C(C)C)[nH+]c2C)o1 ZINC000558826874 568478415 /nfs/dbraw/zinc/47/84/15/568478415.db2.gz NIODRMTVRDADCV-UHFFFAOYSA-N 1 2 369.490 5.254 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(-c2cc3ccccc3o2)o1 ZINC000558846226 568478902 /nfs/dbraw/zinc/47/89/02/568478902.db2.gz IFWYJMMRWUOCHJ-UHFFFAOYSA-N 1 2 365.458 5.602 20 0 FKADLO Cc1[nH+]c(C(C)C)ccc1CSc1nc(-c2ccccc2)c(C)c(=O)[nH]1 ZINC000558850825 568479123 /nfs/dbraw/zinc/47/91/23/568479123.db2.gz YVGJWWIGGRQWKF-UHFFFAOYSA-N 1 2 365.502 5.277 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000559131075 568485748 /nfs/dbraw/zinc/48/57/48/568485748.db2.gz GMXVOMMSQSSAEZ-FQEVSTJZSA-N 1 2 351.519 5.103 20 0 FKADLO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000559131086 568485685 /nfs/dbraw/zinc/48/56/85/568485685.db2.gz GMXVOMMSQSSAEZ-HXUWFJFHSA-N 1 2 351.519 5.103 20 0 FKADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000559187838 568486756 /nfs/dbraw/zinc/48/67/56/568486756.db2.gz QRZPWQQOBYNGAA-GOSISDBHSA-N 1 2 358.555 5.134 20 0 FKADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000559187842 568486825 /nfs/dbraw/zinc/48/68/25/568486825.db2.gz QRZPWQQOBYNGAA-SFHVURJKSA-N 1 2 358.555 5.134 20 0 FKADLO CSCc1cnc(C[NH2+]Cc2ccccc2Oc2cccc(F)c2)s1 ZINC000559268754 568487143 /nfs/dbraw/zinc/48/71/43/568487143.db2.gz GNQBSWZINKNHCA-UHFFFAOYSA-N 1 2 374.506 5.227 20 0 FKADLO Cc1ccccc1-c1cnc(C[NH+]2CCC(c3ncccc3Cl)CC2)o1 ZINC000559272943 568495445 /nfs/dbraw/zinc/49/54/45/568495445.db2.gz ALOOCVIUBVQLJF-UHFFFAOYSA-N 1 2 367.880 5.078 20 0 FKADLO CSCc1cnc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)s1 ZINC000559281766 568495676 /nfs/dbraw/zinc/49/56/76/568495676.db2.gz QKVJRTCETFSALH-UHFFFAOYSA-N 1 2 368.571 5.502 20 0 FKADLO c1onc(Cc2ccccc2)c1CNc1cccc([NH+]2CCCCCC2)c1 ZINC000559282501 568495770 /nfs/dbraw/zinc/49/57/70/568495770.db2.gz XNZWDCKQSLCVJC-UHFFFAOYSA-N 1 2 361.489 5.258 20 0 FKADLO Cc1ccc(-c2ccc(C[N@@H+](Cc3nnc(C(C)C)o3)C(C)C)s2)cc1 ZINC000559286597 568495830 /nfs/dbraw/zinc/49/58/30/568495830.db2.gz PHYDLWAKFMFRSW-UHFFFAOYSA-N 1 2 369.534 5.641 20 0 FKADLO Cc1ccc(-c2ccc(C[N@H+](Cc3nnc(C(C)C)o3)C(C)C)s2)cc1 ZINC000559286597 568495829 /nfs/dbraw/zinc/49/58/29/568495829.db2.gz PHYDLWAKFMFRSW-UHFFFAOYSA-N 1 2 369.534 5.641 20 0 FKADLO CSCc1cnc(C[NH2+]C(c2ccccc2C)c2ccccc2C)s1 ZINC000559294933 568496015 /nfs/dbraw/zinc/49/60/15/568496015.db2.gz LWPSATXNAOYOHG-UHFFFAOYSA-N 1 2 368.571 5.502 20 0 FKADLO Cc1ccc2snc(C(=O)Nc3ccc(Oc4cc[nH+]cc4)cc3)c2c1 ZINC000559339148 568490107 /nfs/dbraw/zinc/49/01/07/568490107.db2.gz AHOBZEPDKWENAZ-UHFFFAOYSA-N 1 2 361.426 5.044 20 0 FKADLO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000559376059 568490887 /nfs/dbraw/zinc/49/08/87/568490887.db2.gz DPXWXDYGEMRORW-HNNXBMFYSA-N 1 2 355.507 5.423 20 0 FKADLO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000559376059 568490886 /nfs/dbraw/zinc/49/08/86/568490886.db2.gz DPXWXDYGEMRORW-HNNXBMFYSA-N 1 2 355.507 5.423 20 0 FKADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000559376060 568490869 /nfs/dbraw/zinc/49/08/69/568490869.db2.gz DPXWXDYGEMRORW-OAHLLOKOSA-N 1 2 355.507 5.423 20 0 FKADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000559376060 568490868 /nfs/dbraw/zinc/49/08/68/568490868.db2.gz DPXWXDYGEMRORW-OAHLLOKOSA-N 1 2 355.507 5.423 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000559517154 568492732 /nfs/dbraw/zinc/49/27/32/568492732.db2.gz JTRASAXLTVAOEV-KRWDZBQOSA-N 1 2 363.288 5.077 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000559517154 568492730 /nfs/dbraw/zinc/49/27/30/568492730.db2.gz JTRASAXLTVAOEV-KRWDZBQOSA-N 1 2 363.288 5.077 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000559517155 568492672 /nfs/dbraw/zinc/49/26/72/568492672.db2.gz JTRASAXLTVAOEV-QGZVFWFLSA-N 1 2 363.288 5.077 20 0 FKADLO Cc1cccc(Cl)c1NC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000559517155 568492671 /nfs/dbraw/zinc/49/26/71/568492671.db2.gz JTRASAXLTVAOEV-QGZVFWFLSA-N 1 2 363.288 5.077 20 0 FKADLO Cc1ccc(C)c(NC(=O)C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000559559970 568493476 /nfs/dbraw/zinc/49/34/76/568493476.db2.gz XAHGNCREVBICQU-INIZCTEOSA-N 1 2 356.897 5.121 20 0 FKADLO Cc1ccc(C)c(NC(=O)C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000559559970 568493475 /nfs/dbraw/zinc/49/34/75/568493475.db2.gz XAHGNCREVBICQU-INIZCTEOSA-N 1 2 356.897 5.121 20 0 FKADLO C[C@H]([NH2+][C@H](c1nccn1C)c1ccc(Cl)cc1)c1cccc(C2CC2)c1 ZINC000559734928 568494778 /nfs/dbraw/zinc/49/47/78/568494778.db2.gz RRNNULNDZHFWNG-BTYIYWSLSA-N 1 2 365.908 5.391 20 0 FKADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(Cl)cc1)c1cccc(C2CC2)c1 ZINC000559734929 568495035 /nfs/dbraw/zinc/49/50/35/568495035.db2.gz RRNNULNDZHFWNG-QVKFZJNVSA-N 1 2 365.908 5.391 20 0 FKADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccc(Cl)cc1)c1cccc(C2CC2)c1 ZINC000559734930 568495073 /nfs/dbraw/zinc/49/50/73/568495073.db2.gz RRNNULNDZHFWNG-VFNWGFHPSA-N 1 2 365.908 5.391 20 0 FKADLO C[C@H]([NH2+][C@@H](c1nccn1C)c1ccc(Cl)cc1)c1cccc(C2CC2)c1 ZINC000559734931 568495020 /nfs/dbraw/zinc/49/50/20/568495020.db2.gz RRNNULNDZHFWNG-YCRPNKLZSA-N 1 2 365.908 5.391 20 0 FKADLO CSc1ccccc1[C@H](C)[NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000559738112 568495087 /nfs/dbraw/zinc/49/50/87/568495087.db2.gz GECIMRXGSSXLOV-ZDUSSCGKSA-N 1 2 358.894 5.568 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@H+](C)Cc2ccccc2C(F)(F)F)o1 ZINC000559745920 568495217 /nfs/dbraw/zinc/49/52/17/568495217.db2.gz YPNHNARMQINPJT-UHFFFAOYSA-N 1 2 360.379 5.301 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)o1 ZINC000559745920 568495216 /nfs/dbraw/zinc/49/52/16/568495216.db2.gz YPNHNARMQINPJT-UHFFFAOYSA-N 1 2 360.379 5.301 20 0 FKADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000559846863 568498422 /nfs/dbraw/zinc/49/84/22/568498422.db2.gz OXAITKPTEMPWEW-GOSISDBHSA-N 1 2 374.406 5.742 20 0 FKADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000559846864 568498427 /nfs/dbraw/zinc/49/84/27/568498427.db2.gz OXAITKPTEMPWEW-SFHVURJKSA-N 1 2 374.406 5.742 20 0 FKADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(OC(C)(C)C)cc2C(F)(F)F)no1 ZINC000559902412 568501401 /nfs/dbraw/zinc/50/14/01/568501401.db2.gz SMBVAFFSYRAIDE-GFCCVEGCSA-N 1 2 356.388 5.030 20 0 FKADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(OC(C)(C)C)cc2C(F)(F)F)no1 ZINC000559902417 568501511 /nfs/dbraw/zinc/50/15/11/568501511.db2.gz SMBVAFFSYRAIDE-LBPRGKRZSA-N 1 2 356.388 5.030 20 0 FKADLO C[C@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1cn2ccccc2n1 ZINC000559905740 568501440 /nfs/dbraw/zinc/50/14/40/568501440.db2.gz ZEDVOOBGHHRDDY-AWEZNQCLSA-N 1 2 374.469 5.055 20 0 FKADLO C[C@@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1cn2ccccc2n1 ZINC000559905741 568501502 /nfs/dbraw/zinc/50/15/02/568501502.db2.gz ZEDVOOBGHHRDDY-CQSZACIVSA-N 1 2 374.469 5.055 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915067 568502282 /nfs/dbraw/zinc/50/22/82/568502282.db2.gz DCTDPZYDWUWZCD-LHSJRXKWSA-N 1 2 370.855 5.323 20 0 FKADLO COc1ccc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915073 568502175 /nfs/dbraw/zinc/50/21/75/568502175.db2.gz DCTDPZYDWUWZCD-QKKBWIMNSA-N 1 2 370.855 5.323 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915075 568502280 /nfs/dbraw/zinc/50/22/80/568502280.db2.gz DCTDPZYDWUWZCD-SPLOXXLWSA-N 1 2 370.855 5.323 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccccc2Cl)cc1 ZINC000559915077 568502213 /nfs/dbraw/zinc/50/22/13/568502213.db2.gz DCTDPZYDWUWZCD-SZNDQCEHSA-N 1 2 370.855 5.323 20 0 FKADLO Cc1sc(C2([NH2+][C@H](C)c3nccs3)CCC2)nc1-c1ccccc1F ZINC000559919997 568502759 /nfs/dbraw/zinc/50/27/59/568502759.db2.gz VAOYVWHQWSMGAJ-GFCCVEGCSA-N 1 2 373.522 5.444 20 0 FKADLO Cc1sc(C2([NH2+][C@@H](C)c3nccs3)CCC2)nc1-c1ccccc1F ZINC000559920002 568502816 /nfs/dbraw/zinc/50/28/16/568502816.db2.gz VAOYVWHQWSMGAJ-LBPRGKRZSA-N 1 2 373.522 5.444 20 0 FKADLO CCOc1ccc([C@H]([NH2+][C@@H](C)c2cc(C)on2)c2cccc(Cl)c2)cc1 ZINC000559920939 568502820 /nfs/dbraw/zinc/50/28/20/568502820.db2.gz CDKOCOCANJKQJA-BTYIYWSLSA-N 1 2 370.880 5.475 20 0 FKADLO CCOc1ccc([C@@H]([NH2+][C@H](C)c2cc(C)on2)c2cccc(Cl)c2)cc1 ZINC000559920940 568502829 /nfs/dbraw/zinc/50/28/29/568502829.db2.gz CDKOCOCANJKQJA-QVKFZJNVSA-N 1 2 370.880 5.475 20 0 FKADLO CCOc1ccc([C@H]([NH2+][C@H](C)c2cc(C)on2)c2cccc(Cl)c2)cc1 ZINC000559920941 568502824 /nfs/dbraw/zinc/50/28/24/568502824.db2.gz CDKOCOCANJKQJA-VFNWGFHPSA-N 1 2 370.880 5.475 20 0 FKADLO CCOc1ccc([C@@H]([NH2+][C@@H](C)c2cc(C)on2)c2cccc(Cl)c2)cc1 ZINC000559920942 568502766 /nfs/dbraw/zinc/50/27/66/568502766.db2.gz CDKOCOCANJKQJA-YCRPNKLZSA-N 1 2 370.880 5.475 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)no1 ZINC000559921850 568502808 /nfs/dbraw/zinc/50/28/08/568502808.db2.gz MVKSNDVFHZVFSF-AUUYWEPGSA-N 1 2 371.278 5.186 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)no1 ZINC000559921853 568502826 /nfs/dbraw/zinc/50/28/26/568502826.db2.gz MVKSNDVFHZVFSF-IFXJQAMLSA-N 1 2 371.278 5.186 20 0 FKADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)no1 ZINC000559921855 568502801 /nfs/dbraw/zinc/50/28/01/568502801.db2.gz MVKSNDVFHZVFSF-KUHUBIRLSA-N 1 2 371.278 5.186 20 0 FKADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)no1 ZINC000559921857 568502818 /nfs/dbraw/zinc/50/28/18/568502818.db2.gz MVKSNDVFHZVFSF-LIRRHRJNSA-N 1 2 371.278 5.186 20 0 FKADLO Cc1cc([C@@H](C)[NH2+]C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)no1 ZINC000559921927 568502822 /nfs/dbraw/zinc/50/28/22/568502822.db2.gz OGJMTAJADQKSOY-CYBMUJFWSA-N 1 2 361.272 5.730 20 0 FKADLO Cc1cc([C@H](C)[NH2+]C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)no1 ZINC000559921928 568502739 /nfs/dbraw/zinc/50/27/39/568502739.db2.gz OGJMTAJADQKSOY-ZDUSSCGKSA-N 1 2 361.272 5.730 20 0 FKADLO Cc1cscc1C[NH2+][C@H](C(=O)c1c[nH]c2ccccc21)c1ccccc1 ZINC000559973361 568506926 /nfs/dbraw/zinc/50/69/26/568506926.db2.gz CIUWYZLCDVIOGE-NRFANRHFSA-N 1 2 360.482 5.252 20 0 FKADLO Cc1cscc1C[NH2+][C@@H](C(=O)c1c[nH]c2ccccc21)c1ccccc1 ZINC000559973362 568506928 /nfs/dbraw/zinc/50/69/28/568506928.db2.gz CIUWYZLCDVIOGE-OAQYLSRUSA-N 1 2 360.482 5.252 20 0 FKADLO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1csc(-c2cccs2)n1 ZINC000560026923 568504854 /nfs/dbraw/zinc/50/48/54/568504854.db2.gz WKDDDPMTJZWMEU-UHFFFAOYSA-N 1 2 370.474 5.561 20 0 FKADLO Cc1ccc2nc(C[NH2+][C@H](c3cccs3)c3ccc(Cl)cc3)cn2c1 ZINC000560050576 568514153 /nfs/dbraw/zinc/51/41/53/568514153.db2.gz RORCLAJQUIZCMK-FQEVSTJZSA-N 1 2 367.905 5.237 20 0 FKADLO Cc1ccc2nc(C[NH2+][C@@H](c3cccs3)c3ccc(Cl)cc3)cn2c1 ZINC000560050577 568514113 /nfs/dbraw/zinc/51/41/13/568514113.db2.gz RORCLAJQUIZCMK-HXUWFJFHSA-N 1 2 367.905 5.237 20 0 FKADLO CC(C)COc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000560165164 568523428 /nfs/dbraw/zinc/52/34/28/568523428.db2.gz DKZCNTNXARLKAC-DLBZAZTESA-N 1 2 365.477 5.183 20 0 FKADLO CC(C)COc1ccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000560165536 568523388 /nfs/dbraw/zinc/52/33/88/568523388.db2.gz DKZCNTNXARLKAC-IAGOWNOFSA-N 1 2 365.477 5.183 20 0 FKADLO CC(C)COc1ccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000560165538 568523539 /nfs/dbraw/zinc/52/35/39/568523539.db2.gz DKZCNTNXARLKAC-IRXDYDNUSA-N 1 2 365.477 5.183 20 0 FKADLO CC(C)COc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000560165540 568523462 /nfs/dbraw/zinc/52/34/62/568523462.db2.gz DKZCNTNXARLKAC-SJORKVTESA-N 1 2 365.477 5.183 20 0 FKADLO C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(CC(F)(F)F)CC1 ZINC000560166210 568523475 /nfs/dbraw/zinc/52/34/75/568523475.db2.gz DQIYIUQKDYWQOE-NSHDSACASA-N 1 2 373.806 5.115 20 0 FKADLO FC(F)(F)c1cccc(C2([NH2+]Cc3csc(-c4ccccc4)n3)CC2)c1 ZINC000560167066 568523549 /nfs/dbraw/zinc/52/35/49/568523549.db2.gz UCUVOHFLWPYQOG-UHFFFAOYSA-N 1 2 374.431 5.608 20 0 FKADLO CC(C)C[N@@H+](Cc1nnc(C2CC2)n1C1CC1)[C@@H](C)c1ccccc1Cl ZINC000560178320 568524576 /nfs/dbraw/zinc/52/45/76/568524576.db2.gz JQAKWABQSMKDDC-HNNXBMFYSA-N 1 2 372.944 5.363 20 0 FKADLO CC(C)C[N@H+](Cc1nnc(C2CC2)n1C1CC1)[C@@H](C)c1ccccc1Cl ZINC000560178320 568524574 /nfs/dbraw/zinc/52/45/74/568524574.db2.gz JQAKWABQSMKDDC-HNNXBMFYSA-N 1 2 372.944 5.363 20 0 FKADLO CC(C)C[N@@H+](Cc1nnc(C2CC2)n1C1CC1)[C@H](C)c1ccccc1Cl ZINC000560178321 568524615 /nfs/dbraw/zinc/52/46/15/568524615.db2.gz JQAKWABQSMKDDC-OAHLLOKOSA-N 1 2 372.944 5.363 20 0 FKADLO CC(C)C[N@H+](Cc1nnc(C2CC2)n1C1CC1)[C@H](C)c1ccccc1Cl ZINC000560178321 568524614 /nfs/dbraw/zinc/52/46/14/568524614.db2.gz JQAKWABQSMKDDC-OAHLLOKOSA-N 1 2 372.944 5.363 20 0 FKADLO COCc1nc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)cs1 ZINC000560182563 568524725 /nfs/dbraw/zinc/52/47/25/568524725.db2.gz MFTXRZPTMQHQIT-AWEZNQCLSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1nc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)cs1 ZINC000560182563 568524723 /nfs/dbraw/zinc/52/47/23/568524723.db2.gz MFTXRZPTMQHQIT-AWEZNQCLSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1nc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)cs1 ZINC000560182569 568524693 /nfs/dbraw/zinc/52/46/93/568524693.db2.gz MFTXRZPTMQHQIT-CQSZACIVSA-N 1 2 352.931 5.162 20 0 FKADLO COCc1nc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)cs1 ZINC000560182569 568524691 /nfs/dbraw/zinc/52/46/91/568524691.db2.gz MFTXRZPTMQHQIT-CQSZACIVSA-N 1 2 352.931 5.162 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@]2(c3ccccc3)CCCCC2=O)o1 ZINC000560193114 568524981 /nfs/dbraw/zinc/52/49/81/568524981.db2.gz UGZIUPVYMBQNAQ-DEOSSOPVSA-N 1 2 374.484 5.120 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@]2(c3ccccc3)CCCCC2=O)o1 ZINC000560193114 568524980 /nfs/dbraw/zinc/52/49/80/568524980.db2.gz UGZIUPVYMBQNAQ-DEOSSOPVSA-N 1 2 374.484 5.120 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@]2(c3ccccc3)CCCCC2=O)o1 ZINC000560193115 568524936 /nfs/dbraw/zinc/52/49/36/568524936.db2.gz UGZIUPVYMBQNAQ-XMMPIXPASA-N 1 2 374.484 5.120 20 0 FKADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@@]2(c3ccccc3)CCCCC2=O)o1 ZINC000560193115 568524935 /nfs/dbraw/zinc/52/49/35/568524935.db2.gz UGZIUPVYMBQNAQ-XMMPIXPASA-N 1 2 374.484 5.120 20 0 FKADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3)cn2)cc1 ZINC000560235535 568526910 /nfs/dbraw/zinc/52/69/10/568526910.db2.gz IVXQPWOUOVUMJL-GOSISDBHSA-N 1 2 361.489 5.173 20 0 FKADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2ncc(-c3ccccc3)cn2)cc1 ZINC000560235536 568527005 /nfs/dbraw/zinc/52/70/05/568527005.db2.gz IVXQPWOUOVUMJL-SFHVURJKSA-N 1 2 361.489 5.173 20 0 FKADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000560239426 568527132 /nfs/dbraw/zinc/52/71/32/568527132.db2.gz ROVUBRAHXGUPHS-GFCCVEGCSA-N 1 2 370.547 5.007 20 0 FKADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000560239431 568527098 /nfs/dbraw/zinc/52/70/98/568527098.db2.gz ROVUBRAHXGUPHS-LBPRGKRZSA-N 1 2 370.547 5.007 20 0 FKADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000560245904 568527680 /nfs/dbraw/zinc/52/76/80/568527680.db2.gz LQCSFHPNWYOWFB-DYESRHJHSA-N 1 2 366.530 5.762 20 0 FKADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000560245905 568527615 /nfs/dbraw/zinc/52/76/15/568527615.db2.gz LQCSFHPNWYOWFB-LAUBAEHRSA-N 1 2 366.530 5.762 20 0 FKADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000560245906 568527666 /nfs/dbraw/zinc/52/76/66/568527666.db2.gz LQCSFHPNWYOWFB-UTKZUKDTSA-N 1 2 366.530 5.762 20 0 FKADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000560245907 568527654 /nfs/dbraw/zinc/52/76/54/568527654.db2.gz LQCSFHPNWYOWFB-UWJYYQICSA-N 1 2 366.530 5.762 20 0 FKADLO CC(C)(C)c1ncc(C[N@H+]2CCc3sccc3[C@@H]2c2cccs2)cn1 ZINC000560257175 568522795 /nfs/dbraw/zinc/52/27/95/568522795.db2.gz MCRAFGOKDCKUJU-GOSISDBHSA-N 1 2 369.559 5.045 20 0 FKADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)cn1 ZINC000560257175 568522794 /nfs/dbraw/zinc/52/27/94/568522794.db2.gz MCRAFGOKDCKUJU-GOSISDBHSA-N 1 2 369.559 5.045 20 0 FKADLO CC(C)(C)c1ncc(C[N@H+]2CCc3sccc3[C@H]2c2cccs2)cn1 ZINC000560257179 568522749 /nfs/dbraw/zinc/52/27/49/568522749.db2.gz MCRAFGOKDCKUJU-SFHVURJKSA-N 1 2 369.559 5.045 20 0 FKADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3sccc3[C@H]2c2cccs2)cn1 ZINC000560257179 568522746 /nfs/dbraw/zinc/52/27/46/568522746.db2.gz MCRAFGOKDCKUJU-SFHVURJKSA-N 1 2 369.559 5.045 20 0 FKADLO C[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(-c2ccccc2)o1 ZINC000560264736 568529812 /nfs/dbraw/zinc/52/98/12/568529812.db2.gz GLVUCNOFEMQZLG-GOSISDBHSA-N 1 2 357.457 5.042 20 0 FKADLO C[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc(-c2ccccc2)o1 ZINC000560264737 568529769 /nfs/dbraw/zinc/52/97/69/568529769.db2.gz GLVUCNOFEMQZLG-SFHVURJKSA-N 1 2 357.457 5.042 20 0 FKADLO Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000560338545 568532303 /nfs/dbraw/zinc/53/23/03/568532303.db2.gz FYRCHSGGQZVDDV-HNNXBMFYSA-N 1 2 369.852 5.227 20 0 FKADLO Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000560338546 568532341 /nfs/dbraw/zinc/53/23/41/568532341.db2.gz FYRCHSGGQZVDDV-OAHLLOKOSA-N 1 2 369.852 5.227 20 0 FKADLO Cc1ccc(C)c(Sc2ccc(NC(=O)C[C@H](C)n3cc[nH+]c3)cc2)c1 ZINC000560338622 568532404 /nfs/dbraw/zinc/53/24/04/568532404.db2.gz MHXLNYYPYQDJKL-KRWDZBQOSA-N 1 2 365.502 5.241 20 0 FKADLO Cc1ccc(C)c(Sc2ccc(NC(=O)C[C@@H](C)n3cc[nH+]c3)cc2)c1 ZINC000560338623 568532938 /nfs/dbraw/zinc/53/29/38/568532938.db2.gz MHXLNYYPYQDJKL-QGZVFWFLSA-N 1 2 365.502 5.241 20 0 FKADLO Cc1ccc(Sc2ccc(NC(=O)C[C@H](C)n3cc[nH+]c3)cc2)c(C)c1 ZINC000560338946 568533185 /nfs/dbraw/zinc/53/31/85/568533185.db2.gz YRWYEFHOYNTKPS-KRWDZBQOSA-N 1 2 365.502 5.241 20 0 FKADLO Cc1ccc(Sc2ccc(NC(=O)C[C@@H](C)n3cc[nH+]c3)cc2)c(C)c1 ZINC000560338947 568533176 /nfs/dbraw/zinc/53/31/76/568533176.db2.gz YRWYEFHOYNTKPS-QGZVFWFLSA-N 1 2 365.502 5.241 20 0 FKADLO COc1ccc([C@H]([NH2+][C@@H](C)c2ccc(C)cc2OC)c2ccco2)cc1 ZINC000560346892 568537488 /nfs/dbraw/zinc/53/74/88/568537488.db2.gz VPQPBLQAGSURIR-AOMKIAJQSA-N 1 2 351.446 5.045 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccc(C)cc2OC)c2ccco2)cc1 ZINC000560346893 568537529 /nfs/dbraw/zinc/53/75/29/568537529.db2.gz VPQPBLQAGSURIR-KSFYIVLOSA-N 1 2 351.446 5.045 20 0 FKADLO COc1ccc([C@@H]([NH2+][C@H](C)c2ccc(C)cc2OC)c2ccco2)cc1 ZINC000560346894 568537513 /nfs/dbraw/zinc/53/75/13/568537513.db2.gz VPQPBLQAGSURIR-OPAMFIHVSA-N 1 2 351.446 5.045 20 0 FKADLO COc1ccc([C@H]([NH2+][C@H](C)c2ccc(C)cc2OC)c2ccco2)cc1 ZINC000560346895 568537518 /nfs/dbraw/zinc/53/75/18/568537518.db2.gz VPQPBLQAGSURIR-ZHRRBRCNSA-N 1 2 351.446 5.045 20 0 FKADLO FC1(F)CC(c2noc(Cn3c4ccccc4[nH+]c3C3CCCCC3)n2)C1 ZINC000560354735 568538081 /nfs/dbraw/zinc/53/80/81/568538081.db2.gz RZXDVGSKKLYXGL-UHFFFAOYSA-N 1 2 372.419 5.028 20 0 FKADLO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000560520735 568549127 /nfs/dbraw/zinc/54/91/27/568549127.db2.gz ZNDMMQAPSHNXHK-HTAPYJJXSA-N 1 2 365.496 5.198 20 0 FKADLO CC(C)Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000560520742 568549144 /nfs/dbraw/zinc/54/91/44/568549144.db2.gz ZNDMMQAPSHNXHK-JTSKRJEESA-N 1 2 365.496 5.198 20 0 FKADLO CC(C)Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000560520743 568549121 /nfs/dbraw/zinc/54/91/21/568549121.db2.gz ZNDMMQAPSHNXHK-VGOFRKELSA-N 1 2 365.496 5.198 20 0 FKADLO CC(C)Cc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000560520745 568549101 /nfs/dbraw/zinc/54/91/01/568549101.db2.gz ZNDMMQAPSHNXHK-VGSWGCGISA-N 1 2 365.496 5.198 20 0 FKADLO CSCc1cnc(C[N@H+]2CC[C@H](Sc3cccc(Cl)c3)C2)s1 ZINC000560532626 568550433 /nfs/dbraw/zinc/55/04/33/568550433.db2.gz DILHAVISGGCYSP-AWEZNQCLSA-N 1 2 370.996 5.026 20 0 FKADLO CSCc1cnc(C[N@@H+]2CC[C@H](Sc3cccc(Cl)c3)C2)s1 ZINC000560532626 568550431 /nfs/dbraw/zinc/55/04/31/568550431.db2.gz DILHAVISGGCYSP-AWEZNQCLSA-N 1 2 370.996 5.026 20 0 FKADLO CSCc1cnc(C[N@H+]2CC[C@@H](Sc3cccc(Cl)c3)C2)s1 ZINC000560532627 568550476 /nfs/dbraw/zinc/55/04/76/568550476.db2.gz DILHAVISGGCYSP-CQSZACIVSA-N 1 2 370.996 5.026 20 0 FKADLO CSCc1cnc(C[N@@H+]2CC[C@@H](Sc3cccc(Cl)c3)C2)s1 ZINC000560532627 568550475 /nfs/dbraw/zinc/55/04/75/568550475.db2.gz DILHAVISGGCYSP-CQSZACIVSA-N 1 2 370.996 5.026 20 0 FKADLO CCc1ccc(-c2nc(C[NH2+]C(C)(C)c3c(C)noc3C)cs2)cc1 ZINC000560539805 568545679 /nfs/dbraw/zinc/54/56/79/568545679.db2.gz HWLLOIVHXYRWDT-UHFFFAOYSA-N 1 2 355.507 5.002 20 0 FKADLO Cc1nc(-c2cccc(N[C@H](c3[nH]cc[nH+]3)C3CCCCC3)c2)cs1 ZINC000560545528 568547077 /nfs/dbraw/zinc/54/70/77/568547077.db2.gz WNPUAAYDXKEJQX-IBGZPJMESA-N 1 2 352.507 5.575 20 0 FKADLO Cc1nc(-c2cccc(N[C@@H](c3[nH]cc[nH+]3)C3CCCCC3)c2)cs1 ZINC000560545533 568547113 /nfs/dbraw/zinc/54/71/13/568547113.db2.gz WNPUAAYDXKEJQX-LJQANCHMSA-N 1 2 352.507 5.575 20 0 FKADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1NC(=O)C(C)(C)C ZINC000560549078 568547724 /nfs/dbraw/zinc/54/77/24/568547724.db2.gz NCUPXOJXDGTHDW-IBGZPJMESA-N 1 2 368.525 5.436 20 0 FKADLO Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1NC(=O)C(C)(C)C ZINC000560549091 568547793 /nfs/dbraw/zinc/54/77/93/568547793.db2.gz NCUPXOJXDGTHDW-LJQANCHMSA-N 1 2 368.525 5.436 20 0 FKADLO Cn1ccnc1[C@@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000560551016 568547944 /nfs/dbraw/zinc/54/79/44/568547944.db2.gz AXJZRGWOLLEZEC-FQEVSTJZSA-N 1 2 367.924 5.250 20 0 FKADLO Cn1ccnc1[C@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000560551017 568547884 /nfs/dbraw/zinc/54/78/84/568547884.db2.gz AXJZRGWOLLEZEC-HXUWFJFHSA-N 1 2 367.924 5.250 20 0 FKADLO FC(F)(F)CCc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000560554110 568548063 /nfs/dbraw/zinc/54/80/63/568548063.db2.gz SZNNMIMPGQNCLG-KRWDZBQOSA-N 1 2 351.416 5.638 20 0 FKADLO FC(F)(F)CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000560554111 568548038 /nfs/dbraw/zinc/54/80/38/568548038.db2.gz SZNNMIMPGQNCLG-QGZVFWFLSA-N 1 2 351.416 5.638 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccncc2OCc2ccccc2)cs1 ZINC000560569080 568552725 /nfs/dbraw/zinc/55/27/25/568552725.db2.gz BNAFXXNYVGQYCC-INIZCTEOSA-N 1 2 367.518 5.091 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccncc2OCc2ccccc2)cs1 ZINC000560569084 568552748 /nfs/dbraw/zinc/55/27/48/568552748.db2.gz BNAFXXNYVGQYCC-MRXNPFEDSA-N 1 2 367.518 5.091 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000560569687 568552863 /nfs/dbraw/zinc/55/28/63/568552863.db2.gz IIWGGTQVXBWRLM-CYBMUJFWSA-N 1 2 358.507 5.522 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000560569689 568552892 /nfs/dbraw/zinc/55/28/92/568552892.db2.gz IIWGGTQVXBWRLM-ZDUSSCGKSA-N 1 2 358.507 5.522 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000560572872 568553934 /nfs/dbraw/zinc/55/39/34/568553934.db2.gz DTVGQTFDBIQESO-NRFANRHFSA-N 1 2 370.468 5.269 20 0 FKADLO CSc1cccc(F)c1C[NH2+][C@@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000560572877 568553957 /nfs/dbraw/zinc/55/39/57/568553957.db2.gz DTVGQTFDBIQESO-OAQYLSRUSA-N 1 2 370.468 5.269 20 0 FKADLO CSCc1ccc(C[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000560582578 568559671 /nfs/dbraw/zinc/55/96/71/568559671.db2.gz FAVDQWNHAVVEQG-NRFANRHFSA-N 1 2 370.468 5.102 20 0 FKADLO CSCc1ccc(C[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000560582579 568559715 /nfs/dbraw/zinc/55/97/15/568559715.db2.gz FAVDQWNHAVVEQG-OAQYLSRUSA-N 1 2 370.468 5.102 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000560584818 568559778 /nfs/dbraw/zinc/55/97/78/568559778.db2.gz LEGNVZHUKRWKCN-ABAIWWIYSA-N 1 2 373.349 5.348 20 0 FKADLO CC(C)c1nc([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000560584819 568559862 /nfs/dbraw/zinc/55/98/62/568559862.db2.gz LEGNVZHUKRWKCN-IAQYHMDHSA-N 1 2 373.349 5.348 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000560584820 568559807 /nfs/dbraw/zinc/55/98/07/568559807.db2.gz LEGNVZHUKRWKCN-NHYWBVRUSA-N 1 2 373.349 5.348 20 0 FKADLO CC(C)c1nc([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000560584821 568559818 /nfs/dbraw/zinc/55/98/18/568559818.db2.gz LEGNVZHUKRWKCN-XHDPSFHLSA-N 1 2 373.349 5.348 20 0 FKADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc(-c2ccc(F)cc2)s1 ZINC000560585237 568559802 /nfs/dbraw/zinc/55/98/02/568559802.db2.gz RQUMKECJYAZCDA-UHFFFAOYSA-N 1 2 363.417 5.197 20 0 FKADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)c2cccc(CC(C)C)c2)[nH+]1 ZINC000560610923 568557985 /nfs/dbraw/zinc/55/79/85/568557985.db2.gz SSGITLJQSPNTOW-KRWDZBQOSA-N 1 2 361.489 5.326 20 0 FKADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2cccc(CC(C)C)c2)[nH+]1 ZINC000560610924 568558008 /nfs/dbraw/zinc/55/80/08/568558008.db2.gz SSGITLJQSPNTOW-QGZVFWFLSA-N 1 2 361.489 5.326 20 0 FKADLO CCc1sc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)cc1C ZINC000560683753 568593099 /nfs/dbraw/zinc/59/30/99/568593099.db2.gz RJWSOASARFIXKD-UHFFFAOYSA-N 1 2 365.502 5.071 20 0 FKADLO Cc1cc(C)cc(CCC(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)c1 ZINC000560684068 568593219 /nfs/dbraw/zinc/59/32/19/568593219.db2.gz RBKDZTLYVCRQLZ-UHFFFAOYSA-N 1 2 373.500 5.075 20 0 FKADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1cccc2ccccc21 ZINC000560684803 568593781 /nfs/dbraw/zinc/59/37/81/568593781.db2.gz ZOCRMLMPHUNUPJ-UHFFFAOYSA-N 1 2 367.452 5.292 20 0 FKADLO Cc1cc(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)ccc1Oc1cc[nH+]cc1 ZINC000560686507 568593862 /nfs/dbraw/zinc/59/38/62/568593862.db2.gz PVEJDUCGOAUPQL-KBPBESRZSA-N 1 2 364.367 5.099 20 0 FKADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)ccc1Oc1cc[nH+]cc1 ZINC000560686509 568593718 /nfs/dbraw/zinc/59/37/18/568593718.db2.gz PVEJDUCGOAUPQL-KGLIPLIRSA-N 1 2 364.367 5.099 20 0 FKADLO Cc1cc(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)ccc1Oc1cc[nH+]cc1 ZINC000560686511 568593773 /nfs/dbraw/zinc/59/37/73/568593773.db2.gz PVEJDUCGOAUPQL-UONOGXRCSA-N 1 2 364.367 5.099 20 0 FKADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)ccc1Oc1cc[nH+]cc1 ZINC000560686512 568593734 /nfs/dbraw/zinc/59/37/34/568593734.db2.gz PVEJDUCGOAUPQL-ZIAGYGMSSA-N 1 2 364.367 5.099 20 0 FKADLO C[C@@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000560687861 568594865 /nfs/dbraw/zinc/59/48/65/568594865.db2.gz HAVLSVYUWCOYMV-KRWDZBQOSA-N 1 2 359.473 5.019 20 0 FKADLO C[C@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000560687862 568594826 /nfs/dbraw/zinc/59/48/26/568594826.db2.gz HAVLSVYUWCOYMV-QGZVFWFLSA-N 1 2 359.473 5.019 20 0 FKADLO O=C(CCC1CCCCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000560687918 568594843 /nfs/dbraw/zinc/59/48/43/568594843.db2.gz CAVDBMXXGCYLCN-UHFFFAOYSA-N 1 2 351.494 5.185 20 0 FKADLO Cc1ccc(C(=O)Nc2ccc(C)c3c2CCCN3)cc1Oc1cc[nH+]cc1 ZINC000560692149 568595113 /nfs/dbraw/zinc/59/51/13/568595113.db2.gz PBQFVUOBYCOEDA-UHFFFAOYSA-N 1 2 373.456 5.101 20 0 FKADLO O=c1nc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)[nH]c2ccsc21 ZINC000560713470 568609720 /nfs/dbraw/zinc/60/97/20/568609720.db2.gz PXEGRKKROCQIOH-QGZVFWFLSA-N 1 2 373.909 5.071 20 0 FKADLO CCOc1ccc([C@@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccccc2)cc1 ZINC000560893093 568698128 /nfs/dbraw/zinc/69/81/28/568698128.db2.gz PRCNENXPEAXGEM-BTYIYWSLSA-N 1 2 352.503 5.290 20 0 FKADLO CCOc1ccc([C@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2)cc1 ZINC000560893096 568698179 /nfs/dbraw/zinc/69/81/79/568698179.db2.gz PRCNENXPEAXGEM-QVKFZJNVSA-N 1 2 352.503 5.290 20 0 FKADLO CCOc1ccc([C@@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2)cc1 ZINC000560893099 568698447 /nfs/dbraw/zinc/69/84/47/568698447.db2.gz PRCNENXPEAXGEM-VFNWGFHPSA-N 1 2 352.503 5.290 20 0 FKADLO Cc1nc([C@H](C)[NH2+]Cc2nc(-c3ccc(Cl)cc3)c(C)s2)cs1 ZINC000560898542 568700247 /nfs/dbraw/zinc/70/02/47/568700247.db2.gz FEOXBCVVOBLLJH-JTQLQIEISA-N 1 2 363.939 5.388 20 0 FKADLO Cc1nc([C@@H](C)[NH2+]Cc2nc(-c3ccc(Cl)cc3)c(C)s2)cs1 ZINC000560898555 568700357 /nfs/dbraw/zinc/70/03/57/568700357.db2.gz FEOXBCVVOBLLJH-SNVBAGLBSA-N 1 2 363.939 5.388 20 0 FKADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)cs1 ZINC000560901565 568701823 /nfs/dbraw/zinc/70/18/23/568701823.db2.gz QVBPBCQOAGRNCZ-LLVKDONJSA-N 1 2 355.488 5.172 20 0 FKADLO COc1cccc([C@H]([NH2+][C@@H](C)c2csc(C)n2)c2ccccc2Cl)c1 ZINC000560903828 568692123 /nfs/dbraw/zinc/69/21/23/568692123.db2.gz OJERZRZGHILNLW-RBZFPXEDSA-N 1 2 372.921 5.554 20 0 FKADLO COc1cccc([C@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2Cl)c1 ZINC000560903835 568692035 /nfs/dbraw/zinc/69/20/35/568692035.db2.gz OJERZRZGHILNLW-XCLFUZPHSA-N 1 2 372.921 5.554 20 0 FKADLO COc1cccc([C@@H]([NH2+][C@H](C)c2csc(C)n2)c2ccccc2Cl)c1 ZINC000560903837 568692628 /nfs/dbraw/zinc/69/26/28/568692628.db2.gz OJERZRZGHILNLW-ZUOKHONESA-N 1 2 372.921 5.554 20 0 FKADLO Cc1[nH+]c2ccccc2c(C)c1Cc1nc(-c2nccc3ccccc32)no1 ZINC000603780727 568166402 /nfs/dbraw/zinc/16/64/02/568166402.db2.gz JMYUKWJYHRBDED-UHFFFAOYSA-N 1 2 366.424 5.041 20 0 FKADLO O=C(Nc1ccc2[nH+]ccn2c1)c1sc2cc(Cl)ccc2c1Cl ZINC000603885078 568176974 /nfs/dbraw/zinc/17/69/74/568176974.db2.gz PJFNXOFQPXPSHX-UHFFFAOYSA-N 1 2 362.241 5.108 20 0 FKADLO Cc1ccc(C(=O)Nc2ccc3ncsc3c2)cc1Oc1cc[nH+]cc1 ZINC000604219807 568230315 /nfs/dbraw/zinc/23/03/15/568230315.db2.gz QILRRMVMJNGJQW-UHFFFAOYSA-N 1 2 361.426 5.044 20 0 FKADLO Clc1cccc(-c2cnc(C[N@H+]3CCSC[C@H]3c3ccccc3)o2)c1 ZINC000604608247 568326196 /nfs/dbraw/zinc/32/61/96/568326196.db2.gz CAUYGKDDBDVEQI-SFHVURJKSA-N 1 2 370.905 5.285 20 0 FKADLO Clc1cccc(-c2cnc(C[N@@H+]3CCSC[C@H]3c3ccccc3)o2)c1 ZINC000604608247 568326195 /nfs/dbraw/zinc/32/61/95/568326195.db2.gz CAUYGKDDBDVEQI-SFHVURJKSA-N 1 2 370.905 5.285 20 0 FKADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2coc(-c3ccc(F)cc3)n2)cc1 ZINC000604761667 568361352 /nfs/dbraw/zinc/36/13/52/568361352.db2.gz LTBLOMQVPRPCBU-FQEVSTJZSA-N 1 2 368.477 5.079 20 0 FKADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2coc(-c3ccc(F)cc3)n2)cc1 ZINC000604761667 568361351 /nfs/dbraw/zinc/36/13/51/568361351.db2.gz LTBLOMQVPRPCBU-FQEVSTJZSA-N 1 2 368.477 5.079 20 0 FKADLO Cc1cccc2sc(C(=O)Nc3ccc(-c4c[nH]c[nH+]4)cc3)c(Cl)c21 ZINC000637153147 568461263 /nfs/dbraw/zinc/46/12/63/568461263.db2.gz ZICZBBQOIIJHRZ-UHFFFAOYSA-N 1 2 367.861 5.506 20 0 FKADLO Cc1ccc(-c2cccc(C[NH2+]C3(c4noc(C(F)F)n4)CCC3)c2)cc1 ZINC000644836519 568068602 /nfs/dbraw/zinc/06/86/02/568068602.db2.gz FMVZFHLSMJVOEJ-UHFFFAOYSA-N 1 2 369.415 5.152 20 0 FKADLO Cc1ccccc1-c1cccc(C[NH2+]C2(c3noc(C(F)F)n3)CCC2)c1 ZINC000644837334 568082001 /nfs/dbraw/zinc/08/20/01/568082001.db2.gz PVKFNAXFFRTJHK-UHFFFAOYSA-N 1 2 369.415 5.152 20 0 FKADLO