smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(=O)[nH]c(-c2ccccc2C[N@H+]2CCC[C@@H](Cc3cccnc3)C2)n1 ZINC000023145063 936384746 /nfs/dbraw/zinc/38/47/46/936384746.db2.gz WTPOUYVPOVRVTE-IBGZPJMESA-N 1 1 374.488 3.595 50 0 FHAAMO CCc1nc2c(s1)[C@@H](N(C)C(=O)CCn1cc[nH+]c1C(C)C)CCC2 ZINC000119037645 938566067 /nfs/dbraw/zinc/56/60/67/938566067.db2.gz JQKYETZMKUEHMM-HNNXBMFYSA-N 1 1 360.527 3.952 50 0 FHAAMO CCC[C@@]1(COC)CCC[N@H+]1Cc1nc(COc2ccc(F)cc2)no1 ZINC000194929735 940204579 /nfs/dbraw/zinc/20/45/79/940204579.db2.gz YXHTXGZFTDNKIQ-IBGZPJMESA-N 1 1 363.433 3.569 50 0 FHAAMO CCCCc1nc(CN2CCC[C@@H]([N@H+]3CCc4ccccc4C3)C2)c[nH]1 ZINC000023375056 940296873 /nfs/dbraw/zinc/29/68/73/940296873.db2.gz GKNIWESZSXBLPR-OAQYLSRUSA-N 1 1 352.526 3.775 50 0 FHAAMO CCCCc1ncc(CN2CCC[C@@H]([N@@H+]3CCc4ccccc4C3)C2)[nH]1 ZINC000023375056 940296875 /nfs/dbraw/zinc/29/68/75/940296875.db2.gz GKNIWESZSXBLPR-OAQYLSRUSA-N 1 1 352.526 3.775 50 0 FHAAMO CCCCc1ncc(CN2CCC[C@@H]([N@H+]3CCc4ccccc4C3)C2)[nH]1 ZINC000023375056 940296877 /nfs/dbraw/zinc/29/68/77/940296877.db2.gz GKNIWESZSXBLPR-OAQYLSRUSA-N 1 1 352.526 3.775 50 0 FHAAMO CC(C)NC(=O)N1CCC([N@H+]2CC3(CCCCC3)[C@H]2c2ccncc2)CC1 ZINC000581802036 940610239 /nfs/dbraw/zinc/61/02/39/940610239.db2.gz FNTFLDUEAPBUIH-HXUWFJFHSA-N 1 1 370.541 3.971 50 0 FHAAMO CC(C)Cc1cc(=O)[nH]c(-c2cccc(C[N@@H+](C)Cc3ccoc3)c2)n1 ZINC000023581160 940744256 /nfs/dbraw/zinc/74/42/56/940744256.db2.gz DGLYOHCENXPGRR-UHFFFAOYSA-N 1 1 351.450 3.860 50 0 FHAAMO Oc1ccc(C[N@H+]2CCC[C@@H](CCc3nc(-c4cccnc4)no3)C2)cc1 ZINC000257190590 942650745 /nfs/dbraw/zinc/65/07/45/942650745.db2.gz MZRNWGWBIOWGIF-INIZCTEOSA-N 1 1 364.449 3.682 50 0 FHAAMO C[N@H+]1CC2(C[C@H]1C(=O)Nc1ccccc1)CC[NH+](Cc1cccs1)CC2 ZINC000675011985 943609184 /nfs/dbraw/zinc/60/91/84/943609184.db2.gz XOTBUANFSYJOSA-IBGZPJMESA-N 1 1 369.534 3.673 50 0 FHAAMO CN1CC2(C[C@H]1C(=O)Nc1ccccc1)CC[NH+](Cc1cccs1)CC2 ZINC000675011985 943609190 /nfs/dbraw/zinc/60/91/90/943609190.db2.gz XOTBUANFSYJOSA-IBGZPJMESA-N 1 1 369.534 3.673 50 0 FHAAMO c1nc2c([nH]1)[C@@H](C1CC[NH+](CC3CC3)CC1)N(Cc1ccccc1)CC2 ZINC000675012239 943609900 /nfs/dbraw/zinc/60/99/00/943609900.db2.gz GILFMMQIZOFYFX-JOCHJYFZSA-N 1 1 350.510 3.631 50 0 FHAAMO CCCCN(Cc1ccco1)C(=O)[C@@H]1Cc2nc[nH]c2C2(CCCCC2)[NH2+]1 ZINC000675018075 943619810 /nfs/dbraw/zinc/61/98/10/943619810.db2.gz TZIOUVJJXNDTIQ-SFHVURJKSA-N 1 1 370.497 3.505 50 0 FHAAMO CCn1cc(C[N@H+]2CCC[C@H]2CCc2noc(-c3ccccc3)n2)c(C)n1 ZINC000675019844 943630129 /nfs/dbraw/zinc/63/01/29/943630129.db2.gz KLACKQQFYDVYBU-IBGZPJMESA-N 1 1 365.481 3.859 50 0 FHAAMO Cc1ccc(C[NH+]2CCN(N=Cc3cccc(Br)c3)CC2)cc1 ZINC000254816545 947676756 /nfs/dbraw/zinc/67/67/56/947676756.db2.gz IIEOAQAMKHLNTE-UHFFFAOYSA-N 1 1 372.310 3.909 50 0 FHAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2cc(Br)cs2)C1 ZINC000000755659 948017719 /nfs/dbraw/zinc/01/77/19/948017719.db2.gz ONIVCUKMZNQYTF-LBPRGKRZSA-N 1 1 359.333 3.591 50 0 FHAAMO C[N@@H+](C[C@@H]1CCCO1)C1CCN(C(=S)Nc2cccc(Cl)c2)CC1 ZINC000003058118 204076831 /nfs/dbraw/zinc/07/68/31/204076831.db2.gz RBEPVCSXNNCGRG-KRWDZBQOSA-N 1 1 367.946 3.612 50 0 FHAAMO CCc1ccc(OCc2ccc(C(=O)N3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000002761504 204055784 /nfs/dbraw/zinc/05/57/84/204055784.db2.gz FGXMJUBJWIASLT-OAQYLSRUSA-N 1 1 364.489 3.748 50 0 FHAAMO O=C(C[NH2+]C1CCN(Cc2ccccc2)CC1)Nc1ccc(Cl)cc1 ZINC000004118681 204122225 /nfs/dbraw/zinc/12/22/25/204122225.db2.gz PWPDBLHJOLYQGO-UHFFFAOYSA-N 1 1 357.885 3.533 50 0 FHAAMO C[C@H](C(=O)NCC1CCCCC1)[N@H+](C)Cc1ccc(Br)cc1 ZINC000003417159 204099180 /nfs/dbraw/zinc/09/91/80/204099180.db2.gz QJCHHMVRPCRHFA-CQSZACIVSA-N 1 1 367.331 3.966 50 0 FHAAMO C[C@H](C(=O)NCC1CCCCC1)[N@@H+](C)Cc1ccc(Br)cc1 ZINC000003417159 204099184 /nfs/dbraw/zinc/09/91/84/204099184.db2.gz QJCHHMVRPCRHFA-CQSZACIVSA-N 1 1 367.331 3.966 50 0 FHAAMO O=C([C@H]1CCC[N@H+](Cc2ccc(Br)cc2)C1)N1CCCCC1 ZINC000004746163 204159815 /nfs/dbraw/zinc/15/98/15/204159815.db2.gz QAWVNVBIWZKJJF-INIZCTEOSA-N 1 1 365.315 3.674 50 0 FHAAMO Cc1cc(OCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)ccc1Cl ZINC000004838712 204167685 /nfs/dbraw/zinc/16/76/85/204167685.db2.gz OGPGCRRDGGVMNV-UHFFFAOYSA-N 1 1 358.869 3.615 50 0 FHAAMO COc1ccc(C[N@H+](C)CC(=O)c2c(C)[nH]c3ccccc32)cc1OC ZINC000006507926 204251427 /nfs/dbraw/zinc/25/14/27/204251427.db2.gz GFQNZAAPDDNLJP-UHFFFAOYSA-N 1 1 352.434 3.808 50 0 FHAAMO COc1ccc(C[N@@H+](C)CC(=O)c2c(C)[nH]c3ccccc32)cc1OC ZINC000006507926 204251431 /nfs/dbraw/zinc/25/14/31/204251431.db2.gz GFQNZAAPDDNLJP-UHFFFAOYSA-N 1 1 352.434 3.808 50 0 FHAAMO COc1ccc([C@@H]2Nc3sc4c(c3C(=O)N2)CC[N@@H+](C)C4)cc1Cl ZINC000006857619 204277665 /nfs/dbraw/zinc/27/76/65/204277665.db2.gz ONKBBPXIAQBKCC-HNNXBMFYSA-N 1 1 363.870 3.827 50 0 FHAAMO COc1ccc([C@@H]2Nc3sc4c(c3C(=O)N2)CC[N@H+](C)C4)cc1Cl ZINC000006857619 204277668 /nfs/dbraw/zinc/27/76/68/204277668.db2.gz ONKBBPXIAQBKCC-HNNXBMFYSA-N 1 1 363.870 3.827 50 0 FHAAMO CC[N@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccc(OC)c(F)c1 ZINC000006881169 204279466 /nfs/dbraw/zinc/27/94/66/204279466.db2.gz CXCWJLNJWCVBLS-UHFFFAOYSA-N 1 1 356.441 3.784 50 0 FHAAMO CC[N@@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccc(OC)c(F)c1 ZINC000006881169 204279469 /nfs/dbraw/zinc/27/94/69/204279469.db2.gz CXCWJLNJWCVBLS-UHFFFAOYSA-N 1 1 356.441 3.784 50 0 FHAAMO C[C@@H](Nc1cc[nH+]c2cc(Cl)ccc12)c1ccc(S(N)(=O)=O)cc1 ZINC000007813818 204307887 /nfs/dbraw/zinc/30/78/87/204307887.db2.gz IRUBGWZKUGVIQU-LLVKDONJSA-N 1 1 361.854 3.709 50 0 FHAAMO O=C(C[N@@H+]1CCc2sccc2[C@H]1C1CC1)NC(=O)Nc1ccccc1F ZINC000007880283 204310716 /nfs/dbraw/zinc/31/07/16/204310716.db2.gz GIACPFSETJXHIY-GOSISDBHSA-N 1 1 373.453 3.545 50 0 FHAAMO O=C(C[N@H+]1CCc2sccc2[C@H]1C1CC1)NC(=O)Nc1ccccc1F ZINC000007880283 204310720 /nfs/dbraw/zinc/31/07/20/204310720.db2.gz GIACPFSETJXHIY-GOSISDBHSA-N 1 1 373.453 3.545 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000008225975 204322799 /nfs/dbraw/zinc/32/27/99/204322799.db2.gz YATVSOQJYRQYFP-ZDUSSCGKSA-N 1 1 360.841 3.570 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000008225975 204322804 /nfs/dbraw/zinc/32/28/04/204322804.db2.gz YATVSOQJYRQYFP-ZDUSSCGKSA-N 1 1 360.841 3.570 50 0 FHAAMO C[C@H]1C[C@H](C)C[NH+](Cc2nc(N)nc(Nc3ccc4ccccc4c3)n2)C1 ZINC000009358455 204365183 /nfs/dbraw/zinc/36/51/83/204365183.db2.gz MXUQNKSYQMNKLF-GJZGRUSLSA-N 1 1 362.481 3.829 50 0 FHAAMO COc1ccc2oc(C(=O)NC[C@H](c3ccco3)[NH+]3CCCC3)c(C)c2c1 ZINC000009532727 204373253 /nfs/dbraw/zinc/37/32/53/204373253.db2.gz ZBLQAQUXCAGENE-QGZVFWFLSA-N 1 1 368.433 3.910 50 0 FHAAMO O=C(C[NH+]1CCC(Cn2cnc3ccccc32)CC1)Nc1cccc(F)c1 ZINC000036708871 204385262 /nfs/dbraw/zinc/38/52/62/204385262.db2.gz OGJKSXKEVWJSIZ-UHFFFAOYSA-N 1 1 366.440 3.526 50 0 FHAAMO C[N@@H+](CCCNC(=O)c1cccnc1SC(F)F)Cc1ccccc1 ZINC000009982911 204386997 /nfs/dbraw/zinc/38/69/97/204386997.db2.gz MBGFVXLINXEVKN-UHFFFAOYSA-N 1 1 365.449 3.648 50 0 FHAAMO C[C@H]1CCC[C@H]([NH+]2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)C1 ZINC000036006916 205000601 /nfs/dbraw/zinc/00/06/01/205000601.db2.gz HBHJSSIOIPAXOO-PXNSSMCTSA-N 1 1 372.534 3.725 50 0 FHAAMO CC[C@@H](C)[N@H+](Cc1cccc(OC)c1)C[C@H](O)COCc1ccccc1 ZINC000036098360 205003141 /nfs/dbraw/zinc/00/31/41/205003141.db2.gz ZNMWFMRGPAPBGG-NQIIRXRSSA-N 1 1 357.494 3.873 50 0 FHAAMO CC[C@H](C)[N@H+](Cc1ccc(OC)cc1)C[C@H](O)COCc1ccccc1 ZINC000036102243 205005199 /nfs/dbraw/zinc/00/51/99/205005199.db2.gz KUKMVOKGXBWVIL-RXVVDRJESA-N 1 1 357.494 3.873 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000036103019 205005702 /nfs/dbraw/zinc/00/57/02/205005702.db2.gz HOYHPUDPGOWWIF-FQEVSTJZSA-N 1 1 369.436 3.999 50 0 FHAAMO COCCC[N@H+](Cc1ccccc1C)C[C@@H](O)COc1ccccc1C ZINC000036099928 205005833 /nfs/dbraw/zinc/00/58/33/205005833.db2.gz YRNDHUBVHGYSEM-OAQYLSRUSA-N 1 1 357.494 3.582 50 0 FHAAMO C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000040007803 205048904 /nfs/dbraw/zinc/04/89/04/205048904.db2.gz SFCJVNYNTUTFHK-DNVCBOLYSA-N 1 1 358.869 3.623 50 0 FHAAMO C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000040007803 205048908 /nfs/dbraw/zinc/04/89/08/205048908.db2.gz SFCJVNYNTUTFHK-DNVCBOLYSA-N 1 1 358.869 3.623 50 0 FHAAMO Cc1sc(-c2ccco2)nc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000040062691 205051067 /nfs/dbraw/zinc/05/10/67/205051067.db2.gz GLQCQRCXMBGQKD-AWEZNQCLSA-N 1 1 371.462 3.871 50 0 FHAAMO Cc1[nH+]ccn1-c1cc(CNC(=O)CCCc2c[nH]c3ccccc23)ccn1 ZINC000040108358 205056315 /nfs/dbraw/zinc/05/63/15/205056315.db2.gz FWNFKBDDVXPXLS-UHFFFAOYSA-N 1 1 373.460 3.696 50 0 FHAAMO COc1cc(CN2CC[N@H+]3CCC[C@@H]3[C@@H]2C2CCCCC2)cc2c1OCO2 ZINC000043164411 205101343 /nfs/dbraw/zinc/10/13/43/205101343.db2.gz MAZLTZVQVGVUSI-NQIIRXRSSA-N 1 1 372.509 3.653 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@@H]2CCOc3ccccc32)C1 ZINC000043165589 205101471 /nfs/dbraw/zinc/10/14/71/205101471.db2.gz KVVFCTWEPDRTQE-ZIFCJYIRSA-N 1 1 359.514 3.568 50 0 FHAAMO CCOC(=O)CCCCCC(=O)c1ccccc1C[NH+]1CCSCC1 ZINC000043211781 205102187 /nfs/dbraw/zinc/10/21/87/205102187.db2.gz AQXQAWGUMRWGDB-UHFFFAOYSA-N 1 1 363.523 3.932 50 0 FHAAMO Cc1cc(NC(=O)CC[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)no1 ZINC000046437955 205135749 /nfs/dbraw/zinc/13/57/49/205135749.db2.gz ZLLDDGIUQCAJNO-CQSZACIVSA-N 1 1 356.451 3.758 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@H+](C)CCO[C@@H]1CCCC[C@H]1C ZINC000048353622 205159031 /nfs/dbraw/zinc/15/90/31/205159031.db2.gz HUBFKQFUQVQGLL-NVXWUHKLSA-N 1 1 350.528 3.874 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@@H+](C)CCO[C@@H]1CCCC[C@H]1C ZINC000048353622 205159034 /nfs/dbraw/zinc/15/90/34/205159034.db2.gz HUBFKQFUQVQGLL-NVXWUHKLSA-N 1 1 350.528 3.874 50 0 FHAAMO CC(C)(C)OC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000047539672 205148450 /nfs/dbraw/zinc/14/84/50/205148450.db2.gz DROWWMOQDRCQGK-UHFFFAOYSA-N 1 1 369.303 3.938 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)CC[C@@H]2CCCO2)C1 ZINC000048313396 205157750 /nfs/dbraw/zinc/15/77/50/205157750.db2.gz KJEIFEBGOPQSEM-UEXGIBASSA-N 1 1 358.526 3.740 50 0 FHAAMO C[C@H]1CCCCN1C(=O)C[NH+]1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000050071762 205177636 /nfs/dbraw/zinc/17/76/36/205177636.db2.gz HVRJZDHJZQNAEV-HNNXBMFYSA-N 1 1 362.901 3.636 50 0 FHAAMO COc1ccc2cc(C[NH2+][C@H](C(=O)NC3CC3)c3ccccc3)ccc2c1 ZINC000055009412 205204716 /nfs/dbraw/zinc/20/47/16/205204716.db2.gz IUMYKZZAKOSLGO-QFIPXVFZSA-N 1 1 360.457 3.958 50 0 FHAAMO COc1cccc(C[N@H+](C)[C@@H](C)c2cccnc2)c1OCCn1ccnc1 ZINC000055073049 205206204 /nfs/dbraw/zinc/20/62/04/205206204.db2.gz XZZNDNXUPIUMCM-KRWDZBQOSA-N 1 1 366.465 3.559 50 0 FHAAMO COc1cccc(C[N@@H+](C)[C@@H](C)c2cccnc2)c1OCCn1ccnc1 ZINC000055073049 205206209 /nfs/dbraw/zinc/20/62/09/205206209.db2.gz XZZNDNXUPIUMCM-KRWDZBQOSA-N 1 1 366.465 3.559 50 0 FHAAMO C(CN1CCCCC1)Sc1nnc(SCC[NH+]2CCCCC2)s1 ZINC000057471746 205240677 /nfs/dbraw/zinc/24/06/77/205240677.db2.gz LKDUYRIFDROYKQ-UHFFFAOYSA-N 1 1 372.629 3.694 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)N1c2ccccc2NC(=O)C[C@H]1C)c1ccccc1Cl ZINC000058048056 205249632 /nfs/dbraw/zinc/24/96/32/205249632.db2.gz QYCYAQCWQJSZGX-ZIAGYGMSSA-N 1 1 371.868 3.755 50 0 FHAAMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)C1 ZINC000058159820 205252404 /nfs/dbraw/zinc/25/24/04/205252404.db2.gz QKBIGEZFKKKZGH-ZBFHGGJFSA-N 1 1 367.474 3.968 50 0 FHAAMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)C1 ZINC000058172252 205254752 /nfs/dbraw/zinc/25/47/52/205254752.db2.gz PCABTEFWHNCQAL-KRWDZBQOSA-N 1 1 355.482 3.511 50 0 FHAAMO Cc1ccc(NC(=O)C[C@H]2C=CCC2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000058208643 205260392 /nfs/dbraw/zinc/26/03/92/205260392.db2.gz XPFVIAPHZIOQDP-KRWDZBQOSA-N 1 1 355.482 3.714 50 0 FHAAMO C[N@H+](Cc1cccnc1)C[C@H]1CCCN(C(=O)Nc2cccc(F)c2)C1 ZINC000058330188 205271076 /nfs/dbraw/zinc/27/10/76/205271076.db2.gz IBSXGVNJGXOFTN-QGZVFWFLSA-N 1 1 356.445 3.597 50 0 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/nfs/dbraw/zinc/30/64/91/205306491.db2.gz BKYXKGVJBPDNIV-UHFFFAOYSA-N 1 1 360.379 3.552 50 0 FHAAMO Cc1ccc([C@@H](C)NC(=O)c2cc3n(n2)CCC[N@@H+](C(C)C)C3)cc1C ZINC000065431049 205350029 /nfs/dbraw/zinc/35/00/29/205350029.db2.gz QDIXWQDTFCXZQN-QGZVFWFLSA-N 1 1 354.498 3.605 50 0 FHAAMO Cc1ccc([C@@H](C)NC(=O)c2cc3n(n2)CCC[N@H+](C(C)C)C3)cc1C ZINC000065431049 205350033 /nfs/dbraw/zinc/35/00/33/205350033.db2.gz QDIXWQDTFCXZQN-QGZVFWFLSA-N 1 1 354.498 3.605 50 0 FHAAMO COc1ccc(F)c(CN2CCC[N@@H+](Cc3ccncc3)CC2)c1Cl ZINC000065461041 205352237 /nfs/dbraw/zinc/35/22/37/205352237.db2.gz DBFOJKRCRLDTFF-UHFFFAOYSA-N 1 1 363.864 3.591 50 0 FHAAMO C[C@H](C(=O)N1CCCCCC1)[N@H+]1CC=C(c2cnn(C(C)(C)C)c2)CC1 ZINC000065465521 205353114 /nfs/dbraw/zinc/35/31/14/205353114.db2.gz GWPNBLGJRVOMFA-QGZVFWFLSA-N 1 1 358.530 3.518 50 0 FHAAMO C[C@H](C(=O)N1CCCCCC1)[N@@H+]1CC=C(c2cnn(C(C)(C)C)c2)CC1 ZINC000065465521 205353117 /nfs/dbraw/zinc/35/31/17/205353117.db2.gz GWPNBLGJRVOMFA-QGZVFWFLSA-N 1 1 358.530 3.518 50 0 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OCC[C@H]1CN(Cc2cccc(C(F)(F)F)c2)CC[N@H+]1C1CCCC1 ZINC000020999068 570927627 /nfs/dbraw/zinc/92/76/27/570927627.db2.gz MPXVTRLBCRXHKM-SFHVURJKSA-N 1 1 356.432 3.517 50 0 FHAAMO Fc1ccc(C[N@H+]2CCC[C@@H](N3CCN(c4ccccc4F)CC3)C2)cc1 ZINC000020997232 570927850 /nfs/dbraw/zinc/92/78/50/570927850.db2.gz IYUQJVKDLWQAPX-HXUWFJFHSA-N 1 1 371.475 3.751 50 0 FHAAMO Fc1ccc(CN2CCC[C@@H]([NH+]3CCN(c4ccccc4F)CC3)C2)cc1 ZINC000020997232 570927852 /nfs/dbraw/zinc/92/78/52/570927852.db2.gz IYUQJVKDLWQAPX-HXUWFJFHSA-N 1 1 371.475 3.751 50 0 FHAAMO O=C(NCc1ccccc1F)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000072049932 570930530 /nfs/dbraw/zinc/93/05/30/570930530.db2.gz RQHDAULYGMSJEG-OAHLLOKOSA-N 1 1 361.486 3.599 50 0 FHAAMO C[NH+]1CCN(Cc2ccc(C(=O)c3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000022027935 570937804 /nfs/dbraw/zinc/93/78/04/570937804.db2.gz WPVVKVIDYNUOFE-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO C[NH+]1CCN(Cc2cccc(C(=O)c3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000022028050 570937832 /nfs/dbraw/zinc/93/78/32/570937832.db2.gz KDBIWFQGRGCTIJ-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO CCOc1cc(CNCC[NH+](C)C)cc(Cl)c1OCc1ccccc1 ZINC000022075639 570939229 /nfs/dbraw/zinc/93/92/29/570939229.db2.gz WURYQQXAPNJPJG-UHFFFAOYSA-N 1 1 362.901 3.969 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(Br)s3)sc2C1 ZINC000022698989 570948798 /nfs/dbraw/zinc/94/87/98/570948798.db2.gz PDCRYNWDVZUBKP-UHFFFAOYSA-N 1 1 372.313 3.597 50 0 FHAAMO CC(C)CC[N@H+]1CCN(Cc2nc(-c3ccccc3)cs2)C[C@@H]1CCO ZINC000022932537 570953189 /nfs/dbraw/zinc/95/31/89/570953189.db2.gz JIUKJZYANVENLE-IBGZPJMESA-N 1 1 373.566 3.725 50 0 FHAAMO CC(=O)Nc1ccc(CN(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000023372995 570962143 /nfs/dbraw/zinc/96/21/43/570962143.db2.gz SUFCVSDVVQSZKI-QHCPKHFHSA-N 1 1 365.521 3.784 50 0 FHAAMO CC(=O)Nc1ccc(C[N@@H+](C)[C@H]2CCCN(CCc3ccccc3)C2)cc1 ZINC000023372995 570962146 /nfs/dbraw/zinc/96/21/46/570962146.db2.gz SUFCVSDVVQSZKI-QHCPKHFHSA-N 1 1 365.521 3.784 50 0 FHAAMO CC(=O)Nc1ccc(C[N@H+](C)[C@H]2CCCN(CCc3ccccc3)C2)cc1 ZINC000023372995 570962151 /nfs/dbraw/zinc/96/21/51/570962151.db2.gz SUFCVSDVVQSZKI-QHCPKHFHSA-N 1 1 365.521 3.784 50 0 FHAAMO O=C(N[C@@H]1CC[N@H+](C2CCCCCC2)C1)c1csc(-c2ccccn2)n1 ZINC000072230569 570985212 /nfs/dbraw/zinc/98/52/12/570985212.db2.gz BKZABEAXGDSTJE-OAHLLOKOSA-N 1 1 370.522 3.732 50 0 FHAAMO CCC[N@@H+](Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C[C@H](O)c1ccccc1 ZINC000025662127 570998485 /nfs/dbraw/zinc/99/84/85/570998485.db2.gz VXZCKYLJYQVILR-SFHVURJKSA-N 1 1 371.868 3.522 50 0 FHAAMO CCC[N@H+](Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C[C@H](O)c1ccccc1 ZINC000025662127 570998488 /nfs/dbraw/zinc/99/84/88/570998488.db2.gz VXZCKYLJYQVILR-SFHVURJKSA-N 1 1 371.868 3.522 50 0 FHAAMO O=C(c1cc(-c2ccccc2)on1)N1CCC[N@H+](Cc2cccs2)CC1 ZINC000028035892 571026315 /nfs/dbraw/zinc/02/63/15/571026315.db2.gz YGSALGQTQQLSSQ-UHFFFAOYSA-N 1 1 367.474 3.751 50 0 FHAAMO O=C(c1cc(-c2ccccc2)on1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000028035892 571026316 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CCN(CC)C(=O)[C@@H]1CCC[N@H+](Cc2ccc(F)c(Br)c2)C1 ZINC000000752258 571068850 /nfs/dbraw/zinc/06/88/50/571068850.db2.gz RZDADTNNCUNMSQ-CQSZACIVSA-N 1 1 371.294 3.669 50 0 FHAAMO COc1ccc(CN2CC[N@H+]3CCC[C@H]3[C@H]2C2CCCCC2)cc1OC ZINC000244817063 571075013 /nfs/dbraw/zinc/07/50/13/571075013.db2.gz STTKBBNUQHXQAG-SIKLNZKXSA-N 1 1 358.526 3.933 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccc[nH]c1=S ZINC000040112343 571079252 /nfs/dbraw/zinc/07/92/52/571079252.db2.gz WZLUIFKYAOVPAA-OAHLLOKOSA-N 1 1 355.507 3.675 50 0 FHAAMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2ccccc2)C[C@H]2CCCO2)c(C)c1 ZINC000245279524 571096343 /nfs/dbraw/zinc/09/63/43/571096343.db2.gz GWXJGRLKRGYHHP-FYYLOGMGSA-N 1 1 369.505 3.724 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)/C=C\c3ccc([C@@H]4C[C@H]4C)o3)sc2C1 ZINC000245285909 571096764 /nfs/dbraw/zinc/09/67/64/571096764.db2.gz ZOZKASDYEMQXJD-OJWNKBRNSA-N 1 1 357.479 3.889 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)/C=C\c3ccc([C@@H]4C[C@H]4C)o3)sc2C1 ZINC000245285909 571096769 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CCn1c2ccccc2c2cc(NC(=O)[C@@H](C)[NH+]3CCC(O)CC3)ccc21 ZINC000033040079 571114840 /nfs/dbraw/zinc/11/48/40/571114840.db2.gz HKNRAEFPMOEBMJ-OAHLLOKOSA-N 1 1 365.477 3.598 50 0 FHAAMO COc1ccc(CNC(=O)CC[N@H+]2CC[C@H](c3ccccc3Cl)C2)cc1 ZINC000244734758 571115728 /nfs/dbraw/zinc/11/57/28/571115728.db2.gz NLKNUQTUEHACRY-KRWDZBQOSA-N 1 1 372.896 3.844 50 0 FHAAMO COCC[N@@H+](C/C=C/c1ccccc1)Cc1cc2c(c(OC)c1)OCO2 ZINC000055152899 571116911 /nfs/dbraw/zinc/11/69/11/571116911.db2.gz MLGWJLZPRDJGKV-RMKNXTFCSA-N 1 1 355.434 3.586 50 0 FHAAMO O=C(NC[C@H](c1ccc(Cl)cc1)[NH+]1CCCCC1)[C@H]1CC[C@@H](O)CC1 ZINC000244874682 571118559 /nfs/dbraw/zinc/11/85/59/571118559.db2.gz XFNRPUKMDYHDPX-NZSAHSFTSA-N 1 1 364.917 3.534 50 0 FHAAMO O=C(NC[C@@H](c1ccc(Cl)cc1)[NH+]1CCCCC1)[C@H]1CC[C@@H](O)CC1 ZINC000244874683 571118573 /nfs/dbraw/zinc/11/85/73/571118573.db2.gz XFNRPUKMDYHDPX-UHOSZYNNSA-N 1 1 364.917 3.534 50 0 FHAAMO CCCN(CC)C(=O)C1CC[NH+](Cc2nc3ccccc3n2CC)CC1 ZINC000247966503 571126496 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50 0 FHAAMO CC(C)[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(=O)OC(C)(C)C ZINC000170592267 571266297 /nfs/dbraw/zinc/26/62/97/571266297.db2.gz CYYSYESDHIKTRQ-HOJAQTOUSA-N 1 1 360.542 3.995 50 0 FHAAMO Clc1ccc(SCC[NH+]2CCC(CCN3CCOCC3)CC2)cc1 ZINC000071853932 571270595 /nfs/dbraw/zinc/27/05/95/571270595.db2.gz HODDMTVISRDRDO-UHFFFAOYSA-N 1 1 368.974 3.866 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1[C@@H](C)c1nnc(-c2cccs2)o1 ZINC000089941678 571274240 /nfs/dbraw/zinc/27/42/40/571274240.db2.gz MBGFXOQJLABIOG-SOUVJXGZSA-N 1 1 374.510 3.725 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1[C@@H](C)c1nnc(-c2cccs2)o1 ZINC000089941678 571274241 /nfs/dbraw/zinc/27/42/41/571274241.db2.gz MBGFXOQJLABIOG-SOUVJXGZSA-N 1 1 374.510 3.725 50 0 FHAAMO CC(C)Oc1ccc(CCC(=O)NC[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1 ZINC000252518107 571282133 /nfs/dbraw/zinc/28/21/33/571282133.db2.gz AALWIBVCVDKFBI-CTNGQTDRSA-N 1 1 358.526 3.787 50 0 FHAAMO C[N@@H+](Cc1ccccc1)[C@H]1CCCN(C(=O)c2cc(C3CC3)on2)CC1 ZINC000252537772 571282966 /nfs/dbraw/zinc/28/29/66/571282966.db2.gz MHMXBIYSQJQKLO-SFHVURJKSA-N 1 1 353.466 3.679 50 0 FHAAMO CCc1cc2c(cc1[C@@H]1Cc3ccc(OC)c(OC)c3C[N@@H+]1C)OCO2 ZINC000019908454 571308216 /nfs/dbraw/zinc/30/82/16/571308216.db2.gz LMBCNGKKYKSVKG-KRWDZBQOSA-N 1 1 355.434 3.724 50 0 FHAAMO CCc1cc2c(cc1[C@@H]1Cc3ccc(OC)c(OC)c3C[N@H+]1C)OCO2 ZINC000019908454 571308217 /nfs/dbraw/zinc/30/82/17/571308217.db2.gz LMBCNGKKYKSVKG-KRWDZBQOSA-N 1 1 355.434 3.724 50 0 FHAAMO COc1ccc(Cl)cc1NC(=O)CC[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000052010440 571309039 /nfs/dbraw/zinc/30/90/39/571309039.db2.gz MADMEHWBSXLMQE-HNNXBMFYSA-N 1 1 363.845 3.811 50 0 FHAAMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H](c3ccncc3)C2)cc1Cl ZINC000253428257 571313234 /nfs/dbraw/zinc/31/32/34/571313234.db2.gz ITBQISTUGHDKMM-OAHLLOKOSA-N 1 1 359.857 3.562 50 0 FHAAMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H](c3ccncc3)C2)cc1Cl ZINC000253428257 571313235 /nfs/dbraw/zinc/31/32/35/571313235.db2.gz ITBQISTUGHDKMM-OAHLLOKOSA-N 1 1 359.857 3.562 50 0 FHAAMO O=C(NC[C@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1cccc(O)c1)C1CC1 ZINC000584887365 571314019 /nfs/dbraw/zinc/31/40/19/571314019.db2.gz ASXJBXLUQUZZED-GOSISDBHSA-N 1 1 371.525 3.721 50 0 FHAAMO Cc1[nH]c(C)c(-c2ccc(C(=O)N3CCO[C@H](c4ccccc4)C3)cc2)[nH+]1 ZINC000584890693 571314536 /nfs/dbraw/zinc/31/45/36/571314536.db2.gz SPOPHUPXXBLOAW-FQEVSTJZSA-N 1 1 361.445 3.907 50 0 FHAAMO C[N@H+]1CCC[C@@H]1CCn1cnc2cc(-c3ccc(F)cc3)sc2c1=O ZINC000584898069 571315803 /nfs/dbraw/zinc/31/58/03/571315803.db2.gz WYHJIRCYQULOAB-OAHLLOKOSA-N 1 1 357.454 3.748 50 0 FHAAMO Cc1[nH]c2c(Cl)cccc2c(=O)c1C[NH+]1CCN(c2ccccc2)CC1 ZINC000019793681 571327273 /nfs/dbraw/zinc/32/72/73/571327273.db2.gz PCMDYBVXKLDQJE-UHFFFAOYSA-N 1 1 367.880 3.812 50 0 FHAAMO CC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CC=C(c2c[nH]c3ccc(OC)cc32)CC1 ZINC000080027601 571328594 /nfs/dbraw/zinc/32/85/94/571328594.db2.gz OOGJIGNGPCFJTA-LSDHHAIUSA-N 1 1 355.482 3.569 50 0 FHAAMO O=C(Cn1c[nH+]c2c1CCCC2)N1CCC[C@H]1Cc1ccccc1Cl ZINC000095465194 571330407 /nfs/dbraw/zinc/33/04/07/571330407.db2.gz INIPIJVODVNALW-INIZCTEOSA-N 1 1 357.885 3.649 50 0 FHAAMO CC(C)N(C)c1cccc(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccncc2)c1 ZINC000095955954 571332856 /nfs/dbraw/zinc/33/28/56/571332856.db2.gz PLPFYONPJUVIRK-OAQYLSRUSA-N 1 1 366.509 3.919 50 0 FHAAMO CC(C)N(C)c1cccc(NC(=O)[C@H]2CCCC[N@H+]2Cc2ccncc2)c1 ZINC000095955954 571332857 /nfs/dbraw/zinc/33/28/57/571332857.db2.gz PLPFYONPJUVIRK-OAQYLSRUSA-N 1 1 366.509 3.919 50 0 FHAAMO Cc1cc(O)ccc1C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000095976476 571333277 /nfs/dbraw/zinc/33/32/77/571333277.db2.gz WJNUZIFKAOVSQD-UHFFFAOYSA-N 1 1 364.445 3.856 50 0 FHAAMO Cc1cc(O)ccc1C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000095976476 571333278 /nfs/dbraw/zinc/33/32/78/571333278.db2.gz WJNUZIFKAOVSQD-UHFFFAOYSA-N 1 1 364.445 3.856 50 0 FHAAMO C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+](C)CCc1ccncc1 ZINC000095982824 571333397 /nfs/dbraw/zinc/33/33/97/571333397.db2.gz JVRDHKZTBLBBCE-GFCCVEGCSA-N 1 1 352.265 3.890 50 0 FHAAMO COc1ccc2cc(C(=O)N(C)C[C@@H]3CCC[N@H+]4CCCC[C@@H]34)n(C)c2c1 ZINC000299754409 571338450 /nfs/dbraw/zinc/33/84/50/571338450.db2.gz KNAYXGKHAXKSAB-HKUYNNGSSA-N 1 1 369.509 3.523 50 0 FHAAMO c1csc(C[N@@H+]2CCCN(Cc3nc(-c4ccsc4)no3)CC2)c1 ZINC000030973329 571350090 /nfs/dbraw/zinc/35/00/90/571350090.db2.gz XECJXTNPONTRCL-UHFFFAOYSA-N 1 1 360.508 3.568 50 0 FHAAMO COc1cccc([C@H](C)NC(=O)N2CCC[N@@H+](Cc3cccs3)CC2)c1 ZINC000670445140 571350565 /nfs/dbraw/zinc/35/05/65/571350565.db2.gz IBEBTHBKBNVUDG-INIZCTEOSA-N 1 1 373.522 3.735 50 0 FHAAMO COc1ccccc1OC[C@H](O)C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000031815765 571353905 /nfs/dbraw/zinc/35/39/05/571353905.db2.gz CRSAWGFFSVOTPO-MRXNPFEDSA-N 1 1 373.474 3.792 50 0 FHAAMO COc1ccccc1OC[C@H](O)C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000031815765 571353906 /nfs/dbraw/zinc/35/39/06/571353906.db2.gz CRSAWGFFSVOTPO-MRXNPFEDSA-N 1 1 373.474 3.792 50 0 FHAAMO CCCNC(=O)N1CCC[C@H](Cc2[nH+]cc(C)n2Cc2ccccc2)C1 ZINC000257192589 942663173 /nfs/dbraw/zinc/66/31/73/942663173.db2.gz VENIWSZRTUCJCC-LJQANCHMSA-N 1 1 354.498 3.614 50 0 FHAAMO CC(C)C[N@H+]1C[C@H](c2ncco2)C2(C1)CCN(C(=O)c1ccccc1)CC2 ZINC000675014694 943621732 /nfs/dbraw/zinc/62/17/32/943621732.db2.gz PMNVEPRJRWKVQR-LJQANCHMSA-N 1 1 367.493 3.652 50 0 FHAAMO Cc1sc2ccccc2c1C[N@H+](Cc1cccnc1)C[C@@H]1CCC(=O)N1 ZINC000215204000 222641669 /nfs/dbraw/zinc/64/16/69/222641669.db2.gz KKVXWOKODLQPQD-KRWDZBQOSA-N 1 1 365.502 3.886 50 0 FHAAMO COc1cccc2[nH]c(C(=O)N(C)C[C@@H]3CCC[N@H+]4CCCC[C@H]34)cc21 ZINC000253412220 203908478 /nfs/dbraw/zinc/90/84/78/203908478.db2.gz QGKRGOGPCQHFMI-HNAYVOBHSA-N 1 1 355.482 3.513 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(F)c(F)c2F)cc1 ZINC000003454158 204101236 /nfs/dbraw/zinc/10/12/36/204101236.db2.gz IPADQFUMWWGLDG-LLVKDONJSA-N 1 1 352.356 3.572 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(F)c(F)c2F)cc1 ZINC000003454158 204101242 /nfs/dbraw/zinc/10/12/42/204101242.db2.gz IPADQFUMWWGLDG-LLVKDONJSA-N 1 1 352.356 3.572 50 0 FHAAMO O=C([C@@H]1CCC[N@H+](Cc2cccc(Br)c2)C1)N1CCCCC1 ZINC000004744881 204160774 /nfs/dbraw/zinc/16/07/74/204160774.db2.gz DALTVDLZVWJFER-MRXNPFEDSA-N 1 1 365.315 3.674 50 0 FHAAMO O=C(C[NH+](Cc1ccccc1)Cc1ccccc1)NCCOc1ccccc1 ZINC000004783872 204162817 /nfs/dbraw/zinc/16/28/17/204162817.db2.gz XINUZPCVMHYEIE-UHFFFAOYSA-N 1 1 374.484 3.884 50 0 FHAAMO CCOc1ccc(C(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000005525133 204213039 /nfs/dbraw/zinc/21/30/39/204213039.db2.gz UDJCJDFCXCKPIX-CTNGQTDRSA-N 1 1 350.462 3.842 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2c(s1)-c1ccccc1OC2 ZINC000005051192 204188041 /nfs/dbraw/zinc/18/80/41/204188041.db2.gz WCRKHLZTEWKKOV-AWEZNQCLSA-N 1 1 356.491 3.912 50 0 FHAAMO CC(C)c1ccc(C[N@@H+](C)C[C@H](O)COCc2ccc3c(c2)OCO3)cc1 ZINC000007007648 204286296 /nfs/dbraw/zinc/28/62/96/204286296.db2.gz JDRRXDDODYDZGZ-FQEVSTJZSA-N 1 1 371.477 3.548 50 0 FHAAMO Cc1ccc2nc(C[N@H+](C)Cc3ccc(Cl)c(Cl)c3)cc(=O)n2c1 ZINC000007267378 204292670 /nfs/dbraw/zinc/29/26/70/204292670.db2.gz LEGXFQWFHIPSNI-UHFFFAOYSA-N 1 1 362.260 3.942 50 0 FHAAMO Cc1ccc2nc(C[N@@H+](C)Cc3ccc(Cl)c(Cl)c3)cc(=O)n2c1 ZINC000007267378 204292672 /nfs/dbraw/zinc/29/26/72/204292672.db2.gz LEGXFQWFHIPSNI-UHFFFAOYSA-N 1 1 362.260 3.942 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](CCCn2cnc3c4cc(Cl)ccc4[nH]c3c2=O)C1 ZINC000006809347 204272787 /nfs/dbraw/zinc/27/27/87/204272787.db2.gz YAAPCIQCNOUERR-OKILXGFUSA-N 1 1 372.900 3.899 50 0 FHAAMO COc1ccc([C@H]2Nc3sc4c(c3C(=O)N2)CC[N@@H+](C)C4)cc1Cl ZINC000006857668 204277167 /nfs/dbraw/zinc/27/71/67/204277167.db2.gz ONKBBPXIAQBKCC-OAHLLOKOSA-N 1 1 363.870 3.827 50 0 FHAAMO COc1ccc([C@H]2Nc3sc4c(c3C(=O)N2)CC[N@H+](C)C4)cc1Cl ZINC000006857668 204277172 /nfs/dbraw/zinc/27/71/72/204277172.db2.gz ONKBBPXIAQBKCC-OAHLLOKOSA-N 1 1 363.870 3.827 50 0 FHAAMO Cc1onc(-c2ccccc2)c1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000008230201 204322878 /nfs/dbraw/zinc/32/28/78/204322878.db2.gz WLKXPFYSYAXVCM-KRWDZBQOSA-N 1 1 365.433 3.810 50 0 FHAAMO Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)cc1 ZINC000008310307 204324973 /nfs/dbraw/zinc/32/49/73/204324973.db2.gz AQCSTGJLLGTMPB-IBGZPJMESA-N 1 1 366.461 3.932 50 0 FHAAMO Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)cc1 ZINC000008310307 204324976 /nfs/dbraw/zinc/32/49/76/204324976.db2.gz AQCSTGJLLGTMPB-IBGZPJMESA-N 1 1 366.461 3.932 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)Nc1ccccc1 ZINC000008310336 204325749 /nfs/dbraw/zinc/32/57/49/204325749.db2.gz HVGHBHZXZVMVPT-GOSISDBHSA-N 1 1 352.434 3.624 50 0 FHAAMO O=C(C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)Nc1ccccc1 ZINC000008310336 204325753 /nfs/dbraw/zinc/32/57/53/204325753.db2.gz HVGHBHZXZVMVPT-GOSISDBHSA-N 1 1 352.434 3.624 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1c[nH]c2ccccc12 ZINC000008922563 204349519 /nfs/dbraw/zinc/34/95/19/204349519.db2.gz NEXFHCWAPKPBII-LJQANCHMSA-N 1 1 362.429 3.959 50 0 FHAAMO O=C(C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1c[nH]c2ccccc12 ZINC000008922563 204349524 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C[NH+]1CCN(c2c(C(=O)c3ccccc3)cnc3ccc(Cl)cc32)CC1 ZINC000004315512 536418038 /nfs/dbraw/zinc/41/80/38/536418038.db2.gz HKMVNLBLSXSJFF-UHFFFAOYSA-N 1 1 365.864 3.871 50 0 FHAAMO O=C(OC[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cccc(Br)c1 ZINC000013425022 560216559 /nfs/dbraw/zinc/21/65/59/560216559.db2.gz AGZJPXXQAWUYDC-HOCLYGCPSA-N 1 1 352.272 3.870 50 0 biogenic,in-vitro FHAAMO COc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012284549 568028299 /nfs/dbraw/zinc/02/82/99/568028299.db2.gz CFTXNFVHKWQGFY-GOSISDBHSA-N 1 1 366.461 3.749 50 0 FHAAMO COc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012284549 568028300 /nfs/dbraw/zinc/02/83/00/568028300.db2.gz CFTXNFVHKWQGFY-GOSISDBHSA-N 1 1 366.461 3.749 50 0 FHAAMO Cc1nc(CN(C)C(=O)[C@H](c2ccc(F)cc2)[NH+]2CCCCC2)cs1 ZINC000215201152 568057478 /nfs/dbraw/zinc/05/74/78/568057478.db2.gz QYCAZTQBQVGRQK-SFHVURJKSA-N 1 1 361.486 3.776 50 0 FHAAMO Fc1ccccc1-c1ccc(C[NH+]2CCN(Cc3cccnc3)CC2)o1 ZINC000215223128 568058832 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366.509 3.871 50 0 FHAAMO Fc1cccc(Cl)c1CN1C[C@H]2CC[C@@H]1C[N@@H+](Cc1cccnc1)C2 ZINC000095356060 570452647 /nfs/dbraw/zinc/45/26/47/570452647.db2.gz LOQCVFBVQHGKCK-DLBZAZTESA-N 1 1 359.876 3.971 50 0 FHAAMO C[NH+](C)[C@@H](C(=O)NCc1cc(-c2ccccc2F)no1)c1cccc(F)c1 ZINC000095353958 570452810 /nfs/dbraw/zinc/45/28/10/570452810.db2.gz XEMJPTQMJODSBG-LJQANCHMSA-N 1 1 371.387 3.539 50 0 FHAAMO c1cn(Cc2cscn2)c([C@@H]2CCCN(c3nc4ccccc4o3)C2)[nH+]1 ZINC000095361106 570453964 /nfs/dbraw/zinc/45/39/64/570453964.db2.gz MFLGIECTOGAQCA-CQSZACIVSA-N 1 1 365.462 3.913 50 0 FHAAMO c1cn(Cc2cscn2)c([C@H]2CCCN(c3nc4ccccc4o3)C2)[nH+]1 ZINC000095361104 570453972 /nfs/dbraw/zinc/45/39/72/570453972.db2.gz MFLGIECTOGAQCA-AWEZNQCLSA-N 1 1 365.462 3.913 50 0 FHAAMO C[N@H+](Cc1ccccc1)[C@@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000000805952 570457474 /nfs/dbraw/zinc/45/74/74/570457474.db2.gz KOQSEFUBYSUYTN-MRXNPFEDSA-N 1 1 363.244 3.757 50 0 FHAAMO C[N@@H+](Cc1ccccc1)[C@@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000000805952 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/nfs/dbraw/zinc/96/67/10/570966710.db2.gz WGFGINIEBVKZSZ-IBGZPJMESA-N 1 1 356.466 3.517 50 0 FHAAMO O=C(/C=C\c1ccc(Cl)cc1)OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000212119209 570969242 /nfs/dbraw/zinc/96/92/42/570969242.db2.gz PHKSYIGBILJVSP-WUQYLLKWSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(/C=C\c1ccc(Cl)cc1)OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000212119209 570969245 /nfs/dbraw/zinc/96/92/45/570969245.db2.gz PHKSYIGBILJVSP-WUQYLLKWSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(Cc1c(Cl)cccc1Cl)N1CC[NH+](Cc2ccccc2)CC1 ZINC000025540932 570996822 /nfs/dbraw/zinc/99/68/22/570996822.db2.gz FGQVOBUHXGALDU-UHFFFAOYSA-N 1 1 363.288 3.880 50 0 FHAAMO COc1cc(CN2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc(Cl)c1OC ZINC000225345862 571029558 /nfs/dbraw/zinc/02/95/58/571029558.db2.gz FMDZTWHGAYBYJH-SFHVURJKSA-N 1 1 360.885 3.846 50 0 FHAAMO CC1(C)C(=O)Nc2ccccc2N1C(=O)C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000008320235 571039621 /nfs/dbraw/zinc/03/96/21/571039621.db2.gz OVTJGBXUSAORBZ-INIZCTEOSA-N 1 1 369.490 3.649 50 0 FHAAMO CC1(C)C(=O)Nc2ccccc2N1C(=O)C[N@H+]1CCC[C@H]1c1cccs1 ZINC000008320235 571039625 /nfs/dbraw/zinc/03/96/25/571039625.db2.gz OVTJGBXUSAORBZ-INIZCTEOSA-N 1 1 369.490 3.649 50 0 FHAAMO CC(C)OC(=O)c1ccc(NC(=O)C[N@@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC000029485788 571040742 /nfs/dbraw/zinc/04/07/42/571040742.db2.gz LZVCSOPGJCELQM-FQEVSTJZSA-N 1 1 366.461 3.810 50 0 FHAAMO C[C@@H](c1cccnc1)[NH+]1CCN(Cc2cccc3c2OC(C)(C)C3)CC1 ZINC000225535225 571043774 /nfs/dbraw/zinc/04/37/74/571043774.db2.gz VAJOFLOBMUIGKW-KRWDZBQOSA-N 1 1 351.494 3.674 50 0 FHAAMO C[C@@H](c1cccnc1)N1CC[NH+](Cc2cccc3c2OC(C)(C)C3)CC1 ZINC000225535225 571043777 /nfs/dbraw/zinc/04/37/77/571043777.db2.gz VAJOFLOBMUIGKW-KRWDZBQOSA-N 1 1 351.494 3.674 50 0 FHAAMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000012686427 571044262 /nfs/dbraw/zinc/04/42/62/571044262.db2.gz RUACAQMLKDKDAT-HNNXBMFYSA-N 1 1 359.882 3.919 50 0 FHAAMO CSc1ccc(Cl)c(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000030363262 571046930 /nfs/dbraw/zinc/04/69/30/571046930.db2.gz ZZBLHRAYXVIZGU-UHFFFAOYSA-N 1 1 360.910 3.850 50 0 FHAAMO CSc1ccc(Cl)c(C(=O)NCC[N@H+]2CCc3ccccc3C2)c1 ZINC000030363262 571046933 /nfs/dbraw/zinc/04/69/33/571046933.db2.gz ZZBLHRAYXVIZGU-UHFFFAOYSA-N 1 1 360.910 3.850 50 0 FHAAMO O[C@H]1CCC[N@H+](Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000070945254 571053623 /nfs/dbraw/zinc/05/36/23/571053623.db2.gz LVSORXTTZGOBNZ-KRWDZBQOSA-N 1 1 355.869 3.695 50 0 FHAAMO O[C@H]1CCC[N@@H+](Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000070945254 571053626 /nfs/dbraw/zinc/05/36/26/571053626.db2.gz LVSORXTTZGOBNZ-KRWDZBQOSA-N 1 1 355.869 3.695 50 0 FHAAMO CC[N@@H+](C)C[C@H]1CCN(c2nc3c(Cl)c(C)nn3c3ccccc32)C1 ZINC000072302152 571055527 /nfs/dbraw/zinc/05/55/27/571055527.db2.gz XXEDLHIRKOECIU-CQSZACIVSA-N 1 1 357.889 3.622 50 0 FHAAMO CC[N@H+](CC(=O)Nc1ccc(NC(C)=O)cc1)C[C@@H]1CCCC(F)(F)C1 ZINC000225769774 571064031 /nfs/dbraw/zinc/06/40/31/571064031.db2.gz ZEOPUSNIWMFZST-OAHLLOKOSA-N 1 1 367.440 3.731 50 0 FHAAMO O=C(CC[N@H+]1CCC[C@@H]1C(=O)Nc1ccccc1)Nc1cccc(Cl)c1 ZINC000025949998 571091730 /nfs/dbraw/zinc/09/17/30/571091730.db2.gz KZHLMPRUTWTGAX-GOSISDBHSA-N 1 1 371.868 3.772 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)c3ccccc3Br)sc2C1 ZINC000012793578 571104657 /nfs/dbraw/zinc/10/46/57/571104657.db2.gz STZAXKJZFDOHKL-UHFFFAOYSA-N 1 1 366.284 3.536 50 0 FHAAMO C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000069619795 571100023 /nfs/dbraw/zinc/10/00/23/571100023.db2.gz IDLFVOWECITYNA-LPHOPBHVSA-N 1 1 355.457 3.652 50 0 FHAAMO Cc1ccccc1OCC[N@H+](C)Cc1cc(=O)oc2c(C)c(O)ccc12 ZINC000012787086 571101051 /nfs/dbraw/zinc/10/10/51/571101051.db2.gz LLLIIBJXKOCFPI-UHFFFAOYSA-N 1 1 353.418 3.626 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)c3ccccc3Br)sc2C1 ZINC000012793578 571104656 /nfs/dbraw/zinc/10/46/56/571104656.db2.gz STZAXKJZFDOHKL-UHFFFAOYSA-N 1 1 366.284 3.536 50 0 FHAAMO CCN(CC(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C)c1ccccc1 ZINC000070004335 571107547 /nfs/dbraw/zinc/10/75/47/571107547.db2.gz AWSIIJSYLNXIAS-LJQANCHMSA-N 1 1 359.901 3.585 50 0 FHAAMO O=C(c1ccccn1)[C@H]1CCC[N@H+](Cc2cncn2C2CCCCC2)C1 ZINC000241081853 571109275 /nfs/dbraw/zinc/10/92/75/571109275.db2.gz YRFGRTMHYZXVER-KRWDZBQOSA-N 1 1 352.482 3.878 50 0 FHAAMO O=C(c1ccccn1)[C@H]1CCC[N@@H+](Cc2cncn2C2CCCCC2)C1 ZINC000241081853 571109276 /nfs/dbraw/zinc/10/92/76/571109276.db2.gz YRFGRTMHYZXVER-KRWDZBQOSA-N 1 1 352.482 3.878 50 0 FHAAMO CC1CC[NH+](CC(=O)N2N=C(c3ccco3)C[C@@H]2c2cccs2)CC1 ZINC000032510548 571110220 /nfs/dbraw/zinc/11/02/20/571110220.db2.gz UVTYBRSDPCVLAM-MRXNPFEDSA-N 1 1 357.479 3.751 50 0 FHAAMO CCOC(=O)c1c(C)oc2nc(C)nc(NCC[N@@H+](C)C3CCCCC3)c21 ZINC000015727446 571110632 /nfs/dbraw/zinc/11/06/32/571110632.db2.gz KYMVCUBJFGZNOU-UHFFFAOYSA-N 1 1 374.485 3.693 50 0 FHAAMO O=C(CC[N@H+]1CCCC[C@@H]1c1nc2cc(F)ccc2[nH]1)Nc1cccnc1 ZINC000244673838 571114249 /nfs/dbraw/zinc/11/42/49/571114249.db2.gz HWNGDJCNJJGPKA-GOSISDBHSA-N 1 1 367.428 3.653 50 0 FHAAMO O=C(CC[N@@H+]1CCCC[C@@H]1c1nc2cc(F)ccc2[nH]1)Nc1cccnc1 ZINC000244673838 571114252 /nfs/dbraw/zinc/11/42/52/571114252.db2.gz HWNGDJCNJJGPKA-GOSISDBHSA-N 1 1 367.428 3.653 50 0 FHAAMO CN1CC[N@@H+](Cc2ccc3c4c2cccc4C(=O)OC3)C[C@@H]1c1ccccc1 ZINC000244691761 571114308 /nfs/dbraw/zinc/11/43/08/571114308.db2.gz JIVAPZRTILCRGT-JOCHJYFZSA-N 1 1 372.468 3.999 50 0 FHAAMO CCOc1ccccc1NC(=O)CC[N@@H+]1CCCC[C@@H]1c1cc(C)on1 ZINC000244795948 571117453 /nfs/dbraw/zinc/11/74/53/571117453.db2.gz RQFGKZHRUKMBCV-GOSISDBHSA-N 1 1 357.454 3.938 50 0 FHAAMO CCOc1ccccc1NC(=O)CC[N@H+]1CCCC[C@@H]1c1cc(C)on1 ZINC000244795948 571117454 /nfs/dbraw/zinc/11/74/54/571117454.db2.gz RQFGKZHRUKMBCV-GOSISDBHSA-N 1 1 357.454 3.938 50 0 FHAAMO Cc1cc(C)n(-c2ccc(NC(=O)N3CC([N@@H+]4CCCC[C@@H]4C)C3)cc2)n1 ZINC000244852501 571117793 /nfs/dbraw/zinc/11/77/93/571117793.db2.gz UTNXLGFIEFVSKJ-INIZCTEOSA-N 1 1 367.497 3.580 50 0 FHAAMO Cc1ccc(NC(=O)CC[N@@H+]2CCC[C@@H](c3nccn3C)C2)cc1Cl ZINC000244882426 571118606 /nfs/dbraw/zinc/11/86/06/571118606.db2.gz XRMATJQYSZMNRT-OAHLLOKOSA-N 1 1 360.889 3.590 50 0 FHAAMO CCCCc1ccc(-n2cc(C[NH2+][C@H](C)Cc3cc(C)[nH]n3)cn2)cc1 ZINC000055575536 571121105 /nfs/dbraw/zinc/12/11/05/571121105.db2.gz WCQPVRSTFKLGIF-MRXNPFEDSA-N 1 1 351.498 3.967 50 0 FHAAMO Cc1nn(C)c(C)c1C[N@H+](Cc1c[nH]nc1-c1ccc(F)cc1)C(C)C ZINC000055575677 571121391 /nfs/dbraw/zinc/12/13/91/571121391.db2.gz PYBHTEAEITUKDD-UHFFFAOYSA-N 1 1 355.461 3.977 50 0 FHAAMO C[N@H+](Cc1ccc2c(c1)OCCO2)Cc1cc(Cl)cc2c1OCOC2 ZINC000042367055 571122014 /nfs/dbraw/zinc/12/20/14/571122014.db2.gz JEPASMYSCVKMGG-UHFFFAOYSA-N 1 1 361.825 3.610 50 0 FHAAMO C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1cc(Cl)cc2c1OCOC2 ZINC000042367055 571122016 /nfs/dbraw/zinc/12/20/16/571122016.db2.gz JEPASMYSCVKMGG-UHFFFAOYSA-N 1 1 361.825 3.610 50 0 FHAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc4ccccc4n3C)CC2)cc1 ZINC000248094133 571127943 /nfs/dbraw/zinc/12/79/43/571127943.db2.gz WVJKWTBCDGZLBF-UHFFFAOYSA-N 1 1 362.477 3.732 50 0 FHAAMO CCCCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000248229097 571128175 /nfs/dbraw/zinc/12/81/75/571128175.db2.gz KDUBFNQGNXGPIS-SFHVURJKSA-N 1 1 370.541 3.917 50 0 FHAAMO Cc1ncsc1CC[N@H+](C)Cc1ccc2c3c1cccc3C(=O)OC2 ZINC000252499407 571133353 /nfs/dbraw/zinc/13/33/53/571133353.db2.gz SADCTAOBGGHSGV-UHFFFAOYSA-N 1 1 352.459 3.950 50 0 FHAAMO Cc1cccc(NC(=O)C[N@@H+]2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1C ZINC000012906056 571143378 /nfs/dbraw/zinc/14/33/78/571143378.db2.gz WYKUSAGBXRUAQA-GOSISDBHSA-N 1 1 365.477 3.593 50 0 FHAAMO Cc1cccc(NC(=O)C[N@H+]2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1C ZINC000012906056 571143380 /nfs/dbraw/zinc/14/33/80/571143380.db2.gz WYKUSAGBXRUAQA-GOSISDBHSA-N 1 1 365.477 3.593 50 0 FHAAMO c1cc(C[NH+]2CCN(c3ncnc4c5ccccc5oc43)CC2)cs1 ZINC000012922044 571145420 /nfs/dbraw/zinc/14/54/20/571145420.db2.gz PNKKCZAIVAATHW-UHFFFAOYSA-N 1 1 350.447 3.760 50 0 FHAAMO COCCNC(=O)[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2ccc(F)cc2)C1 ZINC000034669583 571147424 /nfs/dbraw/zinc/14/74/24/571147424.db2.gz KHOMTMIIGQZDQS-TZIWHRDSSA-N 1 1 370.468 3.542 50 0 FHAAMO CCN(C)c1cc[nH+]c(NCc2cccnc2N2CCc3ccccc3C2)n1 ZINC000067909269 571151789 /nfs/dbraw/zinc/15/17/89/571151789.db2.gz GWRUDPYXULGFGK-UHFFFAOYSA-N 1 1 374.492 3.503 50 0 FHAAMO CC(C)NC(=O)[C@@H](C)[N@@H+]1CCc2onc(-c3cccc4ccccc43)c2C1 ZINC000071315333 571160668 /nfs/dbraw/zinc/16/06/68/571160668.db2.gz HQNOBMWXNCOGLA-OAHLLOKOSA-N 1 1 363.461 3.766 50 0 FHAAMO CC(C)NC(=O)[C@@H](C)[N@H+]1CCc2onc(-c3cccc4ccccc43)c2C1 ZINC000071315333 571160671 /nfs/dbraw/zinc/16/06/71/571160671.db2.gz HQNOBMWXNCOGLA-OAHLLOKOSA-N 1 1 363.461 3.766 50 0 FHAAMO CC(=O)NCC[N@@H+]1CCC[C@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 ZINC000071439639 571161542 /nfs/dbraw/zinc/16/15/42/571161542.db2.gz GSKUDWPBAKWROH-IBGZPJMESA-N 1 1 366.461 3.510 50 0 FHAAMO CC(=O)NCC[N@H+]1CCC[C@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 ZINC000071439639 571161543 /nfs/dbraw/zinc/16/15/43/571161543.db2.gz GSKUDWPBAKWROH-IBGZPJMESA-N 1 1 366.461 3.510 50 0 FHAAMO COc1ccc(OC)c([C@@H](C)NC(=O)C[N@H+]2CCC[C@@H]2C2CCCCC2)c1 ZINC000075358642 571162619 /nfs/dbraw/zinc/16/26/19/571162619.db2.gz ZXQDMCKJNVRGKZ-OXQOHEQNSA-N 1 1 374.525 3.926 50 0 FHAAMO CCc1cc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)on1 ZINC000071747928 571164599 /nfs/dbraw/zinc/16/45/99/571164599.db2.gz POPRJHLKERBDGM-IBGZPJMESA-N 1 1 373.472 3.749 50 0 FHAAMO CC(=O)NC1CC[NH+](Cc2nc(-c3ccc4ccccc4c3)oc2C)CC1 ZINC000071753029 571164852 /nfs/dbraw/zinc/16/48/52/571164852.db2.gz VZRGPIDFONDVSH-UHFFFAOYSA-N 1 1 363.461 3.904 50 0 FHAAMO c1n[nH]cc1CC[N@@H+]1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 ZINC000071755220 571165345 /nfs/dbraw/zinc/16/53/45/571165345.db2.gz YYHIHLOKCNIBDE-QFIPXVFZSA-N 1 1 361.489 3.875 50 0 FHAAMO c1n[nH]cc1CC[N@H+]1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 ZINC000071755220 571165347 /nfs/dbraw/zinc/16/53/47/571165347.db2.gz YYHIHLOKCNIBDE-QFIPXVFZSA-N 1 1 361.489 3.875 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2cccc3ncccc32)CCC[N@H+]1CC1CC1 ZINC000071758950 571165537 /nfs/dbraw/zinc/16/55/37/571165537.db2.gz JUSYFAPUAGKQMV-NRFANRHFSA-N 1 1 351.494 3.817 50 0 FHAAMO CC(C)[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)CCC(=O)N1CC1CC1 ZINC000071770949 571166297 /nfs/dbraw/zinc/16/62/97/571166297.db2.gz HFLLLABCWXIAIA-NRFANRHFSA-N 1 1 351.494 3.704 50 0 FHAAMO CC(=O)c1c(C)cc(C)c(C[N@H+]2CCCN(Cc3cccnc3)CC2)c1C ZINC000072120849 571170060 /nfs/dbraw/zinc/17/00/60/571170060.db2.gz BPEXKNYWHQCIAL-UHFFFAOYSA-N 1 1 365.521 3.917 50 0 FHAAMO COc1cccc(CN2CCC[C@]3(CC[N@@H+](CC4CCC4)C3)C2)c1OC ZINC000072145524 571173074 /nfs/dbraw/zinc/17/30/74/571173074.db2.gz WIUMHUIGLWQYTB-QFIPXVFZSA-N 1 1 358.526 3.792 50 0 FHAAMO COc1cccc([C@H]2C[N@H+](Cc3csc(C)n3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000072148269 571173841 /nfs/dbraw/zinc/17/38/41/571173841.db2.gz DRGKURWKOCKNJW-NJDAHSKKSA-N 1 1 369.534 3.522 50 0 FHAAMO COc1cccc([C@H]2C[N@@H+](Cc3csc(C)n3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000072148269 571173844 /nfs/dbraw/zinc/17/38/44/571173844.db2.gz DRGKURWKOCKNJW-NJDAHSKKSA-N 1 1 369.534 3.522 50 0 FHAAMO CCNC(=O)CC[N@H+]1CCC[C@H](CCc2ccccc2C(F)(F)F)C1 ZINC000072154339 571174761 /nfs/dbraw/zinc/17/47/61/571174761.db2.gz ILVDOUXBPABZTA-OAHLLOKOSA-N 1 1 356.432 3.876 50 0 FHAAMO C[C@H](CNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)[N@H+]1CCc2sccc2C1 ZINC000229797529 571178342 /nfs/dbraw/zinc/17/83/42/571178342.db2.gz IKJLNWBFGAVJHZ-UMVBOHGHSA-N 1 1 374.472 3.980 50 0 FHAAMO C[C@H](CNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)[N@@H+]1CCc2sccc2C1 ZINC000229797529 571178341 /nfs/dbraw/zinc/17/83/41/571178341.db2.gz IKJLNWBFGAVJHZ-UMVBOHGHSA-N 1 1 374.472 3.980 50 0 FHAAMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2nc(C3CC3)sc2n1 ZINC000035509772 571179583 /nfs/dbraw/zinc/17/95/83/571179583.db2.gz BVVVVPUIWXMKKQ-UHFFFAOYSA-N 1 1 372.469 3.580 50 0 FHAAMO Cc1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000012987460 571184686 /nfs/dbraw/zinc/18/46/86/571184686.db2.gz APACRZLRLVQGDM-QGZVFWFLSA-N 1 1 363.465 3.516 50 0 FHAAMO Cc1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000012987460 571184689 /nfs/dbraw/zinc/18/46/89/571184689.db2.gz APACRZLRLVQGDM-QGZVFWFLSA-N 1 1 363.465 3.516 50 0 FHAAMO Cc1ccc(C[N@H+]2CCN(Cc3nc(C(C)C)cs3)C[C@H]2CCO)cc1 ZINC000036385729 571192430 /nfs/dbraw/zinc/19/24/30/571192430.db2.gz VMABZOBXPWMPLC-LJQANCHMSA-N 1 1 373.566 3.644 50 0 FHAAMO Cc1ccc(C[N@@H+]2CCN(Cc3nc(C(C)C)cs3)C[C@H]2CCO)cc1 ZINC000036385729 571192433 /nfs/dbraw/zinc/19/24/33/571192433.db2.gz VMABZOBXPWMPLC-LJQANCHMSA-N 1 1 373.566 3.644 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2ccc(OCc3ccccc3)cc2)C[C@H]1CCO ZINC000036385598 571192482 /nfs/dbraw/zinc/19/24/82/571192482.db2.gz JCLIVIBVRFANSX-JOCHJYFZSA-N 1 1 368.521 3.543 50 0 FHAAMO CC(C)CC[N@H+]1CCN(Cc2nc(-c3ccccc3)cs2)C[C@H]1CCO ZINC000036385574 571192535 /nfs/dbraw/zinc/19/25/35/571192535.db2.gz JIUKJZYANVENLE-LJQANCHMSA-N 1 1 373.566 3.725 50 0 FHAAMO C[C@H](C1CCN(Cc2cccc(C(F)(F)F)c2)CC1)[NH+]1CCOCC1 ZINC000072423302 571193510 /nfs/dbraw/zinc/19/35/10/571193510.db2.gz KXIHUZJVDVYACP-OAHLLOKOSA-N 1 1 356.432 3.638 50 0 FHAAMO Cc1nc2ccccc2nc1C[N@H+]1CCC[C@@H](C(=O)Cc2ccccc2)C1 ZINC000072432395 571195660 /nfs/dbraw/zinc/19/56/60/571195660.db2.gz SFQZMNMBCLCAEG-LJQANCHMSA-N 1 1 359.473 3.962 50 0 FHAAMO C[C@@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1cccc(-c2ccccn2)c1 ZINC000299776108 571196822 /nfs/dbraw/zinc/19/68/22/571196822.db2.gz KJTJVDFVGDIEQF-SFHVURJKSA-N 1 1 371.484 3.925 50 0 FHAAMO O=C(Cc1cccc(C(F)(F)F)c1)NC[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000299777001 571196993 /nfs/dbraw/zinc/19/69/93/571196993.db2.gz GRIKWLNREHMFNK-HNNXBMFYSA-N 1 1 354.416 3.629 50 0 FHAAMO CCCc1cc(N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)n2nccc2n1 ZINC000072447638 571197042 /nfs/dbraw/zinc/19/70/42/571197042.db2.gz LKGRSVRMXACRPU-LJQANCHMSA-N 1 1 363.509 3.640 50 0 FHAAMO O=C(NCc1ccc(F)cc1F)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299779354 571197598 /nfs/dbraw/zinc/19/75/98/571197598.db2.gz FGGPXAGWDZDRJE-SXLOBPIMSA-N 1 1 356.416 3.807 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3cnc(-c4ccccc4C)s3)[C@H]1C[C@@H](O)CC2 ZINC000299779341 571197730 /nfs/dbraw/zinc/19/77/30/571197730.db2.gz FDJXYHNNBRBTMR-ZAAXVRCTSA-N 1 1 358.507 3.623 50 0 FHAAMO Cn1cc(C[N@H+](C)Cc2ccc(OCC(F)F)cc2)c(C(F)(F)F)n1 ZINC000092068866 571198100 /nfs/dbraw/zinc/19/81/00/571198100.db2.gz DRIMOEWYIMFXJB-UHFFFAOYSA-N 1 1 363.330 3.715 50 0 FHAAMO Cn1cc(C[N@@H+](C)Cc2ccc(OCC(F)F)cc2)c(C(F)(F)F)n1 ZINC000092068866 571198101 /nfs/dbraw/zinc/19/81/01/571198101.db2.gz DRIMOEWYIMFXJB-UHFFFAOYSA-N 1 1 363.330 3.715 50 0 FHAAMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@]4(CN(C)C(=O)O4)C3)o2)cc1 ZINC000072475690 571198934 /nfs/dbraw/zinc/19/89/34/571198934.db2.gz VZCJOYSZRQURSZ-IBGZPJMESA-N 1 1 358.463 3.766 50 0 FHAAMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@]4(CN(C)C(=O)O4)C3)o2)cc1 ZINC000072475690 571198935 /nfs/dbraw/zinc/19/89/35/571198935.db2.gz VZCJOYSZRQURSZ-IBGZPJMESA-N 1 1 358.463 3.766 50 0 FHAAMO CSCC[NH+]1CCN(C(=O)c2ccccc2-c2cccc(C)c2)CC1 ZINC000299783643 571198954 /nfs/dbraw/zinc/19/89/54/571198954.db2.gz WEGWEIYJFOCWRT-UHFFFAOYSA-N 1 1 354.519 3.783 50 0 FHAAMO Cc1cc2c([nH]c(C[N@@H+](C)Cc3cccc4ncccc34)nc2=O)s1 ZINC000299792932 571201400 /nfs/dbraw/zinc/20/14/00/571201400.db2.gz GFRDDYFDWICUQR-UHFFFAOYSA-N 1 1 350.447 3.886 50 0 FHAAMO Cc1cc2c([nH]c(C[N@H+](C)Cc3cccc4ncccc34)nc2=O)s1 ZINC000299792932 571201401 /nfs/dbraw/zinc/20/14/01/571201401.db2.gz GFRDDYFDWICUQR-UHFFFAOYSA-N 1 1 350.447 3.886 50 0 FHAAMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc(Cl)cnc2Cl)CC1 ZINC000022345026 571201806 /nfs/dbraw/zinc/20/18/06/571201806.db2.gz ZLRSKMFLGZKQNW-ZDUSSCGKSA-N 1 1 364.276 3.907 50 0 FHAAMO Oc1cccc(CC[C@H]2CCCC[N@H+]2Cc2nc(-c3ccccn3)no2)c1 ZINC000076961885 571205776 /nfs/dbraw/zinc/20/57/76/571205776.db2.gz DQGHERYSIPJBQK-QGZVFWFLSA-N 1 1 364.449 3.825 50 0 FHAAMO c1ccc(OCCC[N@H+]2CCC[C@H]2c2nc(-c3ccccn3)no2)cc1 ZINC000077286699 571206283 /nfs/dbraw/zinc/20/62/83/571206283.db2.gz YFABOBRETJWPIS-SFHVURJKSA-N 1 1 350.422 3.738 50 0 FHAAMO Fc1cccc(-n2cc(C[N@H+]3CCCC[C@@H]3CCn3ccnc3)cn2)c1 ZINC000077299534 571206824 /nfs/dbraw/zinc/20/68/24/571206824.db2.gz YRPYMLSXGIQGPN-LJQANCHMSA-N 1 1 353.445 3.653 50 0 FHAAMO O=C1CCCN1CC[C@H]1CCCC[N@H+]1Cc1cnc(C2CCCCC2)nc1 ZINC000077344079 571208432 /nfs/dbraw/zinc/20/84/32/571208432.db2.gz LYVBHLZEUQJJEU-HXUWFJFHSA-N 1 1 370.541 3.891 50 0 FHAAMO CCn1cc(C[N@H+]2CCC[C@@H](c3n[nH]cc3-c3ccc(F)cc3)C2)cn1 ZINC000077376658 571209313 /nfs/dbraw/zinc/20/93/13/571209313.db2.gz RWVKXMFKOJUDFC-QGZVFWFLSA-N 1 1 353.445 3.812 50 0 FHAAMO CCN1CC2(CC[NH+](Cc3cc(F)ccc3C(F)(F)F)CC2)OC1=O ZINC000077378382 571209475 /nfs/dbraw/zinc/20/94/75/571209475.db2.gz PSNQZJKSFUSSTO-UHFFFAOYSA-N 1 1 360.351 3.651 50 0 FHAAMO Cc1nccn1CC[C@H]1CCCC[N@H+]1Cc1cnc(N2CCCC2)s1 ZINC000077408131 571210773 /nfs/dbraw/zinc/21/07/73/571210773.db2.gz UUFRBPTYABMHGI-QGZVFWFLSA-N 1 1 359.543 3.693 50 0 FHAAMO C[C@@H](C(=O)N(C)Cc1cccc2cnccc21)[N@H+]1CCc2ccccc2C1 ZINC000077458758 571212228 /nfs/dbraw/zinc/21/22/28/571212228.db2.gz YOALMHSVVZZWBF-KRWDZBQOSA-N 1 1 359.473 3.640 50 0 FHAAMO Cn1c(C[N@H+]2CCC[C@@]3(CCC(=O)N(C4CC4)C3)C2)cc2ccccc21 ZINC000077485539 571213171 /nfs/dbraw/zinc/21/31/71/571213171.db2.gz YRQRVFBWVNRMFV-JOCHJYFZSA-N 1 1 351.494 3.545 50 0 FHAAMO Cn1ccnc1C(=O)[C@H]1CCC[N@H+](Cc2cccc(C(F)(F)F)c2)C1 ZINC000077486783 571213468 /nfs/dbraw/zinc/21/34/68/571213468.db2.gz KJIHJAQKLOXUJC-AWEZNQCLSA-N 1 1 351.372 3.534 50 0 FHAAMO Cn1ccnc1C(=O)[C@H]1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2)C1 ZINC000077486783 571213471 /nfs/dbraw/zinc/21/34/71/571213471.db2.gz KJIHJAQKLOXUJC-AWEZNQCLSA-N 1 1 351.372 3.534 50 0 FHAAMO COc1ccc(Cl)cc1-c1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)C2)cc1 ZINC000426360060 571215039 /nfs/dbraw/zinc/21/50/39/571215039.db2.gz ZRMTUOIPYNMTMS-KRWDZBQOSA-N 1 1 358.869 3.792 50 0 FHAAMO CC(C)CCC[N@H+]1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 ZINC000077540803 571215031 /nfs/dbraw/zinc/21/50/31/571215031.db2.gz VBFVYNLOMRLOBD-JOCHJYFZSA-N 1 1 357.542 3.765 50 0 FHAAMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(-c3nc4ccccc4[nH]3)cc1)C2 ZINC000426508144 571229063 /nfs/dbraw/zinc/22/90/63/571229063.db2.gz UJRINCAVRNAEPK-HSZRJFAPSA-N 1 1 374.488 3.788 50 0 FHAAMO CCCO[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(C)[nH+]c3N)cc2)C1 ZINC000426534374 571230489 /nfs/dbraw/zinc/23/04/89/571230489.db2.gz DWMGPUKVNDFTIW-GOSISDBHSA-N 1 1 353.466 3.670 50 0 FHAAMO CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)NCCC[N@@H+](C)C1CCCC1 ZINC000426546040 571231236 /nfs/dbraw/zinc/23/12/36/571231236.db2.gz BUBQAMHOHNUCTI-UHFFFAOYSA-N 1 1 360.477 3.713 50 0 FHAAMO C[C@H]1CCCC[N@H+]1C1CN(C(=O)NCc2ccc(Cl)cc2Cl)C1 ZINC000426584100 571232484 /nfs/dbraw/zinc/23/24/84/571232484.db2.gz SKUBGWWHGMXPCW-LBPRGKRZSA-N 1 1 356.297 3.762 50 0 FHAAMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(-c3cc(F)ccc3C(C)=O)cc2)C1 ZINC000426712852 571236233 /nfs/dbraw/zinc/23/62/33/571236233.db2.gz XOWVHBZPOFWCEJ-INIZCTEOSA-N 1 1 368.452 3.767 50 0 FHAAMO COc1c2c(cc3c1[C@@H](CC(=O)[C@@H]1CC=C(C)CC1)[N@H+](C)CC3)OCO2 ZINC000033348726 571236597 /nfs/dbraw/zinc/23/65/97/571236597.db2.gz XPECFPNIEZESQR-GDBMZVCRSA-N 1 1 357.450 3.659 50 0 FHAAMO COc1c2c(cc3c1[C@@H](CC(=O)[C@@H]1CC=C(C)CC1)[N@@H+](C)CC3)OCO2 ZINC000033348726 571236598 /nfs/dbraw/zinc/23/65/98/571236598.db2.gz XPECFPNIEZESQR-GDBMZVCRSA-N 1 1 357.450 3.659 50 0 FHAAMO CCc1ncc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](C)C3)cn1 ZINC000091255929 571238612 /nfs/dbraw/zinc/23/86/12/571238612.db2.gz GGTBLLBOOORESH-NRFANRHFSA-N 1 1 364.537 3.741 50 0 FHAAMO CCc1ncc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@@H+](C)C3)cn1 ZINC000091255929 571238613 /nfs/dbraw/zinc/23/86/13/571238613.db2.gz GGTBLLBOOORESH-NRFANRHFSA-N 1 1 364.537 3.741 50 0 FHAAMO Cc1noc(C)c1C[N@H+]1C[C@@H]2CC[C@H](C1)N(C(=O)c1cccc(Cl)c1)C2 ZINC000091593809 571241112 /nfs/dbraw/zinc/24/11/12/571241112.db2.gz WIQGFGNGPXZIIC-MAUKXSAKSA-N 1 1 373.884 3.681 50 0 FHAAMO CC(C)=CC[N@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccc1N1CCCC1)C2 ZINC000091636280 571241622 /nfs/dbraw/zinc/24/16/22/571241622.db2.gz IIRCWJYMOBMPPD-WOJBJXKFSA-N 1 1 367.537 3.789 50 0 FHAAMO CC[C@H](C)[N@H+](Cc1cccc(OC)c1)C[C@@H](O)COCc1ccccc1 ZINC000169681705 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Cc1ccc([C@@H](CNC(=O)c2cccc(-c3ccc(O)cc3)c2)[NH+](C)C)o1 ZINC000055211736 205211733 /nfs/dbraw/zinc/21/17/33/205211733.db2.gz ONJWIRQKCCRAKK-HXUWFJFHSA-N 1 1 364.445 3.993 50 0 FHAAMO Fc1cccc(N[C@H]2CCC[N@@H+](Cc3cnc(N4CCCC4)s3)C2)c1 ZINC000055243157 205211846 /nfs/dbraw/zinc/21/18/46/205211846.db2.gz ZRMYVGCTFKWYIL-KRWDZBQOSA-N 1 1 360.502 3.959 50 0 FHAAMO COc1ccccc1CC[N@H+]1CCC[C@H](CN(C)Cc2cccc(C)n2)C1 ZINC000055270573 205212456 /nfs/dbraw/zinc/21/24/56/205212456.db2.gz GBICBKSTNMWILN-HXUWFJFHSA-N 1 1 367.537 3.785 50 0 FHAAMO CC(C)(CN1CCOCC1)C[N@@H+](Cc1ccncc1)Cc1ccc(F)cc1 ZINC000055253549 205212658 /nfs/dbraw/zinc/21/26/58/205212658.db2.gz BTCBRWSOMXGZNR-UHFFFAOYSA-N 1 1 371.500 3.581 50 0 FHAAMO CCOc1ccccc1C[N@@H+](CCn1c2ccccc2oc1=O)C1CC1 ZINC000055325532 205214250 /nfs/dbraw/zinc/21/42/50/205214250.db2.gz SZQHXRBFKIUVAF-UHFFFAOYSA-N 1 1 352.434 3.658 50 0 FHAAMO Cc1cc(NC(=O)C[NH2+][C@@H](c2cccs2)c2ccc3c(c2)CCC3)no1 ZINC000053814204 205196750 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C[N@@H+](CCCNC(=O)C1(c2cccc(F)c2)CCC1)Cc1ccccc1 ZINC000058612555 205277422 /nfs/dbraw/zinc/27/74/22/205277422.db2.gz GNVKHARSMDVWBE-UHFFFAOYSA-N 1 1 354.469 3.886 50 0 FHAAMO COc1ccccc1-c1cc(C[NH2+]CC(=O)Nc2cccc(C)c2C)on1 ZINC000065455272 205352007 /nfs/dbraw/zinc/35/20/07/205352007.db2.gz LHDPXCHVDMLPCQ-UHFFFAOYSA-N 1 1 365.433 3.695 50 0 FHAAMO CC[C@H]1COCC[N@@H+]1Cc1ccc(C(=O)Nc2c(C)cccc2OC)cc1 ZINC000065488802 205353826 /nfs/dbraw/zinc/35/38/26/205353826.db2.gz BSQLGTLDOZCZHZ-IBGZPJMESA-N 1 1 368.477 3.867 50 0 FHAAMO CC[C@H]1COCC[N@H+]1Cc1ccc(C(=O)Nc2c(C)cccc2OC)cc1 ZINC000065488802 205353831 /nfs/dbraw/zinc/35/38/31/205353831.db2.gz BSQLGTLDOZCZHZ-IBGZPJMESA-N 1 1 368.477 3.867 50 0 FHAAMO COC(=O)c1cccc(C[N@H+]2CC[C@@H](c3ccnc(-c4ccccc4)c3)C2)n1 ZINC000065385571 205342896 /nfs/dbraw/zinc/34/28/96/205342896.db2.gz CCQKHTIIYAVLML-LJQANCHMSA-N 1 1 373.456 3.920 50 0 FHAAMO Cc1nn(C)cc1NC(=O)c1cccc(C[N@@H+](C)Cc2ccccc2C)c1 ZINC000067559377 205374929 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Oc1cccc([C@@H]2C[N@@H+](Cc3cccc(F)c3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000095383307 205746025 /nfs/dbraw/zinc/74/60/25/205746025.db2.gz WOYJAZIAYAJRQO-BHDDXSALSA-N 1 1 352.453 3.594 50 0 FHAAMO Oc1cccc([C@@H]2CN(Cc3cccc(F)c3)[C@H]3[C@@H]2[NH+]2CCC3CC2)c1 ZINC000095383307 205746027 /nfs/dbraw/zinc/74/60/27/205746027.db2.gz WOYJAZIAYAJRQO-BHDDXSALSA-N 1 1 352.453 3.594 50 0 FHAAMO COCc1ccc(C(=O)NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)o1 ZINC000097327225 205905216 /nfs/dbraw/zinc/90/52/16/205905216.db2.gz ZLJRAWSHGKUJHO-INIZCTEOSA-N 1 1 356.466 3.730 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(F)ccc1Br ZINC000046989774 206080422 /nfs/dbraw/zinc/08/04/22/206080422.db2.gz CFGZQYWWNQEZEE-CYBMUJFWSA-N 1 1 371.294 3.973 50 0 FHAAMO O=C(Nc1ccccc1)[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000247034625 206126825 /nfs/dbraw/zinc/12/68/25/206126825.db2.gz ZXVIYFJEAQCEJQ-YADHBBJMSA-N 1 1 373.456 3.915 50 0 FHAAMO O=C(Nc1ccccc1)[C@H](c1ccccc1)[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000247034625 206126831 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50 0 FHAAMO O=S(=O)(NC[C@H](c1ccsc1)[NH+]1CCCC1)c1ccccc1Cl ZINC000008899602 206219334 /nfs/dbraw/zinc/21/93/34/206219334.db2.gz FIGAMRCAPYIKSU-OAHLLOKOSA-N 1 1 370.927 3.517 50 0 FHAAMO C[N@@H+](CC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)C1CCCC1 ZINC000053436532 206291628 /nfs/dbraw/zinc/29/16/28/206291628.db2.gz RQVDPMBGQIZIRC-INIZCTEOSA-N 1 1 357.479 3.893 50 0 FHAAMO CCc1cc2c(C[N@@H+](C)CCOc3ccccc3C)cc(=O)oc2cc1O ZINC000012934998 206298784 /nfs/dbraw/zinc/29/87/84/206298784.db2.gz CRIPNBLBAVOHBY-UHFFFAOYSA-N 1 1 367.445 3.880 50 0 FHAAMO O=C(c1cc(C2CC2)on1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000178588858 206304200 /nfs/dbraw/zinc/30/42/00/206304200.db2.gz ZELWIXISQVUZJQ-QUCCMNQESA-N 1 1 365.477 3.679 50 0 FHAAMO O=C(CCc1c[nH]c2ccccc12)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000013010381 206300494 /nfs/dbraw/zinc/30/04/94/206300494.db2.gz GOIFPJRCNPGYEF-UHFFFAOYSA-N 1 1 361.489 3.835 50 0 FHAAMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000106920914 206313222 /nfs/dbraw/zinc/31/32/22/206313222.db2.gz XJJBWQQJHGVOFC-OLZOCXBDSA-N 1 1 358.313 3.594 50 0 FHAAMO C[NH+]1CCN(C(=O)C[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000016623479 206318933 /nfs/dbraw/zinc/31/89/33/206318933.db2.gz WBZFBXFFMLVAQT-IBGZPJMESA-N 1 1 360.860 3.775 50 0 FHAAMO C[NH+]1CCN(C(=O)C[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000016623476 206319479 /nfs/dbraw/zinc/31/94/79/206319479.db2.gz WBZFBXFFMLVAQT-LJQANCHMSA-N 1 1 360.860 3.775 50 0 FHAAMO Brc1csc(CN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000019536737 206325660 /nfs/dbraw/zinc/32/56/60/206325660.db2.gz GCEPSCXYHDQARD-UHFFFAOYSA-N 1 1 351.313 3.828 50 0 FHAAMO C[C@H](Cc1cnccn1)[N@@H+](C)Cc1c(-c2ccccc2)nc2ccccn21 ZINC000215362170 206345666 /nfs/dbraw/zinc/34/56/66/206345666.db2.gz UGPSTGFQICQPMJ-QGZVFWFLSA-N 1 1 357.461 3.854 50 0 FHAAMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)sc2Cl)C[C@@H](C)O1 ZINC000021058346 206347091 /nfs/dbraw/zinc/34/70/91/206347091.db2.gz GRYMIBSKCIVZBF-NXEZZACHSA-N 1 1 365.326 3.673 50 0 FHAAMO Cn1cccc1[C@@H](CNC(=O)c1ccccc1)[N@@H+]1CCc2ccccc2C1 ZINC000021151863 206351878 /nfs/dbraw/zinc/35/18/78/206351878.db2.gz MYHPLDYLJLGNKX-JOCHJYFZSA-N 1 1 359.473 3.555 50 0 FHAAMO Cn1cccc1[C@@H](CNC(=O)c1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000021151863 206351881 /nfs/dbraw/zinc/35/18/81/206351881.db2.gz MYHPLDYLJLGNKX-JOCHJYFZSA-N 1 1 359.473 3.555 50 0 FHAAMO C[C@@H](CCn1cccn1)[N@H+]1CCc2nc(-c3ccc(Cl)cc3)[nH]c2C1 ZINC000215853459 206352644 /nfs/dbraw/zinc/35/26/44/206352644.db2.gz GUVNDNAROAQNEK-AWEZNQCLSA-N 1 1 355.873 3.764 50 0 FHAAMO COc1ccc2[nH]c(=O)c(C[N@@H+]3CCCC[C@H]3c3nccs3)cc2c1 ZINC000216099902 206353056 /nfs/dbraw/zinc/35/30/56/206353056.db2.gz WTNQVPUEUWOQLH-KRWDZBQOSA-N 1 1 355.463 3.720 50 0 FHAAMO COc1ccc2[nH]c(=O)c(C[N@H+]3CCCC[C@H]3c3nccs3)cc2c1 ZINC000216099902 206353061 /nfs/dbraw/zinc/35/30/61/206353061.db2.gz WTNQVPUEUWOQLH-KRWDZBQOSA-N 1 1 355.463 3.720 50 0 FHAAMO COc1cccc2c1OCC(C[N@H+]1CCC[C@H](OCc3ccccn3)C1)=C2 ZINC000216123428 206355382 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CC(C)[N@H+]1CC[C@@H](CNC(=O)N(Cc2c(F)cccc2Cl)C2CC2)C1 ZINC000426674403 263655443 /nfs/dbraw/zinc/65/54/43/263655443.db2.gz ZWYXDYMSYVKOLR-AWEZNQCLSA-N 1 1 367.896 3.883 50 0 FHAAMO CCC[N@H+]1CCCn2nc(CNC(=O)Nc3ccc(SC)cc3)cc2C1 ZINC000082166840 519854542 /nfs/dbraw/zinc/85/45/42/519854542.db2.gz FLMRKAGJVQDYSU-UHFFFAOYSA-N 1 1 373.526 3.542 50 0 FHAAMO CCCC(=O)N[C@H](C)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288408 519876187 /nfs/dbraw/zinc/87/61/87/519876187.db2.gz ZPOBFBGXGLHTPU-DYESRHJHSA-N 1 1 371.550 3.916 50 0 FHAAMO CCOC[C@H]1CC[N@H+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1 ZINC000081522142 520182722 /nfs/dbraw/zinc/18/27/22/520182722.db2.gz WMMXOHNOHWSBNJ-JXFKEZNVSA-N 1 1 356.441 3.864 50 0 FHAAMO CCCCc1ncc(C[N@H+]2CCC[C@@H](NC(=O)Nc3ccccc3)CC2)[nH]1 ZINC000082096951 521294498 /nfs/dbraw/zinc/29/44/98/521294498.db2.gz LRIHZGZGFURAAX-GOSISDBHSA-N 1 1 369.513 3.929 50 0 FHAAMO CCCCc1nc(C[N@@H+]2CCC[C@@H](NC(=O)Nc3ccccc3)CC2)c[nH]1 ZINC000082096951 521294515 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C[N@H+]1Cc2ccccc2C[C@@H]1C(=O)N(Cc1ccccn1)C1CCCCC1 ZINC000095353160 570452141 /nfs/dbraw/zinc/45/21/41/570452141.db2.gz LMOUBKACUBHSKR-JOCHJYFZSA-N 1 1 363.505 3.800 50 0 FHAAMO Cc1ccc2nc(CN3C[C@H]4CC[C@@H]3C[N@@H+](Cc3ccccc3)C4)cn2c1 ZINC000095354929 570452577 /nfs/dbraw/zinc/45/25/77/570452577.db2.gz BSWPFBFJZDZEHH-RBBKRZOGSA-N 1 1 360.505 3.739 50 0 FHAAMO O=C(NCCCSc1ccccc1)[C@H](c1cccnc1)[NH+]1CCCC1 ZINC000095354285 570452642 /nfs/dbraw/zinc/45/26/42/570452642.db2.gz UWBXOCRWDXZSQY-IBGZPJMESA-N 1 1 355.507 3.517 50 0 FHAAMO CSCc1ccc(C(=O)N2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)o1 ZINC000095354924 570452775 /nfs/dbraw/zinc/45/27/75/570452775.db2.gz WFLCGAIIZCYZMC-QZTJIDSGSA-N 1 1 370.518 3.879 50 0 FHAAMO O=C(C[NH+]1CCC(c2ccccc2)CC1)N1CCC[C@@H]1c1nccs1 ZINC000095359484 570453942 /nfs/dbraw/zinc/45/39/42/570453942.db2.gz XLCDCBVHKUHTPD-GOSISDBHSA-N 1 1 355.507 3.686 50 0 FHAAMO Cc1noc(C)c1C(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@H+](C)C2 ZINC000095361923 570454294 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CN(Cc1n[nH]c2c1CCCC2)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000095380910 570458862 /nfs/dbraw/zinc/45/88/62/570458862.db2.gz OAEMYTFMOOWBLA-UHFFFAOYSA-N 1 1 366.509 3.547 50 0 FHAAMO O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000095380592 570458923 /nfs/dbraw/zinc/45/89/23/570458923.db2.gz HWSQXVIDFYPAQK-AWEZNQCLSA-N 1 1 371.868 3.943 50 0 FHAAMO CN(Cc1cccc2cnccc21)C(=O)[C@H](c1ccc(F)cc1)[NH+](C)C ZINC000095382522 570459365 /nfs/dbraw/zinc/45/93/65/570459365.db2.gz CPCQMBQCTPHTGA-FQEVSTJZSA-N 1 1 351.425 3.635 50 0 FHAAMO C[N@H+]1C[C@H](c2ccccc2)CC12CCN(C(=O)c1cncc(Cl)c1)CC2 ZINC000095499349 570462841 /nfs/dbraw/zinc/46/28/41/570462841.db2.gz LNEVLKKDUPUNSP-GOSISDBHSA-N 1 1 369.896 3.829 50 0 FHAAMO Cc1nc(C)c(C(=O)N2CCC3(C[C@@H](c4ccccc4)C[N@@H+]3C)CC2)s1 ZINC000095508157 570464854 /nfs/dbraw/zinc/46/48/54/570464854.db2.gz ZMWOMWBEGJSBFX-GOSISDBHSA-N 1 1 369.534 3.854 50 0 FHAAMO COc1ccc(-c2ccccc2NC(=O)NC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000095508138 570465046 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CC[C@H]1C[N@H+](Cc2cc(OC)ccc2OC)Cc2cc(OC)ccc2O1 ZINC000012279226 570731921 /nfs/dbraw/zinc/73/19/21/570731921.db2.gz JTLPMXQPUNQTTQ-KRWDZBQOSA-N 1 1 357.450 3.886 50 0 FHAAMO CC[C@H]1C[N@@H+](Cc2cc(OC)ccc2OC)Cc2cc(OC)ccc2O1 ZINC000012279226 570731922 /nfs/dbraw/zinc/73/19/22/570731922.db2.gz JTLPMXQPUNQTTQ-KRWDZBQOSA-N 1 1 357.450 3.886 50 0 FHAAMO CCOC(=O)N1CCC([N@H+]2CCC[C@H](C(=O)c3sccc3C)C2)CC1 ZINC000012298239 570733315 /nfs/dbraw/zinc/73/33/15/570733315.db2.gz DNEGFABWTHRIIH-HNNXBMFYSA-N 1 1 364.511 3.572 50 0 FHAAMO COCCC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(C(C)C)cc1)C2 ZINC000012301530 570733718 /nfs/dbraw/zinc/73/37/18/570733718.db2.gz CZKHWSGEPTVPMU-JOCHJYFZSA-N 1 1 358.526 3.661 50 0 FHAAMO COc1ccc(F)c(C[NH2+][C@H]2CCCc3nc(-c4cccnc4)ncc32)c1 ZINC000012385213 570740838 /nfs/dbraw/zinc/74/08/38/570740838.db2.gz FSABCTIAAUAQDR-IBGZPJMESA-N 1 1 364.424 3.854 50 0 FHAAMO O=C(c1ccc(F)c(Cl)c1)N1CC[C@@]2(C1)CCC[N@@H+](CC1CC1)C2 ZINC000012386155 570741455 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COc1ccc(C(=O)[C@@H]2CCC[N@@H+](CCc3ccccc3)C2)c(OC)c1 ZINC000012716603 570758427 /nfs/dbraw/zinc/75/84/27/570758427.db2.gz VIZRBIPQRDMKNH-GOSISDBHSA-N 1 1 353.462 3.841 50 0 FHAAMO CN(C(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000012942246 570767847 /nfs/dbraw/zinc/76/78/47/570767847.db2.gz FXTWFHAXCIXZIW-IBGZPJMESA-N 1 1 366.461 3.648 50 0 FHAAMO CN(C(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000012942246 570767851 /nfs/dbraw/zinc/76/78/51/570767851.db2.gz FXTWFHAXCIXZIW-IBGZPJMESA-N 1 1 366.461 3.648 50 0 FHAAMO CC(=O)c1c(C)cc(C)c(C[NH+]2CCN(c3ccccc3O)CC2)c1C ZINC000032668173 570768329 /nfs/dbraw/zinc/76/83/29/570768329.db2.gz DJWJIPGEMZQURB-UHFFFAOYSA-N 1 1 352.478 3.842 50 0 FHAAMO Cc1cc(C)cc(NC(=O)C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1 ZINC000012975247 570769738 /nfs/dbraw/zinc/76/97/38/570769738.db2.gz DYWRMMXOPPRNNR-SFHVURJKSA-N 1 1 365.477 3.593 50 0 FHAAMO Cc1cc(C)cc(NC(=O)C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1 ZINC000012975247 570769739 /nfs/dbraw/zinc/76/97/39/570769739.db2.gz DYWRMMXOPPRNNR-SFHVURJKSA-N 1 1 365.477 3.593 50 0 FHAAMO CCc1ccc(S(=O)(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000013112307 570773774 /nfs/dbraw/zinc/77/37/74/570773774.db2.gz HAJLSVZWWIZPKO-TZIWHRDSSA-N 1 1 370.518 3.554 50 0 FHAAMO COCc1ccc(C[N@H+]2CCC[C@H](CCC(=O)NCc3ccc(C)o3)C2)o1 ZINC000013594275 570779874 /nfs/dbraw/zinc/77/98/74/570779874.db2.gz GOJTWSLPNKAQJZ-QGZVFWFLSA-N 1 1 374.481 3.636 50 0 FHAAMO CC[C@H]1CCCC[N@H+]1CCCNS(=O)(=O)c1ccc2ccccc2c1 ZINC000013675742 570784207 /nfs/dbraw/zinc/78/42/07/570784207.db2.gz QLVOVSBALYNEJZ-IBGZPJMESA-N 1 1 360.523 3.773 50 0 FHAAMO CCc1ccccc1[C@@H](CC(=O)OC)[NH2+][C@@H]1C(C)=C(C)C(=O)N1C(C)(C)C ZINC000013893028 570795371 /nfs/dbraw/zinc/79/53/71/570795371.db2.gz BPEQGMXSCPTRIG-QUCCMNQESA-N 1 1 372.509 3.746 50 0 FHAAMO C[C@H](c1ccccc1Cl)[NH+]1CCN(Cn2ncsc2=S)CC1 ZINC000032770243 570797215 /nfs/dbraw/zinc/79/72/15/570797215.db2.gz VCFGHEOLKJCADG-GFCCVEGCSA-N 1 1 354.932 3.664 50 0 FHAAMO CC(=O)c1ccc(NC(=O)CC[N@@H+](C)CCOc2ccccc2C)cc1 ZINC000014079495 570803804 /nfs/dbraw/zinc/80/38/04/570803804.db2.gz SCLAZMFCAHPHAN-UHFFFAOYSA-N 1 1 354.450 3.537 50 0 FHAAMO O=C1C[C@@H]([NH+]2CCC(c3ccccc3)CC2)C(=O)N1c1ccc(Cl)cc1 ZINC000018222848 570815474 /nfs/dbraw/zinc/81/54/74/570815474.db2.gz ILTALOXCGYZEJN-LJQANCHMSA-N 1 1 368.864 3.852 50 0 FHAAMO CC(=O)N1CCC([N@H+]2CCC[C@H](C(=O)c3ccc(Cl)cc3C)C2)CC1 ZINC000014968580 570827398 /nfs/dbraw/zinc/82/73/98/570827398.db2.gz JOBMAYSEKHQQOS-INIZCTEOSA-N 1 1 362.901 3.554 50 0 FHAAMO Cc1occc1C(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(F)c(F)c1)C2 ZINC000014971880 570827483 /nfs/dbraw/zinc/82/74/83/570827483.db2.gz VOQGXUCNXBMLFV-OAQYLSRUSA-N 1 1 374.431 3.995 50 0 FHAAMO CSc1ccc(C[N@@H+]2CCC(=O)N(Cc3cccc(F)c3)CC2)cc1 ZINC000014988050 570828012 /nfs/dbraw/zinc/82/80/12/570828012.db2.gz WBCWLRBNWYLBAM-UHFFFAOYSA-N 1 1 358.482 3.782 50 0 FHAAMO Cc1c2ccc(C)c(C)c2oc1C(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000015062946 570830472 /nfs/dbraw/zinc/83/04/72/570830472.db2.gz XAAMGPSDYOCFKF-GOSISDBHSA-N 1 1 370.493 3.542 50 0 FHAAMO COc1cccc(CN2CC[N@@H+](CC3=CC[C@H]4C[C@@H]3C4(C)C)CCC2=O)c1 ZINC000015068271 570830958 /nfs/dbraw/zinc/83/09/58/570830958.db2.gz FIXNBIOHTRYAKZ-FPOVZHCZSA-N 1 1 368.521 3.722 50 0 FHAAMO CC[C@H](NC(=O)c1cc(Cn2cc[nH+]c2C(C)C)n[nH]1)c1cccs1 ZINC000015079185 570832668 /nfs/dbraw/zinc/83/26/68/570832668.db2.gz KCWXSRFNYUQJPN-AWEZNQCLSA-N 1 1 357.483 3.721 50 0 FHAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)NCCC2=CCCCC2)c(OC)c1 ZINC000015366920 570838248 /nfs/dbraw/zinc/83/82/48/570838248.db2.gz XNJLVLXJKHPJJL-HXUWFJFHSA-N 1 1 372.509 3.847 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)NCCC2=CCCCC2)c(OC)c1 ZINC000015366920 570838252 /nfs/dbraw/zinc/83/82/52/570838252.db2.gz XNJLVLXJKHPJJL-HXUWFJFHSA-N 1 1 372.509 3.847 50 0 FHAAMO Cc1ccc(-c2cc(C(=O)NC[C@@H](c3ccco3)[NH+]3CCCC3)no2)cc1 ZINC000015859718 570846009 /nfs/dbraw/zinc/84/60/09/570846009.db2.gz FFCNYBQJCPVSRP-SFHVURJKSA-N 1 1 365.433 3.810 50 0 FHAAMO C[C@@H]1C[N@@H+](C2CCN(Cc3ccc(Br)cc3)CC2)C[C@H](C)O1 ZINC000016116157 570850509 /nfs/dbraw/zinc/85/05/09/570850509.db2.gz VXNFHRYPUZHERA-GASCZTMLSA-N 1 1 367.331 3.523 50 0 FHAAMO O=C(Nc1ccc(Cl)c(Cl)c1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000032912558 570852512 /nfs/dbraw/zinc/85/25/12/570852512.db2.gz VJZVSLXBENPBHD-AWEZNQCLSA-N 1 1 372.296 3.712 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)NCC1CCCCC1)c1ccccc1Br ZINC000016695809 570861068 /nfs/dbraw/zinc/86/10/68/570861068.db2.gz UBPFLKHKMOMVLK-CYBMUJFWSA-N 1 1 353.304 3.796 50 0 FHAAMO C[N@H+]1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)C[C@@H]1CCO ZINC000019222371 570882539 /nfs/dbraw/zinc/88/25/39/570882539.db2.gz RWYSOLKCGUOJGJ-SFHVURJKSA-N 1 1 360.885 3.631 50 0 FHAAMO Cc1c(Cl)cccc1NC(=O)CC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000019359356 570887188 /nfs/dbraw/zinc/88/71/88/570887188.db2.gz VZLHWQKGVMBYFH-UHFFFAOYSA-N 1 1 371.912 3.795 50 0 FHAAMO COc1ccc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](Cc2ccc(F)cc2)C3)o1 ZINC000012056954 570888338 /nfs/dbraw/zinc/88/83/38/570888338.db2.gz NVUHJQNVKJEPQU-OAQYLSRUSA-N 1 1 372.440 3.556 50 0 FHAAMO CCc1ccc(-c2cn3c4ccccc4nc3n2CC[NH+]2CCOCC2)cc1 ZINC000019771579 570902866 /nfs/dbraw/zinc/90/28/66/570902866.db2.gz XXPRWZUUTAFRAO-UHFFFAOYSA-N 1 1 374.488 3.851 50 0 FHAAMO CCOc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc(C(C)=O)cc2)cc1 ZINC000045697392 570910895 /nfs/dbraw/zinc/91/08/95/570910895.db2.gz UNUWAJPFXRNWAV-UHFFFAOYSA-N 1 1 354.450 3.749 50 0 FHAAMO C[NH+]1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc32)CC1 ZINC000020220115 570914040 /nfs/dbraw/zinc/91/40/40/570914040.db2.gz KAIFQEIKDKMCGS-UHFFFAOYSA-N 1 1 365.864 3.943 50 0 FHAAMO Cc1ccc(-c2cc(C(=O)N3CC[NH+](C)CC3)c3ccccc3n2)cc1C ZINC000020395089 570914950 /nfs/dbraw/zinc/91/49/50/570914950.db2.gz NYQYUNRMQBQQLC-UHFFFAOYSA-N 1 1 359.473 3.906 50 0 FHAAMO Cc1nn(C)cc1C[N@H+]1CCC[C@H](c2n[nH]cc2-c2ccc(F)cc2)C1 ZINC000020385484 570915130 /nfs/dbraw/zinc/91/51/30/570915130.db2.gz JSEONQZWIWDTOM-INIZCTEOSA-N 1 1 353.445 3.637 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)CCn3ccc4ccccc43)sc2C1 ZINC000021296549 570929302 /nfs/dbraw/zinc/92/93/02/570929302.db2.gz SJKWERLAOGNZEC-UHFFFAOYSA-N 1 1 354.479 3.505 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)CCn3ccc4ccccc43)sc2C1 ZINC000021296549 570929305 /nfs/dbraw/zinc/92/93/05/570929305.db2.gz SJKWERLAOGNZEC-UHFFFAOYSA-N 1 1 354.479 3.505 50 0 FHAAMO CC(C)NC(=O)Nc1cccc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1 ZINC000047675776 570929573 /nfs/dbraw/zinc/92/95/73/570929573.db2.gz SRVDFQWGHKJYGQ-UHFFFAOYSA-N 1 1 374.529 3.553 50 0 FHAAMO O=C(Nc1cccc(OC(F)F)c1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047906728 570931876 /nfs/dbraw/zinc/93/18/76/570931876.db2.gz KAQCQSCFXRKDGX-INIZCTEOSA-N 1 1 361.392 3.684 50 0 FHAAMO COc1ccc2cc(-c3n[nH]cc3CN(C)C[C@@H]3CCC[N@H+]3C)ccc2c1 ZINC000022851523 570950920 /nfs/dbraw/zinc/95/09/20/570950920.db2.gz NOGASNABZBYSPC-FQEVSTJZSA-N 1 1 364.493 3.765 50 0 FHAAMO CN(C)c1ncc(CN(C)[C@@H]2CCC[N@@H+](CCCc3ccccc3)C2)s1 ZINC000022852420 570951836 /nfs/dbraw/zinc/95/18/36/570951836.db2.gz BAWBOKJCKKKAMT-LJQANCHMSA-N 1 1 372.582 3.738 50 0 FHAAMO O=C(CC[NH+]1CCN(Cc2ccc(Cl)s2)CC1)Nc1ccccc1 ZINC000022931223 570953328 /nfs/dbraw/zinc/95/33/28/570953328.db2.gz FMBRGSZRKWKWKC-UHFFFAOYSA-N 1 1 363.914 3.548 50 0 FHAAMO CC[N@@H+]1CCC[C@H]1CNCc1ccc(OCCc2ccccc2)c(OC)c1 ZINC000022936716 570953788 /nfs/dbraw/zinc/95/37/88/570953788.db2.gz WPWCPUKNRABVDR-NRFANRHFSA-N 1 1 368.521 3.891 50 0 FHAAMO CC[N@H+]1CCC[C@H]1CNCc1ccc(OCCc2ccccc2)c(OC)c1 ZINC000022936716 570953790 /nfs/dbraw/zinc/95/37/90/570953790.db2.gz WPWCPUKNRABVDR-NRFANRHFSA-N 1 1 368.521 3.891 50 0 FHAAMO CC[N@@H+]1CCC[C@H]1CNCc1ccc(OCc2ccccc2)c(OC)c1 ZINC000022935997 570954096 /nfs/dbraw/zinc/95/40/96/570954096.db2.gz YQQSSHJWCKOONX-FQEVSTJZSA-N 1 1 354.494 3.848 50 0 FHAAMO CC[N@H+]1CCC[C@H]1CNCc1ccc(OCc2ccccc2)c(OC)c1 ZINC000022935997 570954099 /nfs/dbraw/zinc/95/40/99/570954099.db2.gz YQQSSHJWCKOONX-FQEVSTJZSA-N 1 1 354.494 3.848 50 0 FHAAMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc3c4c(cccc42)CC3)C[C@H](C)O1 ZINC000025408764 570995237 /nfs/dbraw/zinc/99/52/37/570995237.db2.gz ZVAAMMZUONRVCF-IYBDPMFKSA-N 1 1 366.505 3.556 50 0 FHAAMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc3c4c(cccc42)CC3)C[C@H](C)O1 ZINC000025408764 570995245 /nfs/dbraw/zinc/99/52/45/570995245.db2.gz ZVAAMMZUONRVCF-IYBDPMFKSA-N 1 1 366.505 3.556 50 0 FHAAMO CC(C)(CNC(=O)c1ccccc1OC(F)F)[N@H+]1CCc2ccccc2C1 ZINC000025464207 570996498 /nfs/dbraw/zinc/99/64/98/570996498.db2.gz KTNDLOUGLTXJSJ-UHFFFAOYSA-N 1 1 374.431 3.855 50 0 FHAAMO Oc1ccc(N2CC[NH+](CCOc3ccc(Cl)cc3Cl)CC2)cc1 ZINC000025572539 570997314 /nfs/dbraw/zinc/99/73/14/570997314.db2.gz SZBNJIHMRWRBAP-UHFFFAOYSA-N 1 1 367.276 3.900 50 0 FHAAMO C[C@H](C(=O)Nc1ccc(Cl)cn1)[N@H+](C)CCOc1ccccc1Cl ZINC000029154074 571037067 /nfs/dbraw/zinc/03/70/67/571037067.db2.gz PANFDOGQMFTXDC-GFCCVEGCSA-N 1 1 368.264 3.726 50 0 FHAAMO C[C@H](C(=O)Nc1ccc(Cl)cn1)[N@@H+](C)CCOc1ccccc1Cl ZINC000029154074 571037068 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CCn1c(C[NH+]2CCC(C(=O)N(C(C)C)C(C)C)CC2)nc2ccccc21 ZINC000249680539 571129163 /nfs/dbraw/zinc/12/91/63/571129163.db2.gz ASBYMBCJIXWGTH-UHFFFAOYSA-N 1 1 370.541 3.914 50 0 FHAAMO CCCN(CCC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000249701557 571129191 /nfs/dbraw/zinc/12/91/91/571129191.db2.gz YNSXSEVICSOXRB-GOSISDBHSA-N 1 1 370.541 3.917 50 0 FHAAMO CCn1c(C[N@H+]2CCC[C@@H](C(=O)N(C(C)C)C(C)C)C2)nc2ccccc21 ZINC000249693155 571129218 /nfs/dbraw/zinc/12/92/18/571129218.db2.gz NSLVDCNDKDTSOG-GOSISDBHSA-N 1 1 370.541 3.914 50 0 FHAAMO CCOc1ccc(C(=O)CC[NH+]2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000020034568 571143911 /nfs/dbraw/zinc/14/39/11/571143911.db2.gz VYUKMVLOMBZDSC-UHFFFAOYSA-N 1 1 356.441 3.619 50 0 FHAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)N(C)Cc2ccsc2)c(OC)c1 ZINC000012921919 571145412 /nfs/dbraw/zinc/14/54/12/571145412.db2.gz JJSFRDMXQIUARZ-GOSISDBHSA-N 1 1 374.506 3.561 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)N(C)Cc2ccsc2)c(OC)c1 ZINC000012921919 571145414 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368.452 3.580 50 0 FHAAMO C[N@H+]1CCc2c(CNC(=O)NC3CCCCC3)c(-n3cccc3)sc2C1 ZINC000020865042 571331880 /nfs/dbraw/zinc/33/18/80/571331880.db2.gz SKLRZLHGTUHJGZ-UHFFFAOYSA-N 1 1 372.538 3.659 50 0 FHAAMO Cc1cccc(OC2CCN([C@@H]3CCC[N@@H+](Cc4ccccc4)C3)CC2)n1 ZINC000095940895 571332395 /nfs/dbraw/zinc/33/23/95/571332395.db2.gz XYICZOAVYOAXPN-OAQYLSRUSA-N 1 1 365.521 3.898 50 0 FHAAMO Cc1cccc(OC2CC[NH+]([C@@H]3CCCN(Cc4ccccc4)C3)CC2)n1 ZINC000095940895 571332396 /nfs/dbraw/zinc/33/23/96/571332396.db2.gz XYICZOAVYOAXPN-OAQYLSRUSA-N 1 1 365.521 3.898 50 0 FHAAMO O=C(NC[C@@H](c1ccsc1)[NH+]1CCC1)c1cccc(Br)c1 ZINC000225593960 571337359 /nfs/dbraw/zinc/33/73/59/571337359.db2.gz GIIFNBOXZZAUPX-HNNXBMFYSA-N 1 1 365.296 3.687 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1 ZINC000028244652 571338804 /nfs/dbraw/zinc/33/88/04/571338804.db2.gz IUNCJRFWMNDYNZ-UHFFFAOYSA-N 1 1 361.380 3.962 50 0 FHAAMO Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H](C[NH+](C)C)c2ccccc2)c1C ZINC000030499320 571346120 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CC[C@H]1C[N@@H+](Cc2ccc(OCCO)cc2)Cc2ccc(Cl)cc2O1 ZINC000299776478 945133504 /nfs/dbraw/zinc/13/35/04/945133504.db2.gz CAOASTLGWVXFKK-SFHVURJKSA-N 1 1 361.869 3.884 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3C(C)(C)O)cs2)c(OC)c1 ZINC000119046323 938578521 /nfs/dbraw/zinc/57/85/21/938578521.db2.gz WGEJQYCRMHKBGF-QGZVFWFLSA-N 1 1 362.495 3.563 50 0 FHAAMO Cc1cc(N2CCC(NC(=O)N3CCC[C@H](C(C)C)CC3)CC2)nc(C)[nH+]1 ZINC000176899658 938989276 /nfs/dbraw/zinc/98/92/76/938989276.db2.gz YBUWMKHWDIEJLC-SFHVURJKSA-N 1 1 373.545 3.530 50 0 FHAAMO COc1ccc(Br)cc1C[N@@H+](C)C[C@@H](O)c1ccccc1 ZINC000023280999 939966131 /nfs/dbraw/zinc/96/61/31/939966131.db2.gz ZXUDZBWIGZDIFU-MRXNPFEDSA-N 1 1 350.256 3.623 50 0 FHAAMO c1cn(-c2ccc(C[N@H+](Cc3ccccc3)CC3CCOCC3)cn2)cn1 ZINC000177159199 939973761 /nfs/dbraw/zinc/97/37/61/939973761.db2.gz RDNWRQHZFKVCAK-UHFFFAOYSA-N 1 1 362.477 3.696 50 0 FHAAMO Fc1ccc(-n2ccc(C[NH+]3CCC(OC[C@@H]4CCCCO4)CC3)n2)cc1 ZINC000177608218 940313995 /nfs/dbraw/zinc/31/39/95/940313995.db2.gz NTRWBAKBASIBGZ-NRFANRHFSA-N 1 1 373.472 3.562 50 0 FHAAMO CCN(CC[NH+](C)C)C(=O)c1cccc(-c2nc[nH]c2-c2ccccc2)c1 ZINC000426689847 941973044 /nfs/dbraw/zinc/97/30/44/941973044.db2.gz JHJUVLVKLSFSPZ-UHFFFAOYSA-N 1 1 362.477 3.767 50 0 FHAAMO CCN1CCCn2nc([C@@H]3CCC[N@@H+](CC4CCCCC4)C3)cc2C1=O ZINC000675010299 943603815 /nfs/dbraw/zinc/60/38/15/943603815.db2.gz NWNHAGLTBHWAFR-GOSISDBHSA-N 1 1 358.530 3.509 50 0 FHAAMO Cc1nnc([C@@H]2CC[N@@H+](CC3CCCCC3)CCN2Cc2ccccc2)[nH]1 ZINC000675012702 943611503 /nfs/dbraw/zinc/61/15/03/943611503.db2.gz CCOVRRWSEGLWBU-NRFANRHFSA-N 1 1 367.541 3.942 50 0 FHAAMO Cc1nc([C@@H]2CC[N@H+](CC3CCCCC3)CCN2Cc2ccccc2)n[nH]1 ZINC000675012702 943611507 /nfs/dbraw/zinc/61/15/07/943611507.db2.gz CCOVRRWSEGLWBU-NRFANRHFSA-N 1 1 367.541 3.942 50 0 FHAAMO Cc1nc([C@@H]2CC[N@@H+](CC3CCCCC3)CCN2Cc2ccccc2)n[nH]1 ZINC000675012702 943611511 /nfs/dbraw/zinc/61/15/11/943611511.db2.gz CCOVRRWSEGLWBU-NRFANRHFSA-N 1 1 367.541 3.942 50 0 FHAAMO CC[C@@H](OC1CCCCC1)C(=O)N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000329932135 944308919 /nfs/dbraw/zinc/30/89/19/944308919.db2.gz AYNAHVNTOBYQLO-LJQANCHMSA-N 1 1 360.498 3.888 50 0 FHAAMO CCc1cc(=O)[nH]c(C[N@H+]2CCC[C@H](c3nc(-c4ccccc4)c[nH]3)C2)n1 ZINC000120946991 946929387 /nfs/dbraw/zinc/92/93/87/946929387.db2.gz OLTVSFOZFSFPPE-INIZCTEOSA-N 1 1 363.465 3.514 50 0 FHAAMO Fc1ccc2nc([C@H]3CCC[N@@H+](Cc4cc5n(n4)CCCC5)C3)oc2c1 ZINC000888094283 948398843 /nfs/dbraw/zinc/39/88/43/948398843.db2.gz FYYPUJVCTTZQEW-AWEZNQCLSA-N 1 1 354.429 3.879 50 0 FHAAMO CCOc1cncc(C[NH+]2CCC3(CCc4ccccc4C3=O)CC2)c1 ZINC000888100800 948441199 /nfs/dbraw/zinc/44/11/99/948441199.db2.gz VHAXAMXDMDOXLT-UHFFFAOYSA-N 1 1 350.462 3.892 50 0 FHAAMO COc1cccc(C[N@@H+](C)C[C@H](O)COc2cc(Cl)ccc2Cl)c1 ZINC000002631884 204047540 /nfs/dbraw/zinc/04/75/40/204047540.db2.gz MWCKTMHFLWUHMI-HNNXBMFYSA-N 1 1 370.276 3.874 50 0 FHAAMO CCOc1ccccc1C[N@H+]1CCC[C@@H](C(=O)N(C)Cc2ccccc2)C1 ZINC000002734716 204052927 /nfs/dbraw/zinc/05/29/27/204052927.db2.gz SXMVAVVUUHFGAG-OAQYLSRUSA-N 1 1 366.505 3.956 50 0 FHAAMO O=C(c1ccco1)N1CC[NH+](CCCCCCOc2ccc(F)cc2)CC1 ZINC000003906298 204115859 /nfs/dbraw/zinc/11/58/59/204115859.db2.gz DLTMUCBFYKUVEA-UHFFFAOYSA-N 1 1 374.456 3.816 50 0 FHAAMO COc1cc(OC)c([C@H]2[NH2+]Cc3ccccc3-n3cccc32)cc1OC ZINC000004188224 204126793 /nfs/dbraw/zinc/12/67/93/204126793.db2.gz LAQJUHMDPHSQLP-OAQYLSRUSA-N 1 1 350.418 3.696 50 0 FHAAMO COc1ccc(C)cc1NC(=O)C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000003347788 204094202 /nfs/dbraw/zinc/09/42/02/204094202.db2.gz SFXQEEZPOGABTH-UHFFFAOYSA-N 1 1 352.478 3.897 50 0 FHAAMO CC[NH+]1CCN(C(=S)c2ccc(OCc3ccc(C)cc3)cc2)CC1 ZINC000004739987 204160437 /nfs/dbraw/zinc/16/04/37/204160437.db2.gz WZDHRFLYNWMQTP-UHFFFAOYSA-N 1 1 354.519 3.887 50 0 FHAAMO COc1ccc(Cl)cc1NC(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000004271937 204129968 /nfs/dbraw/zinc/12/99/68/204129968.db2.gz DAIXGTPXMJAWMV-UHFFFAOYSA-N 1 1 373.884 3.741 50 0 FHAAMO Fc1ccc([C@H]2C3=C([NH+]=C4N=CNN42)c2cc(Cl)ccc2OC3)cc1 ZINC000005576536 204215619 /nfs/dbraw/zinc/21/56/19/204215619.db2.gz OPCMVESKYARHIJ-KRWDZBQOSA-N 1 1 354.772 3.542 50 0 FHAAMO O=C1C[C@H]([NH+]2CCCCC2)C(=O)N1c1ccc(Oc2ccccc2)cc1 ZINC000004978434 204181706 /nfs/dbraw/zinc/18/17/06/204181706.db2.gz GXZXWOQJAMFAAZ-IBGZPJMESA-N 1 1 350.418 3.597 50 0 FHAAMO Nc1n[nH]c2nc(Nc3ccccc3)c3c(c12)CC[N@H+](C1CCCCC1)C3 ZINC000005207650 204197754 /nfs/dbraw/zinc/19/77/54/204197754.db2.gz NDHXKRVDYQGKOP-UHFFFAOYSA-N 1 1 362.481 3.975 50 0 FHAAMO Nc1n[nH]c2nc(Nc3ccccc3)c3c(c12)CC[N@@H+](C1CCCCC1)C3 ZINC000005207650 204197755 /nfs/dbraw/zinc/19/77/55/204197755.db2.gz NDHXKRVDYQGKOP-UHFFFAOYSA-N 1 1 362.481 3.975 50 0 FHAAMO C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 ZINC000007063211 204287819 /nfs/dbraw/zinc/28/78/19/204287819.db2.gz XMKAOIWJCVARMF-MRXNPFEDSA-N 1 1 354.498 3.983 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 ZINC000007063211 204287824 /nfs/dbraw/zinc/28/78/24/204287824.db2.gz XMKAOIWJCVARMF-MRXNPFEDSA-N 1 1 354.498 3.983 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)CCC(=O)c1ccc(Cl)s1)c1cccs1 ZINC000006787834 204270218 /nfs/dbraw/zinc/27/02/18/204270218.db2.gz LJMAOACKOJBBCA-NSHDSACASA-N 1 1 370.927 3.845 50 0 FHAAMO COC(=O)c1ccc(C)c(NC(=O)C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000008319936 204326836 /nfs/dbraw/zinc/32/68/36/204326836.db2.gz VSXSBUGMJXYLHB-MRXNPFEDSA-N 1 1 358.463 3.619 50 0 FHAAMO COC(=O)c1ccc(C)c(NC(=O)C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000008319936 204326840 /nfs/dbraw/zinc/32/68/40/204326840.db2.gz VSXSBUGMJXYLHB-MRXNPFEDSA-N 1 1 358.463 3.619 50 0 FHAAMO CC[C@@H](C(=O)Nc1cc(C)on1)[NH+]1CCC(c2nc3ccccc3o2)CC1 ZINC000008920068 204348839 /nfs/dbraw/zinc/34/88/39/204348839.db2.gz GJTQXPXZMPOTMW-INIZCTEOSA-N 1 1 368.437 3.721 50 0 FHAAMO COc1ccc2cc(CN(C)C(=O)C[N@@H+]3CCc4ccccc4C3)ccc2c1 ZINC000036390305 204379821 /nfs/dbraw/zinc/37/98/21/204379821.db2.gz RESQCTNRRQJRGK-UHFFFAOYSA-N 1 1 374.484 3.865 50 0 FHAAMO COc1ccc2cc(CN(C)C(=O)C[N@H+]3CCc4ccccc4C3)ccc2c1 ZINC000036390305 204379824 /nfs/dbraw/zinc/37/98/24/204379824.db2.gz RESQCTNRRQJRGK-UHFFFAOYSA-N 1 1 374.484 3.865 50 0 FHAAMO O=C(NCCC[N@@H+]1CCO[C@H](c2ccccc2)C1)c1ccccc1Cl ZINC000036699971 204382711 /nfs/dbraw/zinc/38/27/11/204382711.db2.gz WQRUUPDSAZWJOL-IBGZPJMESA-N 1 1 358.869 3.533 50 0 FHAAMO O=C(NCCC[N@H+]1CCO[C@H](c2ccccc2)C1)c1ccccc1Cl ZINC000036699971 204382715 /nfs/dbraw/zinc/38/27/15/204382715.db2.gz WQRUUPDSAZWJOL-IBGZPJMESA-N 1 1 358.869 3.533 50 0 FHAAMO COc1cccc(C[N@@H+](CCC(C)C)C[C@H](O)COC(C)(C)C)c1OC ZINC000036097312 205002961 /nfs/dbraw/zinc/00/29/61/205002961.db2.gz PVZRREOTSVTBOX-SFHVURJKSA-N 1 1 367.530 3.728 50 0 FHAAMO CCC[N@H+](Cc1cccc(OC)c1OC)C[C@H](O)COc1ccccc1C ZINC000036097244 205003013 /nfs/dbraw/zinc/00/30/13/205003013.db2.gz KOBZLNPRYXYQGO-IBGZPJMESA-N 1 1 373.493 3.664 50 0 FHAAMO COc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)Cc2ccccc2)cc1OC ZINC000036095631 205003280 /nfs/dbraw/zinc/00/32/80/205003280.db2.gz LBZKOQYDMBBDEF-FQEVSTJZSA-N 1 1 357.494 3.765 50 0 FHAAMO COc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)COc2ccccc2)cc1OC ZINC000036095607 205003966 /nfs/dbraw/zinc/00/39/66/205003966.db2.gz GFCNDHAPIZSETO-LJQANCHMSA-N 1 1 373.493 3.602 50 0 FHAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccccc2Cl)C(C)C)cc1 ZINC000036102014 205004651 /nfs/dbraw/zinc/00/46/51/205004651.db2.gz XYJIKRQIUOSLNN-QGZVFWFLSA-N 1 1 363.885 3.999 50 0 FHAAMO Cc1ccccc1C[N@H+](Cc1ccc2c(c1)OCO2)C[C@H](O)COC(C)C ZINC000036104602 205005364 /nfs/dbraw/zinc/00/53/64/205005364.db2.gz KZPJPALHQQPRKX-FQEVSTJZSA-N 1 1 371.477 3.512 50 0 FHAAMO COCCC[N@H+](Cc1cccc(C)c1)C[C@@H](O)COc1ccccc1C ZINC000036100517 205005859 /nfs/dbraw/zinc/00/58/59/205005859.db2.gz BYCJIFXSYXWMKO-OAQYLSRUSA-N 1 1 357.494 3.582 50 0 FHAAMO CCCC(=O)OC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000036104450 205006123 /nfs/dbraw/zinc/00/61/23/205006123.db2.gz DJJHNUOVIOLLEC-OAQYLSRUSA-N 1 1 355.478 3.701 50 0 FHAAMO COCCC[N@H+](Cc1ccccc1C)C[C@H](O)COc1ccccc1C ZINC000036099926 205006134 /nfs/dbraw/zinc/00/61/34/205006134.db2.gz YRNDHUBVHGYSEM-NRFANRHFSA-N 1 1 357.494 3.582 50 0 FHAAMO CCC[C@H](O)C[N@H+](Cc1cccc(F)c1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145902 205007861 /nfs/dbraw/zinc/00/78/61/205007861.db2.gz BXZTWFPRDKOTPY-SFTDATJTSA-N 1 1 370.468 3.982 50 0 FHAAMO O=C(C[NH+]1CCCCC1)N1N=C(c2ccccc2)C[C@@H]1c1ccc(F)cc1 ZINC000036345194 205009918 /nfs/dbraw/zinc/00/99/18/205009918.db2.gz DIFDMUUHEKWAJU-OAQYLSRUSA-N 1 1 365.452 3.989 50 0 FHAAMO Cc1c2cc(Cl)ccc2[nH]c1CN1CC[N@H+](CC(C)C)[C@H](CCO)C1 ZINC000036379403 205013336 /nfs/dbraw/zinc/01/33/36/205013336.db2.gz BGLAGLJDATUVLB-QGZVFWFLSA-N 1 1 363.933 3.654 50 0 FHAAMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1ccc2c(c1)OCCCO2 ZINC000036396725 205016741 /nfs/dbraw/zinc/01/67/41/205016741.db2.gz HFEVILSWEXZRFS-UHFFFAOYSA-N 1 1 368.477 3.618 50 0 FHAAMO COc1ccc(OC)c(CN2CC[N@H+]3CCC[C@@H]3[C@@H]2C2CCCCC2)c1 ZINC000039769780 205047210 /nfs/dbraw/zinc/04/72/10/205047210.db2.gz WWUIJHJNWLBGLM-IRLDBZIGSA-N 1 1 358.526 3.933 50 0 FHAAMO CS(=O)(=O)Nc1cccc(C[NH2+]Cc2ccc(Cl)cc2Cl)c1 ZINC000040040195 205049697 /nfs/dbraw/zinc/04/96/97/205049697.db2.gz UQRJMLXDIXGKAV-UHFFFAOYSA-N 1 1 359.278 3.655 50 0 FHAAMO CC(C)[NH+]1CCN(C(=O)c2ccc(SCc3cccnc3)cc2)CC1 ZINC000047841138 205149454 /nfs/dbraw/zinc/14/94/54/205149454.db2.gz ZNNIRTFCWWMGAQ-UHFFFAOYSA-N 1 1 355.507 3.540 50 0 FHAAMO O=S(=O)(CC[NH2+]Cc1ccc(-c2ccc(F)cc2)o1)Cc1ccccc1 ZINC000048277651 205154938 /nfs/dbraw/zinc/15/49/38/205154938.db2.gz ZLKNJEWVCZUSLC-UHFFFAOYSA-N 1 1 373.449 3.790 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@@H+]1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000048332855 205158306 /nfs/dbraw/zinc/15/83/06/205158306.db2.gz LDQPQUBLCKHCJX-QFBILLFUSA-N 1 1 360.498 3.632 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@H+]1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000048332855 205158309 /nfs/dbraw/zinc/15/83/09/205158309.db2.gz LDQPQUBLCKHCJX-QFBILLFUSA-N 1 1 360.498 3.632 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@H+](C)CCO[C@@H]1CCCC[C@@H]1C ZINC000048353623 205160236 /nfs/dbraw/zinc/16/02/36/205160236.db2.gz HUBFKQFUQVQGLL-DOTOQJQBSA-N 1 1 350.528 3.874 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@@H+](C)CCO[C@@H]1CCCC[C@@H]1C ZINC000048353623 205160240 /nfs/dbraw/zinc/16/02/40/205160240.db2.gz HUBFKQFUQVQGLL-DOTOQJQBSA-N 1 1 350.528 3.874 50 0 FHAAMO C[C@H]1C[NH+](Cc2ccccc2CNC(=O)CCc2ccccc2)C[C@H](C)O1 ZINC000048358538 205160972 /nfs/dbraw/zinc/16/09/72/205160972.db2.gz PBKPTYQQBBPMDP-OALUTQOASA-N 1 1 366.505 3.545 50 0 FHAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)N2[C@H](C)CCC[C@@H]2C)c(OC)c1 ZINC000050274313 205178272 /nfs/dbraw/zinc/17/82/72/205178272.db2.gz XOCJUBUCDUOPTE-JTDSTZFVSA-N 1 1 360.498 3.630 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)N2[C@H](C)CCC[C@@H]2C)c(OC)c1 ZINC000050274313 205178277 /nfs/dbraw/zinc/17/82/77/205178277.db2.gz XOCJUBUCDUOPTE-JTDSTZFVSA-N 1 1 360.498 3.630 50 0 FHAAMO CCN(Cc1ccncc1)C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000055099849 205206122 /nfs/dbraw/zinc/20/61/22/205206122.db2.gz KARXDBXIRGQASV-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@@H+](Cc1ccncc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055099849 205206142 /nfs/dbraw/zinc/20/61/42/205206142.db2.gz KARXDBXIRGQASV-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@H+](Cc1ccncc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055099849 205206145 /nfs/dbraw/zinc/20/61/45/205206145.db2.gz KARXDBXIRGQASV-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO O=C(c1csc2ccccc12)N1CC[NH+](CCc2ccccc2)CC1 ZINC000055062661 205206613 /nfs/dbraw/zinc/20/66/13/205206613.db2.gz RFXFWCIBKLDVLV-UHFFFAOYSA-N 1 1 350.487 3.902 50 0 FHAAMO Cc1ccsc1CNc1ccccc1C(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000055099238 205207243 /nfs/dbraw/zinc/20/72/43/205207243.db2.gz ZUZSYNZKWNFZPK-INIZCTEOSA-N 1 1 355.507 3.589 50 0 FHAAMO NC(=O)CCn1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)c2ccccc21 ZINC000055271349 205212555 /nfs/dbraw/zinc/21/25/55/205212555.db2.gz TUADWRRBOVYVHR-FQEVSTJZSA-N 1 1 362.477 3.639 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1csc(-c2ccccc2Cl)n1 ZINC000053274899 205191791 /nfs/dbraw/zinc/19/17/91/205191791.db2.gz 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ZINC000058162284 205252041 /nfs/dbraw/zinc/25/20/41/205252041.db2.gz BFLAQFBOOSPXTR-LLVKDONJSA-N 1 1 351.422 3.833 50 0 FHAAMO CC(C)c1ccccc1NCC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000058219027 205264267 /nfs/dbraw/zinc/26/42/67/205264267.db2.gz XHCFKRWFDAPBNN-UHFFFAOYSA-N 1 1 351.494 3.566 50 0 FHAAMO COc1ccccc1N1C[C@@H]2C[C@@H](c3ccsc3)[N@H+]3CCC[C@@]23C1=O ZINC000014971282 205281594 /nfs/dbraw/zinc/28/15/94/205281594.db2.gz ANPXIJNSNDJAGU-KNBMTAEXSA-N 1 1 354.475 3.699 50 0 FHAAMO COc1ccc(C)cc1NC(=O)C[N@H+]1CCC[C@H]1CN(C)c1ccccc1 ZINC000062582401 205291596 /nfs/dbraw/zinc/29/15/96/205291596.db2.gz YUYOIWPXDDWXMQ-IBGZPJMESA-N 1 1 367.493 3.543 50 0 FHAAMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2cccc(NC(=O)C3CC3)c2)C1 ZINC000064725757 205303576 /nfs/dbraw/zinc/30/35/76/205303576.db2.gz PYMXNNIMDSDOCG-GQIGUUNPSA-N 1 1 369.509 3.513 50 0 FHAAMO Cc1ccc2cc(CCC(=O)NCCC[N@@H+]3CCCC[C@@H]3C)c(=O)[nH]c2c1 ZINC000065245602 205328215 /nfs/dbraw/zinc/32/82/15/205328215.db2.gz 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CCOc1ccccc1CN1CC[N@H+](C2CCCCCC2)C[C@@H]1CCO ZINC000019836172 570904210 /nfs/dbraw/zinc/90/42/10/570904210.db2.gz RMWKIIBEEZZBPR-NRFANRHFSA-N 1 1 360.542 3.677 50 0 FHAAMO COc1cc(C)c(CN2CC[N@H+](C3CCCCC3)[C@@H](CCO)C2)cc1C ZINC000020233588 570914058 /nfs/dbraw/zinc/91/40/58/570914058.db2.gz POPDDTIHIHDDHW-NRFANRHFSA-N 1 1 360.542 3.513 50 0 FHAAMO Cc1c2cc(C)ccc2[nH]c1CN1CC[N@@H+](C2CCCC2)[C@@H](CCO)C1 ZINC000020601582 570920522 /nfs/dbraw/zinc/92/05/22/570920522.db2.gz AUUGSVIAKVYGSJ-IBGZPJMESA-N 1 1 355.526 3.596 50 0 FHAAMO FC(F)(F)Oc1cccc(-c2n[nH]c3c2C[N@H+](C2CCOCC2)CC3)c1 ZINC000020864871 570926249 /nfs/dbraw/zinc/92/62/49/570926249.db2.gz YOJQEGDBFVHCBK-UHFFFAOYSA-N 1 1 367.371 3.512 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2cc(Cl)cc(Cl)c2)CC1 ZINC000022028251 570937771 /nfs/dbraw/zinc/93/77/71/570937771.db2.gz KZAKKVIVGHBEFZ-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO CC(C)[N@@H+](CC(=O)Nc1cccc(N2CCCC2=O)c1)Cc1ccccc1 ZINC000022134709 570940361 /nfs/dbraw/zinc/94/03/61/570940361.db2.gz MEEOXVVIWNGAJZ-UHFFFAOYSA-N 1 1 365.477 3.663 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2ccc(OCc3ccccc3)cc2)C[C@@H]1CCO ZINC000022919556 570952445 /nfs/dbraw/zinc/95/24/45/570952445.db2.gz JCLIVIBVRFANSX-QFIPXVFZSA-N 1 1 368.521 3.543 50 0 FHAAMO CCC(CC)[C@@H](CNC(=O)c1cccc(Cl)c1Cl)[NH+]1CCOCC1 ZINC000022898659 570952720 /nfs/dbraw/zinc/95/27/20/570952720.db2.gz XTRORTXQVHWHHV-MRXNPFEDSA-N 1 1 373.324 3.860 50 0 FHAAMO COc1ccc(C(C)=O)cc1CN1CCC[N@@H+](Cc2ccc(C)cc2)CC1 ZINC000022995338 570954834 /nfs/dbraw/zinc/95/48/34/570954834.db2.gz JFGKMFFNDUQMES-UHFFFAOYSA-N 1 1 366.505 3.914 50 0 FHAAMO CCCn1cc(C[N@@H+]2CCc3[nH]nc(CCc4ccccc4)c3C2)c(C)n1 ZINC000023310971 570961388 /nfs/dbraw/zinc/96/13/88/570961388.db2.gz QFJNGVSTMZPZCE-UHFFFAOYSA-N 1 1 363.509 3.668 50 0 FHAAMO CCCn1cc(C[N@H+]2CCc3[nH]nc(CCc4ccccc4)c3C2)c(C)n1 ZINC000023310971 570961390 /nfs/dbraw/zinc/96/13/90/570961390.db2.gz QFJNGVSTMZPZCE-UHFFFAOYSA-N 1 1 363.509 3.668 50 0 FHAAMO CCCn1cc(C[N@@H+]2CCc3n[nH]c(CCc4ccccc4)c3C2)c(C)n1 ZINC000023310971 570961392 /nfs/dbraw/zinc/96/13/92/570961392.db2.gz QFJNGVSTMZPZCE-UHFFFAOYSA-N 1 1 363.509 3.668 50 0 FHAAMO CCCn1cc(C[N@H+]2CCc3n[nH]c(CCc4ccccc4)c3C2)c(C)n1 ZINC000023310971 570961393 /nfs/dbraw/zinc/96/13/93/570961393.db2.gz QFJNGVSTMZPZCE-UHFFFAOYSA-N 1 1 363.509 3.668 50 0 FHAAMO OCC[C@@H]1CN(Cc2cc3ccccc3o2)CC[N@@H+]1Cc1cccs1 ZINC000023361186 570962105 /nfs/dbraw/zinc/96/21/05/570962105.db2.gz UMGJAPDQNLRBTK-QGZVFWFLSA-N 1 1 356.491 3.563 50 0 FHAAMO OCC[C@@H]1CN(Cc2cc3ccccc3o2)CC[N@H+]1Cc1cccs1 ZINC000023361186 570962109 /nfs/dbraw/zinc/96/21/09/570962109.db2.gz UMGJAPDQNLRBTK-QGZVFWFLSA-N 1 1 356.491 3.563 50 0 FHAAMO OCC[C@@H]1C[N@H+](Cc2cc3ccccc3o2)CCN1Cc1cccs1 ZINC000023361186 570962111 /nfs/dbraw/zinc/96/21/11/570962111.db2.gz UMGJAPDQNLRBTK-QGZVFWFLSA-N 1 1 356.491 3.563 50 0 FHAAMO OCC[C@@H]1C[N@@H+](Cc2cc3ccccc3o2)CCN1Cc1cccs1 ZINC000023361186 570962116 /nfs/dbraw/zinc/96/21/16/570962116.db2.gz UMGJAPDQNLRBTK-QGZVFWFLSA-N 1 1 356.491 3.563 50 0 FHAAMO CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000223962116 570973121 /nfs/dbraw/zinc/97/31/21/570973121.db2.gz WTYXXTOXSKLQCM-QGZVFWFLSA-N 1 1 365.452 3.755 50 0 FHAAMO O=C(N[C@H]1CC[N@H+](C2CCCCCC2)C1)c1csc(-c2ccccn2)n1 ZINC000072230570 570985259 /nfs/dbraw/zinc/98/52/59/570985259.db2.gz BKZABEAXGDSTJE-HNNXBMFYSA-N 1 1 370.522 3.732 50 0 FHAAMO Cc1cccc(C)c1N1C(=O)C[C@@H]([N@H+](Cc2ccc(F)cc2)C2CC2)C1=O ZINC000025059182 570990093 /nfs/dbraw/zinc/99/00/93/570990093.db2.gz ACMBGDHYRMLSLJ-LJQANCHMSA-N 1 1 366.436 3.739 50 0 FHAAMO Cc1cccc(C)c1N1C(=O)C[C@@H]([N@@H+](Cc2ccc(F)cc2)C2CC2)C1=O ZINC000025059182 570990094 /nfs/dbraw/zinc/99/00/94/570990094.db2.gz ACMBGDHYRMLSLJ-LJQANCHMSA-N 1 1 366.436 3.739 50 0 FHAAMO Cc1oc(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000027333716 571011516 /nfs/dbraw/zinc/01/15/16/571011516.db2.gz JHJFEISLCMSCGK-KRWDZBQOSA-N 1 1 365.433 3.810 50 0 FHAAMO Cc1cc(C)c2oc(C(=O)NC[C@H](c3cccs3)[NH+](C)C)cc(=O)c2c1 ZINC000028288307 571029565 /nfs/dbraw/zinc/02/95/65/571029565.db2.gz SVHDJUNXGKKDJG-OAHLLOKOSA-N 1 1 370.474 3.504 50 0 FHAAMO C[C@@](O)(COc1ccccc1)c1ccc2c(c1)C[N@@H+](C1CCC1)CCO2 ZINC000015067272 571041511 /nfs/dbraw/zinc/04/15/11/571041511.db2.gz SWIOUJHPPCIQAY-JOCHJYFZSA-N 1 1 353.462 3.720 50 0 FHAAMO COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)Cn2cc[nH+]c2C)cc1 ZINC000030696218 571048780 /nfs/dbraw/zinc/04/87/80/571048780.db2.gz YQKJYBOVJJKKQN-OAQYLSRUSA-N 1 1 374.444 3.578 50 0 FHAAMO CC(C)OCc1cccc(NC(=O)N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@@H]3C2)c1 ZINC000072295065 571052831 /nfs/dbraw/zinc/05/28/31/571052831.db2.gz SZUJJDHBGDYPQN-DFQSSKMNSA-N 1 1 357.498 3.560 50 0 FHAAMO C[N@@H+](Cc1ccccc1-c1ccccc1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000083865616 571055302 /nfs/dbraw/zinc/05/53/02/571055302.db2.gz WKYKFWNIOINETO-SFHVURJKSA-N 1 1 362.395 3.949 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(=O)oc3cc(O)ccc23)cc1 ZINC000012736615 571059712 /nfs/dbraw/zinc/05/97/12/571059712.db2.gz XUMNURLVGZHRMV-IBGZPJMESA-N 1 1 351.402 3.844 50 0 FHAAMO COc1ccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c(Br)c1OC ZINC000225729151 571059957 /nfs/dbraw/zinc/05/99/57/571059957.db2.gz WIEGUIIHYHHGKS-JSGCOSHPSA-N 1 1 372.303 3.592 50 0 FHAAMO O=C(C[C@@H]1CCC[N@@H+]1CC(=O)N1CCCCCCC1)c1ccc(F)cc1 ZINC000084387582 571084666 /nfs/dbraw/zinc/08/46/66/571084666.db2.gz WSLIQPZBCCCXRX-IBGZPJMESA-N 1 1 360.473 3.656 50 0 FHAAMO O=C(C[C@@H]1CCC[N@H+]1CC(=O)N1CCCCCCC1)c1ccc(F)cc1 ZINC000084387582 571084667 /nfs/dbraw/zinc/08/46/67/571084667.db2.gz WSLIQPZBCCCXRX-IBGZPJMESA-N 1 1 360.473 3.656 50 0 FHAAMO Cc1ncsc1C[N@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)n[nH]2)C1 ZINC000097096370 571094250 /nfs/dbraw/zinc/09/42/50/571094250.db2.gz HSISGYRWISVJQL-AWEZNQCLSA-N 1 1 357.458 3.755 50 0 FHAAMO COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000229638797 571095028 /nfs/dbraw/zinc/09/50/28/571095028.db2.gz AUWGKOZUFQIUDX-ZHALLVOQSA-N 1 1 358.526 3.742 50 0 FHAAMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)ccc2Cl)C1 ZINC000040624709 571100952 /nfs/dbraw/zinc/10/09/52/571100952.db2.gz KHJNCABPFBXPTB-NSHDSACASA-N 1 1 359.695 3.563 50 0 FHAAMO CCCNC(=O)N(C)C[C@@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC000012437455 571104607 /nfs/dbraw/zinc/10/46/07/571104607.db2.gz MQMZTNPREKCXDY-KRWDZBQOSA-N 1 1 351.922 3.646 50 0 FHAAMO CSC[C@H]1CCC[N@@H+](Cc2cc3c(cc2Br)OCCO3)C1 ZINC000240551511 571108967 /nfs/dbraw/zinc/10/89/67/571108967.db2.gz GUGYAOFROGZCCM-LBPRGKRZSA-N 1 1 372.328 3.795 50 0 FHAAMO Cc1nc(C)c(C(=O)NC[C@@H](c2ccc(F)cc2)[NH+]2CCCCC2)s1 ZINC000243932658 571113197 /nfs/dbraw/zinc/11/31/97/571113197.db2.gz BXKZKLTXYXHDMB-KRWDZBQOSA-N 1 1 361.486 3.856 50 0 FHAAMO O=C(NC[C@H](c1ccc(Cl)cc1)[NH+]1CCCCC1)c1n[nH]c2c1CCC2 ZINC000244574823 571113490 /nfs/dbraw/zinc/11/34/90/571113490.db2.gz CSAIAZIEAPJCRB-GOSISDBHSA-N 1 1 372.900 3.509 50 0 FHAAMO O=C(NC[C@@H](c1ccc(Cl)cc1)[NH+]1CCCCC1)c1n[nH]c2c1CCC2 ZINC000244574824 571113595 /nfs/dbraw/zinc/11/35/95/571113595.db2.gz CSAIAZIEAPJCRB-SFHVURJKSA-N 1 1 372.900 3.509 50 0 FHAAMO Fc1ccc(N2CCC[N@@H+](Cc3cc(-c4cccnc4)no3)CC2)cc1 ZINC000244584350 571113611 /nfs/dbraw/zinc/11/36/11/571113611.db2.gz CXPVOPLYZLVEGM-UHFFFAOYSA-N 1 1 352.413 3.588 50 0 FHAAMO Cc1ccccc1SC1CC[NH+](Cc2cc(=O)n3ccsc3n2)CC1 ZINC000244678517 571114396 /nfs/dbraw/zinc/11/43/96/571114396.db2.gz IFCRWKUOTKTHFP-UHFFFAOYSA-N 1 1 371.531 3.821 50 0 FHAAMO Cc1ccc(C)c(NC(=O)CC[N@H+](C)CCc2nc3cc(F)ccc3[nH]2)c1 ZINC000244734849 571115872 /nfs/dbraw/zinc/11/58/72/571115872.db2.gz NMWBPRIAUMBMGM-UHFFFAOYSA-N 1 1 368.456 3.822 50 0 FHAAMO Cc1ccc(C)c(NC(=O)CC[N@@H+](C)CCc2nc3ccc(F)cc3[nH]2)c1 ZINC000244734849 571115874 /nfs/dbraw/zinc/11/58/74/571115874.db2.gz NMWBPRIAUMBMGM-UHFFFAOYSA-N 1 1 368.456 3.822 50 0 FHAAMO Cc1ccc(C)c(NC(=O)CC[N@H+](C)CCc2nc3ccc(F)cc3[nH]2)c1 ZINC000244734849 571115876 /nfs/dbraw/zinc/11/58/76/571115876.db2.gz NMWBPRIAUMBMGM-UHFFFAOYSA-N 1 1 368.456 3.822 50 0 FHAAMO Cc1ncsc1CCCNC(=O)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000244795594 571117403 /nfs/dbraw/zinc/11/74/03/571117403.db2.gz RJKODXBNQPGJCW-SFHVURJKSA-N 1 1 357.523 3.555 50 0 FHAAMO Cc1nccn1CC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2cccc(F)c2)o1 ZINC000244795499 571117458 /nfs/dbraw/zinc/11/74/58/571117458.db2.gz RHKUOQIVECYIPW-SFHVURJKSA-N 1 1 369.444 3.825 50 0 FHAAMO c1cnn(CCC2CC[NH+](C[C@H]3CCN(Cc4ccccc4)C3)CC2)c1 ZINC000244873452 571118110 /nfs/dbraw/zinc/11/81/10/571118110.db2.gz WQQNYQYOOHVACC-JOCHJYFZSA-N 1 1 352.526 3.507 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)/C=C/c3ccc([C@@H]4C[C@@H]4C)o3)sc2C1 ZINC000041974113 571118254 /nfs/dbraw/zinc/11/82/54/571118254.db2.gz ZOZKASDYEMQXJD-LFHSMUGYSA-N 1 1 357.479 3.889 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)/C=C/c3ccc([C@@H]4C[C@@H]4C)o3)sc2C1 ZINC000041974113 571118256 /nfs/dbraw/zinc/11/82/56/571118256.db2.gz ZOZKASDYEMQXJD-LFHSMUGYSA-N 1 1 357.479 3.889 50 0 FHAAMO Cc1nccn1CC[C@H]1CCCC[N@H+]1Cc1cc(C(N)=O)oc1C(C)(C)C ZINC000244873186 571118382 /nfs/dbraw/zinc/11/83/82/571118382.db2.gz WLIKDIOZOUGASG-QGZVFWFLSA-N 1 1 372.513 3.626 50 0 FHAAMO CCOC(=O)c1sc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2)cc1C ZINC000010128948 571122583 /nfs/dbraw/zinc/12/25/83/571122583.db2.gz QZKMWAYUJHODCT-AWEZNQCLSA-N 1 1 360.479 3.865 50 0 FHAAMO CCOC(=O)c1sc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2)cc1C ZINC000010128948 571122585 /nfs/dbraw/zinc/12/25/85/571122585.db2.gz QZKMWAYUJHODCT-AWEZNQCLSA-N 1 1 360.479 3.865 50 0 FHAAMO Cc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3nc4ccccc4n3C)C2)cc1 ZINC000247962383 571126541 /nfs/dbraw/zinc/12/65/41/571126541.db2.gz FUXCXSKYUCSYCB-QGZVFWFLSA-N 1 1 362.477 3.732 50 0 FHAAMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)cc1 ZINC000247962383 571126542 /nfs/dbraw/zinc/12/65/42/571126542.db2.gz FUXCXSKYUCSYCB-QGZVFWFLSA-N 1 1 362.477 3.732 50 0 FHAAMO CCCN(C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1)C(C)C ZINC000247964268 571126552 /nfs/dbraw/zinc/12/65/52/571126552.db2.gz AUNRYUXFACSKMV-SFHVURJKSA-N 1 1 370.541 3.915 50 0 FHAAMO CCCCN(C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2C)C1)C(C)C ZINC000247961210 571126620 /nfs/dbraw/zinc/12/66/20/571126620.db2.gz DVZZEAQCQMHYAE-SFHVURJKSA-N 1 1 370.541 3.822 50 0 FHAAMO Cn1c(C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3F)C2)nc2ccccc21 ZINC000247962278 571126676 /nfs/dbraw/zinc/12/66/76/571126676.db2.gz FLJAEKCNKGSPGA-HNNXBMFYSA-N 1 1 366.440 3.563 50 0 FHAAMO Cn1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3F)C2)nc2ccccc21 ZINC000247962278 571126678 /nfs/dbraw/zinc/12/66/78/571126678.db2.gz FLJAEKCNKGSPGA-HNNXBMFYSA-N 1 1 366.440 3.563 50 0 FHAAMO Cc1cc(NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)ccc1N1CCCC1 ZINC000071850089 571127178 /nfs/dbraw/zinc/12/71/78/571127178.db2.gz LGVLHIMYENRFMM-SFHVURJKSA-N 1 1 356.470 3.613 50 0 FHAAMO CCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1 ZINC000248025889 571127375 /nfs/dbraw/zinc/12/73/75/571127375.db2.gz WERKZZIBNIBLKE-QGZVFWFLSA-N 1 1 356.514 3.698 50 0 FHAAMO CCCCN(C)C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000248121827 571127915 /nfs/dbraw/zinc/12/79/15/571127915.db2.gz NFPQMROPKGGTQV-KRWDZBQOSA-N 1 1 356.514 3.527 50 0 FHAAMO CN(C)C(=O)c1ccc(C[N@H+](C/C=C/c2ccccc2)C[C@@H]2CCCO2)o1 ZINC000252487644 571132653 /nfs/dbraw/zinc/13/26/53/571132653.db2.gz HYXKHNKHHJZUIJ-IUYMFKLXSA-N 1 1 368.477 3.676 50 0 FHAAMO CN(C)C(=O)c1ccc(C[N@@H+](C/C=C/c2ccccc2)C[C@@H]2CCCO2)o1 ZINC000252487644 571132655 /nfs/dbraw/zinc/13/26/55/571132655.db2.gz HYXKHNKHHJZUIJ-IUYMFKLXSA-N 1 1 368.477 3.676 50 0 FHAAMO Fc1ccc(/C=C\CN2CCN(CCOCc3ccc(F)cc3)CC2)cc1 ZINC000211003808 571139793 /nfs/dbraw/zinc/13/97/93/571139793.db2.gz WDQYGKQTXAOIKK-UPHRSURJSA-N 1 1 372.459 3.812 50 0 FHAAMO Cc1n[nH]c(C)c1CC[N@@H+]1CC=C(c2cnn(-c3ccccc3C)c2)CC1 ZINC000067934562 571152230 /nfs/dbraw/zinc/15/22/30/571152230.db2.gz YXZBXPHFXXGAKY-UHFFFAOYSA-N 1 1 361.493 3.852 50 0 FHAAMO O[C@@H]1C[N@@H+](Cc2c[nH]nc2-c2ccccc2)CC[C@H]1c1ccc(F)cc1 ZINC000067983246 571152928 /nfs/dbraw/zinc/15/29/28/571152928.db2.gz MWAXTQQAGNMYCE-VQTJNVASSA-N 1 1 351.425 3.566 50 0 FHAAMO CC[C@H](c1cccnc1)[N@@H+](C)Cc1cccc(C(=O)Nc2cnn(C)c2)c1 ZINC000071278666 571160751 /nfs/dbraw/zinc/16/07/51/571160751.db2.gz WHQPLJXNFMCRQQ-HXUWFJFHSA-N 1 1 363.465 3.651 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2ccc(F)cn2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071613823 571163017 /nfs/dbraw/zinc/16/30/17/571163017.db2.gz XWKHWTKVRMJWBM-FQEVSTJZSA-N 1 1 373.447 3.733 50 0 FHAAMO CC(C)[C@H]1C[N@@H+](CCC(F)(F)F)CCC(=O)N1Cc1ccc(F)cc1 ZINC000071763058 571165832 /nfs/dbraw/zinc/16/58/32/571165832.db2.gz RKWHSLDHLXZRFR-MRXNPFEDSA-N 1 1 360.395 3.837 50 0 FHAAMO COc1ccc(-c2nc(CN3CC([N@H+]4CCCC[C@@H]4C)C3)c(C)o2)c(F)c1 ZINC000071762635 571165836 /nfs/dbraw/zinc/16/58/36/571165836.db2.gz YGSIUTSARSTCHU-AWEZNQCLSA-N 1 1 373.472 3.856 50 0 FHAAMO COc1ccc(F)c(-c2nc(C[N@H+]3CCC[C@H](C(C)(C)O)C3)c(C)o2)c1 ZINC000071763566 571165865 /nfs/dbraw/zinc/16/58/65/571165865.db2.gz KYLPRSKUOCKDFE-AWEZNQCLSA-N 1 1 362.445 3.781 50 0 FHAAMO CC[C@H]1Cn2c(C(=O)NCC[N@@H+](C)C3CCCCC3)cc3cccc(c32)O1 ZINC000035477437 571171538 /nfs/dbraw/zinc/17/15/38/571171538.db2.gz HWLORIRTKRZUNO-SFHVURJKSA-N 1 1 369.509 3.807 50 0 FHAAMO Cc1ncnc(N2CCC([C@@H]3CC[N@@H+](CCc4ccccc4)C3)CC2)c1C ZINC000072140176 571172147 /nfs/dbraw/zinc/17/21/47/571172147.db2.gz VIMICXIYHYLSLE-JOCHJYFZSA-N 1 1 364.537 3.874 50 0 FHAAMO C[NH+](C)Cc1cc2n(n1)CCN(Cc1ccc(-c3ccccc3Cl)o1)C2 ZINC000072166334 571176757 /nfs/dbraw/zinc/17/67/57/571176757.db2.gz POEFVDUQXFLKII-UHFFFAOYSA-N 1 1 370.884 3.874 50 0 FHAAMO Cc1nn(-c2ccccc2)cc1C[N@H+]1CCC[C@@H](OCc2ccccn2)C1 ZINC000072167783 571176992 /nfs/dbraw/zinc/17/69/92/571176992.db2.gz XREMSWSXBNDOQQ-JOCHJYFZSA-N 1 1 362.477 3.757 50 0 FHAAMO CC[N@@H+](Cc1ccncc1)[C@@H]1CCCN(C(=O)C(C)(C)c2ccccc2)C1 ZINC000072172918 571177701 /nfs/dbraw/zinc/17/77/01/571177701.db2.gz AGFDABFFRKWZKW-OAQYLSRUSA-N 1 1 365.521 3.872 50 0 FHAAMO COc1ccnc(C[N@@H+]2CCC[C@H](C(=O)CCc3ccccc3)C2)c1OC ZINC000072171485 571177729 /nfs/dbraw/zinc/17/77/29/571177729.db2.gz PLJOTSAHQXLFKP-SFHVURJKSA-N 1 1 368.477 3.513 50 0 FHAAMO COc1ccnc(C[N@H+]2CCC[C@H](C(=O)CCc3ccccc3)C2)c1OC ZINC000072171485 571177730 /nfs/dbraw/zinc/17/77/30/571177730.db2.gz PLJOTSAHQXLFKP-SFHVURJKSA-N 1 1 368.477 3.513 50 0 FHAAMO C[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(N2CCNC2=O)cc1 ZINC000072171618 571177737 /nfs/dbraw/zinc/17/77/37/571177737.db2.gz QOTSVROJTPNYIO-UHFFFAOYSA-N 1 1 362.433 3.503 50 0 FHAAMO C[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(N2CCNC2=O)cc1 ZINC000072171618 571177738 /nfs/dbraw/zinc/17/77/38/571177738.db2.gz QOTSVROJTPNYIO-UHFFFAOYSA-N 1 1 362.433 3.503 50 0 FHAAMO OC[C@@H]1CCC[N@@H+](Cc2cc(F)cc3c2O[C@@H](c2ccccc2)OC3)C1 ZINC000229706020 571178111 /nfs/dbraw/zinc/17/81/11/571178111.db2.gz WYMNJKCOXKTMRK-VFNWGFHPSA-N 1 1 357.425 3.638 50 0 FHAAMO OC[C@@H]1CCC[N@@H+](Cc2cc(F)cc3c2O[C@@H](c2ccsc2)OC3)C1 ZINC000229658316 571178130 /nfs/dbraw/zinc/17/81/30/571178130.db2.gz NPQVTGVRQDCXKS-YJYMSZOUSA-N 1 1 363.454 3.699 50 0 FHAAMO COc1ccccc1[C@@H]([NH2+][C@@H]1CCCc2[nH]c(=O)ccc21)c1ccco1 ZINC000090534823 571178330 /nfs/dbraw/zinc/17/83/30/571178330.db2.gz XAMXHYUJZVWMNK-DYESRHJHSA-N 1 1 350.418 3.733 50 0 FHAAMO Cc1c(C(=O)Nc2cc(F)ccc2OC(F)F)cnn1-c1cc[nH+]cc1 ZINC000090660578 571185222 /nfs/dbraw/zinc/18/52/22/571185222.db2.gz URLBTGAHXMQWAL-UHFFFAOYSA-N 1 1 362.311 3.569 50 0 FHAAMO COc1cc(/C=C/C(=O)NCCC[N@H+]2CCC[C@H](C)C2)ccc1OC(C)C ZINC000040108082 571185838 /nfs/dbraw/zinc/18/58/38/571185838.db2.gz ANBTXLIBMLDORQ-CKDFRHGISA-N 1 1 374.525 3.734 50 0 FHAAMO O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000013003228 571187700 /nfs/dbraw/zinc/18/77/00/571187700.db2.gz UBYBEHYDZSYWIY-SFHVURJKSA-N 1 1 362.395 3.639 50 0 FHAAMO Cc1cc(C)cc(C(=O)N2CC[NH+](Cc3cccc4cccnc43)CC2)c1 ZINC000013009839 571188212 /nfs/dbraw/zinc/18/82/12/571188212.db2.gz GEWFYUUCFFMEJT-UHFFFAOYSA-N 1 1 359.473 3.810 50 0 FHAAMO O=C1CC[N@H+](Cc2cccc3cccnc32)CCN1Cc1ccccc1F ZINC000299765849 571194634 /nfs/dbraw/zinc/19/46/34/571194634.db2.gz YQAFXJAOXPAZIC-UHFFFAOYSA-N 1 1 363.436 3.608 50 0 FHAAMO O=C(CCc1ccc(F)c(F)c1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000299769613 571195411 /nfs/dbraw/zinc/19/54/11/571195411.db2.gz OQAYRZORSYSHDA-SFHVURJKSA-N 1 1 358.432 3.536 50 0 FHAAMO O=C(NCCOc1ccc(F)cc1)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299772969 571196247 /nfs/dbraw/zinc/19/62/47/571196247.db2.gz DGEAESFDIHOWOF-HBMCJLEFSA-N 1 1 368.452 3.546 50 0 FHAAMO COc1cccc(Cc2c[nH+]cc3c2cc(OC)c(OC)c3OC)c1OC ZINC000072447063 571197109 /nfs/dbraw/zinc/19/71/09/571197109.db2.gz HLSUBSLWKFBRQD-UHFFFAOYSA-N 1 1 369.417 3.869 50 0 FHAAMO CC(C)[N@H+]1CCC[C@H](CN(C)C(=O)c2cccc(CCC(C)(C)O)c2)C1 ZINC000072462562 571197957 /nfs/dbraw/zinc/19/79/57/571197957.db2.gz BNTRQZOBYSSNNO-LJQANCHMSA-N 1 1 360.542 3.583 50 0 FHAAMO Cc1cc(C[NH+]2CCC3(CN(C[C@H](C)c4ccccc4)C(=O)O3)CC2)on1 ZINC000072476423 571199205 /nfs/dbraw/zinc/19/92/05/571199205.db2.gz VMVWBWUMYMMBAK-INIZCTEOSA-N 1 1 369.465 3.574 50 0 FHAAMO Cc1[nH+]ccn1[C@@H](C)CC(=O)N(C)Cc1csc(-c2ccccc2)n1 ZINC000072477886 571199465 /nfs/dbraw/zinc/19/94/65/571199465.db2.gz RVSSCCIWLCLGNF-AWEZNQCLSA-N 1 1 354.479 3.925 50 0 FHAAMO Cc1c[nH]c(CN(C)C(=O)Nc2cccc(C[N@@H+]3CCCC[C@@H]3C)c2)n1 ZINC000299788441 571200100 /nfs/dbraw/zinc/20/01/00/571200100.db2.gz SNLIPFIQHGZWFP-INIZCTEOSA-N 1 1 355.486 3.756 50 0 FHAAMO CCCc1nc(CNC(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)cs1 ZINC000299790560 571200726 /nfs/dbraw/zinc/20/07/26/571200726.db2.gz BLCCFRZHZQLURU-OTWHNJEPSA-N 1 1 369.534 3.937 50 0 FHAAMO COc1ccc(NC(=O)N2CC[NH+]([C@H](C)c3ccccc3)CC2)c(C)c1 ZINC000022335217 571201430 /nfs/dbraw/zinc/20/14/30/571201430.db2.gz AYHKVRUEWBKCIT-QGZVFWFLSA-N 1 1 353.466 3.914 50 0 FHAAMO Fc1cccc(-n2cc(C[N@H+]3CCCC[C@H]3CCn3ccnc3)cn2)c1 ZINC000077299536 571206677 /nfs/dbraw/zinc/20/66/77/571206677.db2.gz YRPYMLSXGIQGPN-IBGZPJMESA-N 1 1 353.445 3.653 50 0 FHAAMO C[N@H+]1CCC[C@H]1CCNC(=O)c1ccc(-c2ccc3cnc(N)cc3c2)cc1 ZINC000534666871 571208509 /nfs/dbraw/zinc/20/85/09/571208509.db2.gz APVDXEDOIFERGV-NRFANRHFSA-N 1 1 374.488 3.528 50 0 FHAAMO Cc1oc(-c2ccccc2F)nc1C[NH2+][C@H]1CC(=O)N(c2ccccc2)C1 ZINC000077356142 571208701 /nfs/dbraw/zinc/20/87/01/571208701.db2.gz VYASUUOHMJTFDE-HNNXBMFYSA-N 1 1 365.408 3.684 50 0 FHAAMO O=C(c1ccc(Cl)cc1F)N1CCC[N@H+](C2Cc3ccccc3C2)CC1 ZINC000077374886 571208952 /nfs/dbraw/zinc/20/89/52/571208952.db2.gz MPRPZWGZCZZFOU-UHFFFAOYSA-N 1 1 372.871 3.794 50 0 FHAAMO CCCCN1C[C@]2(CCC[N@@H+](Cc3c(C)nn(CC)c3C)C2)CCC1=O ZINC000077456855 571212342 /nfs/dbraw/zinc/21/23/42/571212342.db2.gz CKCQUPPCJKRVCF-OAQYLSRUSA-N 1 1 360.546 3.525 50 0 FHAAMO Cc1[nH+]ccn1-c1ncccc1NC(=O)Cc1c(C)nc2ccccc2c1C ZINC000089568317 571212403 /nfs/dbraw/zinc/21/24/03/571212403.db2.gz APCFXOFHRISOOP-UHFFFAOYSA-N 1 1 371.444 3.922 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3ccncc3Cl)[C@H]1C[C@@H](Oc1ccccn1)CC2 ZINC000426370745 571216150 /nfs/dbraw/zinc/21/61/50/571216150.db2.gz OGDSCGUAMJIPSE-XKGZKEIXSA-N 1 1 373.884 3.721 50 0 FHAAMO CCn1ncc(C[N@H+](C)Cc2cc(F)ccc2-n2nc(C)cc2C)c1C ZINC000426423373 571223654 /nfs/dbraw/zinc/22/36/54/571223654.db2.gz JVZGTGIDMNBHFP-UHFFFAOYSA-N 1 1 355.461 3.785 50 0 FHAAMO CCn1ncc(C[N@@H+](C)Cc2cc(F)ccc2-n2nc(C)cc2C)c1C ZINC000426423373 571223656 /nfs/dbraw/zinc/22/36/56/571223656.db2.gz JVZGTGIDMNBHFP-UHFFFAOYSA-N 1 1 355.461 3.785 50 0 FHAAMO C[C@H](NC(=O)C1CC1)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000023181123 571226485 /nfs/dbraw/zinc/22/64/85/571226485.db2.gz ICPZCIGYUOLMBY-JXFKEZNVSA-N 1 1 369.534 3.526 50 0 FHAAMO C[C@H](NC(=O)C1CC1)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000023181116 571226508 /nfs/dbraw/zinc/22/65/08/571226508.db2.gz ICPZCIGYUOLMBY-OXJNMPFZSA-N 1 1 369.534 3.526 50 0 FHAAMO O=C1CC[C@@]2(CCC[N@@H+](Cc3ccncc3)C2)CN1CCc1ccccc1 ZINC000082083587 571227646 /nfs/dbraw/zinc/22/76/46/571227646.db2.gz CZKPZQWUWBQMFM-HSZRJFAPSA-N 1 1 363.505 3.529 50 0 FHAAMO O=C1CC[C@]2(CCC[N@@H+](Cc3cccnc3)C2)CN1CCc1ccccc1 ZINC000082098143 571228169 /nfs/dbraw/zinc/22/81/69/571228169.db2.gz OHWNBRHEGIXNIS-QHCPKHFHSA-N 1 1 363.505 3.529 50 0 FHAAMO CCC(=O)c1cccc(-c2cccc(C(=O)N3CC[N@H+]4CCC[C@H]4C3)c2)c1 ZINC000426496819 571228423 /nfs/dbraw/zinc/22/84/23/571228423.db2.gz GQYJBDAWRVDOLC-NRFANRHFSA-N 1 1 362.473 3.867 50 0 FHAAMO Clc1ccc(CN2CC[C@H]3C[N@@H+](Cc4cccc5nonc54)C[C@H]32)s1 ZINC000082171978 571229652 /nfs/dbraw/zinc/22/96/52/571229652.db2.gz JJQHCLJONXJWBO-BLLLJJGKSA-N 1 1 374.897 3.644 50 0 FHAAMO CCC[NH+](CCC)CN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O ZINC000033286110 571229990 /nfs/dbraw/zinc/22/99/90/571229990.db2.gz OUUPBAHVKHOQLC-YBEGLDIGSA-N 1 1 362.451 3.531 50 0 FHAAMO CC[N@@H+](C)C1(CNC(=O)c2cccc(-c3ccc(CO)cc3)c2)CCCC1 ZINC000426545169 571230930 /nfs/dbraw/zinc/23/09/30/571230930.db2.gz RYGXGZIERAWKNS-UHFFFAOYSA-N 1 1 366.505 3.840 50 0 FHAAMO O=C(c1ccc(C[NH+]2CCSCC2)cc1)c1cc(F)c(F)c(F)c1 ZINC000085651307 571233710 /nfs/dbraw/zinc/23/37/10/571233710.db2.gz HDSQKBOXPXCETR-UHFFFAOYSA-N 1 1 351.393 3.884 50 0 FHAAMO c1cn(Cc2ccncc2)c(C2CCN(c3nc4ccccc4o3)CC2)[nH+]1 ZINC000091416721 571239428 /nfs/dbraw/zinc/23/94/28/571239428.db2.gz HMQRHAVCHLLUSN-UHFFFAOYSA-N 1 1 359.433 3.852 50 0 FHAAMO O=C1[C@H]2CC[C@H](C[N@@H+](Cc3cccc(C(F)(F)F)c3)C2)N1CC1CC1 ZINC000091411987 571239522 /nfs/dbraw/zinc/23/95/22/571239522.db2.gz LNQGQGHWJBOSMX-DOTOQJQBSA-N 1 1 352.400 3.538 50 0 FHAAMO O=C1[C@H]2CC[C@H](C[N@H+](Cc3cccc(C(F)(F)F)c3)C2)N1CC1CC1 ZINC000091411987 571239524 /nfs/dbraw/zinc/23/95/24/571239524.db2.gz LNQGQGHWJBOSMX-DOTOQJQBSA-N 1 1 352.400 3.538 50 0 FHAAMO c1cn(Cc2cscn2)c(C2CCN(c3nc4ccccc4o3)CC2)[nH+]1 ZINC000091440432 571239695 /nfs/dbraw/zinc/23/96/95/571239695.db2.gz KUSQWRWZBFDOBJ-UHFFFAOYSA-N 1 1 365.462 3.913 50 0 FHAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3cc(C)on3)CC2)C1 ZINC000091745505 571243154 /nfs/dbraw/zinc/24/31/54/571243154.db2.gz WXWJYDUOARUNNL-IBGZPJMESA-N 1 1 367.493 3.715 50 0 FHAAMO CC[C@@H](C)[N@H+](Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1ccccc1 ZINC000169681739 571247115 /nfs/dbraw/zinc/24/71/15/571247115.db2.gz MMDIQKGWVFTHLD-IEBWSBKVSA-N 1 1 373.493 3.744 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COc1ccccc1C[N@@H+](C[C@@H](O)COc1ccc(Cl)cc1)C1CC1 ZINC000036102907 205005901 /nfs/dbraw/zinc/00/59/01/205005901.db2.gz KCOZZQRNPGLOMT-GOSISDBHSA-N 1 1 361.869 3.753 50 0 FHAAMO CCn1cc(CN2CC[N@@H+](CC(C)(C)C)[C@H](CCO)C2)c2ccccc21 ZINC000036379395 205013363 /nfs/dbraw/zinc/01/33/63/205013363.db2.gz MBHCQSMJKWQEDM-LJQANCHMSA-N 1 1 357.542 3.576 50 0 FHAAMO O=C(Nc1ccc(-c2cc[nH]n2)cc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000039447340 205045899 /nfs/dbraw/zinc/04/58/99/205045899.db2.gz MFAIEJNNKYQMKS-LJQANCHMSA-N 1 1 360.461 3.927 50 0 FHAAMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)CCNC(=O)C3CCCC3)cc2)C1 ZINC000040121252 205058268 /nfs/dbraw/zinc/05/82/68/205058268.db2.gz IABXXWBQBXXOJN-KRWDZBQOSA-N 1 1 371.525 3.554 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)Nc1ccccc1OC ZINC000040152977 205060620 /nfs/dbraw/zinc/06/06/20/205060620.db2.gz NOWFNUUOPHKEHU-GOSISDBHSA-N 1 1 368.481 3.609 50 0 FHAAMO CC[N@H+]1CCC[C@H]1CNC(=O)c1c(C)onc1-c1c(F)cccc1Cl ZINC000040160255 205061249 /nfs/dbraw/zinc/06/12/49/205061249.db2.gz VBPFFZRYLVQOQE-LBPRGKRZSA-N 1 1 365.836 3.657 50 0 FHAAMO C[C@H](C(=O)N[C@@H]1CCOc2ccccc21)[N@H+]1CC=C(c2ccccc2)CC1 ZINC000042292746 205094652 /nfs/dbraw/zinc/09/46/52/205094652.db2.gz KPFLRXURBWIWON-DYESRHJHSA-N 1 1 362.473 3.804 50 0 FHAAMO C[C@H](C(=O)N[C@@H]1CCOc2ccccc21)[N@@H+]1CC=C(c2ccccc2)CC1 ZINC000042292746 205094656 /nfs/dbraw/zinc/09/46/56/205094656.db2.gz KPFLRXURBWIWON-DYESRHJHSA-N 1 1 362.473 3.804 50 0 FHAAMO CCOC(=O)CCCCCCC(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000043210946 205103086 /nfs/dbraw/zinc/10/30/86/205103086.db2.gz AEAJQQIOFVZKEM-UHFFFAOYSA-N 1 1 374.525 3.520 50 0 FHAAMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1cncc(-n2cccn2)n1 ZINC000048279144 205154366 /nfs/dbraw/zinc/15/43/66/205154366.db2.gz QKBVTQMPYTWGIH-KRWDZBQOSA-N 1 1 362.481 3.649 50 0 FHAAMO CCN(C(=O)C[N@H+]1CCC[C@H]1Cc1ccc(OC)cc1)c1ccc(F)cc1 ZINC000048290182 205156823 /nfs/dbraw/zinc/15/68/23/205156823.db2.gz OIBWKIKSAVZINA-FQEVSTJZSA-N 1 1 370.468 3.894 50 0 FHAAMO CC[C@@H](NC(=O)N[C@@H]1CCC[N@@H+](CC)C1)c1ccccc1OC(F)F ZINC000052526919 205185738 /nfs/dbraw/zinc/18/57/38/205185738.db2.gz WAAUDJCZRCGXOQ-UKRRQHHQSA-N 1 1 355.429 3.523 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)CCc2ccc3c(c2)OCO3)cc1F ZINC000054215638 205198840 /nfs/dbraw/zinc/19/88/40/205198840.db2.gz NECJIFOKEYZZBW-UHFFFAOYSA-N 1 1 367.380 3.620 50 0 FHAAMO C[C@H](CO)C[N@@H+](Cc1ccccc1)Cc1ccc(Oc2ncccn2)cc1 ZINC000055344383 205217057 /nfs/dbraw/zinc/21/70/57/205217057.db2.gz HJCYPQBWHUVYPA-SFHVURJKSA-N 1 1 363.461 3.900 50 0 FHAAMO COc1ccc(C(=O)[C@H]2CCC[N@H+](C3CSCCSC3)C2)c(C)c1 ZINC000055182435 205210082 /nfs/dbraw/zinc/21/00/82/205210082.db2.gz DCAKBHFKBVUUKW-HNNXBMFYSA-N 1 1 365.564 3.747 50 0 FHAAMO CC[C@H](CO)[N@H+](Cc1cccs1)Cc1ccc(OC)c(O)c1Cl ZINC000055392794 205217268 /nfs/dbraw/zinc/21/72/68/205217268.db2.gz OZDCXVAGTNIWPC-CYBMUJFWSA-N 1 1 355.887 3.889 50 0 FHAAMO CC[C@H](CO)[N@@H+](Cc1cccs1)Cc1ccc(OC)c(O)c1Cl ZINC000055392794 205217273 /nfs/dbraw/zinc/21/72/73/205217273.db2.gz OZDCXVAGTNIWPC-CYBMUJFWSA-N 1 1 355.887 3.889 50 0 FHAAMO c1cncc(C[N@H+](Cc2ccc3c(c2)OCO3)Cc2cccc3nonc32)c1 ZINC000055382940 205216532 /nfs/dbraw/zinc/21/65/32/205216532.db2.gz NUSFHTULOACHOS-UHFFFAOYSA-N 1 1 374.400 3.549 50 0 FHAAMO c1cncc(C[N@@H+](Cc2ccc3c(c2)OCO3)Cc2cccc3nonc32)c1 ZINC000055382940 205216534 /nfs/dbraw/zinc/21/65/34/205216534.db2.gz NUSFHTULOACHOS-UHFFFAOYSA-N 1 1 374.400 3.549 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056804815 205232489 /nfs/dbraw/zinc/23/24/89/205232489.db2.gz UQJKYJKUHCATAX-RHSMWYFYSA-N 1 1 365.905 3.727 50 0 FHAAMO Fc1ccccc1OCC[NH+]1CCN(c2nsc3ccccc32)CC1 ZINC000057151949 205236004 /nfs/dbraw/zinc/23/60/04/205236004.db2.gz SCAUGZNHKHYTKE-UHFFFAOYSA-N 1 1 357.454 3.636 50 0 FHAAMO COCC[N@H+](Cc1cccs1)Cc1cc(=O)oc2ccc(OC)cc12 ZINC000055562725 205220344 /nfs/dbraw/zinc/22/03/44/205220344.db2.gz VKZLFPBBQIXPAE-UHFFFAOYSA-N 1 1 359.447 3.512 50 0 FHAAMO COCC[N@@H+](Cc1cccs1)Cc1cc(=O)oc2ccc(OC)cc12 ZINC000055562725 205220348 /nfs/dbraw/zinc/22/03/48/205220348.db2.gz VKZLFPBBQIXPAE-UHFFFAOYSA-N 1 1 359.447 3.512 50 0 FHAAMO C[C@@H](CNC(=O)Nc1cnc2ccccc2c1)[N@@H+]1CCc2sccc2C1 ZINC000058087838 205249541 /nfs/dbraw/zinc/24/95/41/205249541.db2.gz HUORRIVGMJEJKU-AWEZNQCLSA-N 1 1 366.490 3.865 50 0 FHAAMO C[C@@H](CNC(=O)Nc1cnc2ccccc2c1)[N@H+]1CCc2sccc2C1 ZINC000058087838 205249545 /nfs/dbraw/zinc/24/95/45/205249545.db2.gz HUORRIVGMJEJKU-AWEZNQCLSA-N 1 1 366.490 3.865 50 0 FHAAMO C[C@H](C1CC1)[N@@H+](C)CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000058191912 205257313 /nfs/dbraw/zinc/25/73/13/205257313.db2.gz UFNPLQOOUIAGRW-CYBMUJFWSA-N 1 1 357.479 3.669 50 0 FHAAMO CC[C@H](C)[N@@H+](C)CC(=O)Nc1ccccc1C(=O)Nc1cccc(C)c1 ZINC000058308660 205270739 /nfs/dbraw/zinc/27/07/39/205270739.db2.gz CKIGWSBGBIPDQY-INIZCTEOSA-N 1 1 353.466 3.916 50 0 FHAAMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2cncc(-n3cccn3)n2)C1 ZINC000057984852 205247126 /nfs/dbraw/zinc/24/71/26/205247126.db2.gz HRVMLAIZHCNBHR-QGZVFWFLSA-N 1 1 362.481 3.506 50 0 FHAAMO COCC[NH2+][C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000057999867 205247952 /nfs/dbraw/zinc/24/79/52/205247952.db2.gz HYAYHKSPYUKJLE-INIZCTEOSA-N 1 1 353.249 3.909 50 0 FHAAMO C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C[C@@H](C)O1 ZINC000060061236 205283182 /nfs/dbraw/zinc/28/31/82/205283182.db2.gz LGTYOEPXHBRYHI-XNJGSVPQSA-N 1 1 371.308 3.707 50 0 FHAAMO CCC[NH+]1CCN(C(=O)c2ccc(-n3ccc4ccccc43)s2)CC1 ZINC000063647396 205294173 /nfs/dbraw/zinc/29/41/73/205294173.db2.gz VUKCXFOOGKKJLT-UHFFFAOYSA-N 1 1 353.491 3.860 50 0 FHAAMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)CCc1cc2ccccc2[nH]c1=O ZINC000065245421 205328411 /nfs/dbraw/zinc/32/84/11/205328411.db2.gz WXWBFJXNCJQRMR-IBGZPJMESA-N 1 1 369.509 3.644 50 0 FHAAMO CC(C)Oc1ccc(CNC(=O)C2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC000064817966 205306462 /nfs/dbraw/zinc/30/64/62/205306462.db2.gz IOKXMCXCQPDUQG-UHFFFAOYSA-N 1 1 364.489 3.922 50 0 FHAAMO CC(C)C(=O)Nc1cccnc1-c1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000065490350 205354406 /nfs/dbraw/zinc/35/44/06/205354406.db2.gz PQXNGNNZOBQCAL-INIZCTEOSA-N 1 1 353.466 3.736 50 0 FHAAMO CCCCc1ccc(C(=O)CCC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000065585898 205359886 /nfs/dbraw/zinc/35/98/86/205359886.db2.gz UHJGSIFNXMEAMY-HXUWFJFHSA-N 1 1 356.510 3.689 50 0 FHAAMO O=C(CC[N@H+]1CCC[C@@H]1c1ccccn1)Nc1nc2ccccc2s1 ZINC000065384732 205342500 /nfs/dbraw/zinc/34/25/00/205342500.db2.gz WDIVXVZTUPZPFW-MRXNPFEDSA-N 1 1 352.463 3.857 50 0 FHAAMO Cn1cc(C[N@H+](C)Cc2cccc(C(=O)Nc3c(F)cccc3F)c2)cn1 ZINC000065395358 205345275 /nfs/dbraw/zinc/34/52/75/205345275.db2.gz HDBGIHMBCOLSOL-UHFFFAOYSA-N 1 1 370.403 3.583 50 0 FHAAMO Cn1cc(C[N@@H+](C)Cc2cccc(C(=O)Nc3c(F)cccc3F)c2)cn1 ZINC000065395358 205345280 /nfs/dbraw/zinc/34/52/80/205345280.db2.gz HDBGIHMBCOLSOL-UHFFFAOYSA-N 1 1 370.403 3.583 50 0 FHAAMO Cc1ccsc1[C@@H]1CC[N@H+](Cc2coc3ccc(C)cc3c2=O)C[C@H]1O ZINC000065408654 205347955 /nfs/dbraw/zinc/34/79/55/205347955.db2.gz ZIBGSCBDHUCRHW-SJLPKXTDSA-N 1 1 369.486 3.822 50 0 FHAAMO Cc1ccsc1[C@@H]1CC[N@@H+](Cc2coc3ccc(C)cc3c2=O)C[C@H]1O ZINC000065408654 205347958 /nfs/dbraw/zinc/34/79/58/205347958.db2.gz ZIBGSCBDHUCRHW-SJLPKXTDSA-N 1 1 369.486 3.822 50 0 FHAAMO Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C[N@H+]1CCC[C@@H](CO)C1 ZINC000067514002 205374903 /nfs/dbraw/zinc/37/49/03/205374903.db2.gz YAXKQZBSAYCNKH-CYBMUJFWSA-N 1 1 354.372 3.873 50 0 FHAAMO Cc1cccc(CO)c1NC(=O)c1cccc(C[N@H+](C)Cc2ccoc2)c1 ZINC000067541274 205375090 /nfs/dbraw/zinc/37/50/90/205375090.db2.gz XZUUKNSHDLADDX-UHFFFAOYSA-N 1 1 364.445 3.965 50 0 FHAAMO Cc1cccc(CO)c1NC(=O)c1cccc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000067541274 205375095 /nfs/dbraw/zinc/37/50/95/205375095.db2.gz XZUUKNSHDLADDX-UHFFFAOYSA-N 1 1 364.445 3.965 50 0 FHAAMO Cc1cccnc1C[C@@H](C)[N@@H+](C)Cc1cc2ccc(Cl)cc2[nH]c1=O ZINC000067588861 205376038 /nfs/dbraw/zinc/37/60/38/205376038.db2.gz BPOHMYVMSZFRRJ-CQSZACIVSA-N 1 1 355.869 3.948 50 0 FHAAMO Cc1cc(C)n([C@H]2CC[N@@H+](Cc3cnc4c(-c5ccccc5)cnn4c3)C2)n1 ZINC000067674232 205379584 /nfs/dbraw/zinc/37/95/84/205379584.db2.gz LMEJLIQOFPWINX-FQEVSTJZSA-N 1 1 372.476 3.657 50 0 FHAAMO Cc1cccc2[nH]c([C@@H]3CCC[N@H+](Cc4nc(-c5ccco5)no4)C3)nc21 ZINC000067672928 205379811 /nfs/dbraw/zinc/37/98/11/205379811.db2.gz IUEXSUNISZJDTD-CQSZACIVSA-N 1 1 363.421 3.894 50 0 FHAAMO Cc1cccc2[nH]c([C@@H]3CCC[N@@H+](Cc4nc(-c5ccco5)no4)C3)nc21 ZINC000067672928 205379816 /nfs/dbraw/zinc/37/98/16/205379816.db2.gz IUEXSUNISZJDTD-CQSZACIVSA-N 1 1 363.421 3.894 50 0 FHAAMO Cc1[nH+]ccn1[C@@H](C)C(=O)N1CCC(c2n[nH]cc2-c2ccccc2)CC1 ZINC000067754393 205389769 /nfs/dbraw/zinc/38/97/69/205389769.db2.gz YGMXYNIVXCCQQZ-HNNXBMFYSA-N 1 1 363.465 3.549 50 0 FHAAMO Cc1ccc(C)c(-n2cc(C[NH+]3CCN(C)CC3)c(-c3ccccc3)n2)c1 ZINC000072463439 205556770 /nfs/dbraw/zinc/55/67/70/205556770.db2.gz YJJUQCKIPORGHB-UHFFFAOYSA-N 1 1 360.505 3.904 50 0 FHAAMO Cc1ccccc1[C@H](C(=O)NCc1cc(-c2cccc(F)c2)no1)[NH+](C)C ZINC000095506599 205773515 /nfs/dbraw/zinc/77/35/15/205773515.db2.gz XOSPKHWBXGWJIA-HXUWFJFHSA-N 1 1 367.424 3.708 50 0 FHAAMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000105750099 206009840 /nfs/dbraw/zinc/00/98/40/206009840.db2.gz FXBJOEJTYRHYCE-YADHBBJMSA-N 1 1 369.505 3.724 50 0 FHAAMO C[C@@H](NC(=O)C[N@@H+]1CCC[C@H]1c1cccn1C)c1cc2ccccc2o1 ZINC000103994145 206229777 /nfs/dbraw/zinc/22/97/77/206229777.db2.gz QWZBFOWGJSWULM-QAPCUYQASA-N 1 1 351.450 3.786 50 0 FHAAMO C[C@@H](NC(=O)C[N@H+]1CCC[C@H]1c1cccn1C)c1cc2ccccc2o1 ZINC000103994145 206229781 /nfs/dbraw/zinc/22/97/81/206229781.db2.gz QWZBFOWGJSWULM-QAPCUYQASA-N 1 1 351.450 3.786 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1cc(Br)ccc1Cl)c1ccco1 ZINC000003491257 206234217 /nfs/dbraw/zinc/23/42/17/206234217.db2.gz LHQNNFQZLGCNMC-CYBMUJFWSA-N 1 1 371.662 3.728 50 0 FHAAMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(C3CC3)on2)CC[N@H+]1Cc1ccccc1 ZINC000172411877 206283008 /nfs/dbraw/zinc/28/30/08/206283008.db2.gz DDGLSCJMFOJKDB-QAPCUYQASA-N 1 1 353.466 3.677 50 0 FHAAMO Cc1nc2cc(NC(=O)COc3cc[nH+]c4c3CCCC4)ccc2s1 ZINC000207012803 206284604 /nfs/dbraw/zinc/28/46/04/206284604.db2.gz WZCJCDUJEKJYCN-UHFFFAOYSA-N 1 1 353.447 3.896 50 0 FHAAMO Cc1nn(C)c(C)c1CCC(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000053720645 206310671 /nfs/dbraw/zinc/31/06/71/206310671.db2.gz CQMISUFOZAPIMQ-INIZCTEOSA-N 1 1 368.525 3.983 50 0 FHAAMO CC1(C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)OCCCO1 ZINC000190670381 206326658 /nfs/dbraw/zinc/32/66/58/206326658.db2.gz SQAMKWWBVXNPHI-MRXNPFEDSA-N 1 1 366.255 3.874 50 0 FHAAMO C[C@@H]1C[NH+](Cc2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000195528679 206331962 /nfs/dbraw/zinc/33/19/62/206331962.db2.gz FHEZZRCEQVNWLE-YVHKJVDXSA-N 1 1 364.489 3.713 50 0 FHAAMO COc1c2c(cc3c1[C@@H](n1ccc4ccc(F)cc41)[N@H+](C)CC3)OCO2 ZINC000020759349 206343183 /nfs/dbraw/zinc/34/31/83/206343183.db2.gz NMWFHRFZEBIUKN-HXUWFJFHSA-N 1 1 354.381 3.553 50 0 FHAAMO COc1c2c(cc3c1[C@@H](n1ccc4ccc(F)cc41)[N@@H+](C)CC3)OCO2 ZINC000020759349 206343187 /nfs/dbraw/zinc/34/31/87/206343187.db2.gz NMWFHRFZEBIUKN-HXUWFJFHSA-N 1 1 354.381 3.553 50 0 FHAAMO Cn1ccnc1CN1CC[NH+](Cc2ccc(C3CCCCC3)s2)CC1 ZINC000215306558 206344863 /nfs/dbraw/zinc/34/48/63/206344863.db2.gz VMZCTFBEZJUYBI-UHFFFAOYSA-N 1 1 358.555 3.847 50 0 FHAAMO Cn1cccc1[C@H](CNC(=O)c1ccccc1)[N@@H+]1CCc2ccccc2C1 ZINC000021151865 206351673 /nfs/dbraw/zinc/35/16/73/206351673.db2.gz MYHPLDYLJLGNKX-QFIPXVFZSA-N 1 1 359.473 3.555 50 0 FHAAMO Cn1cccc1[C@H](CNC(=O)c1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000021151865 206351676 /nfs/dbraw/zinc/35/16/76/206351676.db2.gz MYHPLDYLJLGNKX-QFIPXVFZSA-N 1 1 359.473 3.555 50 0 FHAAMO CCCOc1c(C[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)cc(Cl)cc1OC ZINC000216061498 206353653 /nfs/dbraw/zinc/35/36/53/206353653.db2.gz KHTGFHIKEDNUSL-ZDUSSCGKSA-N 1 1 364.877 3.635 50 0 FHAAMO CCCOc1c(C[N@H+]2CCC[C@H](c3nnc[nH]3)C2)cc(Cl)cc1OC ZINC000216061498 206353659 /nfs/dbraw/zinc/35/36/59/206353659.db2.gz KHTGFHIKEDNUSL-ZDUSSCGKSA-N 1 1 364.877 3.635 50 0 FHAAMO Cc1[nH+]cn(CCNC(=O)c2c(C)onc2-c2ccccc2Cl)c1C ZINC000218945592 206376774 /nfs/dbraw/zinc/37/67/74/206376774.db2.gz JRGXPFDTCRJPRO-UHFFFAOYSA-N 1 1 358.829 3.547 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(C2SCCS2)cc1)c1ccco1 ZINC000021903075 206363324 /nfs/dbraw/zinc/36/33/24/206363324.db2.gz HAFQTDSEYIJDDG-OAHLLOKOSA-N 1 1 362.520 3.791 50 0 FHAAMO COc1cc2c(cc1C[NH2+]C1CCN(Cc3ccccc3)CC1)O[C@@H](C)C2 ZINC000022771322 206392227 /nfs/dbraw/zinc/39/22/27/206392227.db2.gz VZPCDOPLRKFMMN-KRWDZBQOSA-N 1 1 366.505 3.773 50 0 FHAAMO Cc1cccc(OC2CN(C(=O)[C@H]3CCCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000220024344 206396926 /nfs/dbraw/zinc/39/69/26/206396926.db2.gz SZLXJUJOMTXGQD-JOCHJYFZSA-N 1 1 364.489 3.639 50 0 FHAAMO O=c1cc(C[N@@H+]2CCc3sccc3[C@H]2c2ccccc2)nc2ccccn12 ZINC000023039912 206397848 /nfs/dbraw/zinc/39/78/48/206397848.db2.gz WLSFXSUDEHUPFG-JOCHJYFZSA-N 1 1 373.481 3.904 50 0 FHAAMO O=c1cc(C[N@H+]2CCc3sccc3[C@H]2c2ccccc2)nc2ccccn12 ZINC000023039912 206397852 /nfs/dbraw/zinc/39/78/52/206397852.db2.gz WLSFXSUDEHUPFG-JOCHJYFZSA-N 1 1 373.481 3.904 50 0 FHAAMO CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3cnc4ccccc4c3)C[C@@H]21 ZINC000225581561 206487124 /nfs/dbraw/zinc/48/71/24/206487124.db2.gz HIXYJQWLYQXPLW-CMKODMSKSA-N 1 1 367.493 3.970 50 0 FHAAMO C[NH+](C)Cc1cc(NC(=O)c2cnn(Cc3ccccc3)c2)ccc1Cl ZINC000225623696 206490562 /nfs/dbraw/zinc/49/05/62/206490562.db2.gz LVBFROSNGAFAMU-UHFFFAOYSA-N 1 1 368.868 3.899 50 0 FHAAMO Cc1[nH+]c2n(c1CCNC(=O)CCSc1ccc(C)c(C)c1)CCCC2 ZINC000048236288 221002192 /nfs/dbraw/zinc/00/21/92/221002192.db2.gz KURVBOZXLOCNSI-UHFFFAOYSA-N 1 1 371.550 3.986 50 0 FHAAMO c1cn(Cc2ccccc2)c([C@H]2CCCN(c3[nH+]cnc4[nH]ccc43)C2)n1 ZINC000082170753 132198090 /nfs/dbraw/zinc/19/80/90/132198090.db2.gz VCZWRMPDEOVAIS-KRWDZBQOSA-N 1 1 358.449 3.587 50 0 FHAAMO Clc1cccnc1N1CCC[C@H](c2[nH+]ccn2Cc2cccnc2)C1 ZINC000091782220 132203922 /nfs/dbraw/zinc/20/39/22/132203922.db2.gz GSEQRMRMKNKIEB-INIZCTEOSA-N 1 1 353.857 3.759 50 0 FHAAMO Clc1ccc(N2CCC(c3[nH+]ccn3Cc3ccncc3)CC2)nc1 ZINC000091781576 132204021 /nfs/dbraw/zinc/20/40/21/132204021.db2.gz LOLRALMIEWLAFY-UHFFFAOYSA-N 1 1 353.857 3.759 50 0 FHAAMO Clc1ccc(N2CCC(c3[nH+]ccn3Cc3ccccn3)CC2)nc1 ZINC000092078825 132206233 /nfs/dbraw/zinc/20/62/33/132206233.db2.gz HPBQIEBKNBCUAP-UHFFFAOYSA-N 1 1 353.857 3.759 50 0 FHAAMO Cc1cc(C)c2c(ncnc2N2CCC([N@H+]3CCc4ccccc4C3)CC2)n1 ZINC000095356337 132207060 /nfs/dbraw/zinc/20/70/60/132207060.db2.gz ZCDPDUKMDGFDLS-UHFFFAOYSA-N 1 1 373.504 3.669 50 0 FHAAMO C[C@@H]1CCC[N@@H+](CC(=O)N2c3ccccc3OC[C@H]2c2ccccc2)C1 ZINC000107326262 132241603 /nfs/dbraw/zinc/24/16/03/132241603.db2.gz UVCFBZNFCJHWOD-XLIONFOSSA-N 1 1 350.462 3.885 50 0 FHAAMO Cc1ccc2c(C[NH+]3CCN(c4ccccc4F)CC3)cc(=O)oc2c1C ZINC000054105985 132376136 /nfs/dbraw/zinc/37/61/36/132376136.db2.gz XMCZFKZYABFVNI-UHFFFAOYSA-N 1 1 366.436 3.871 50 0 FHAAMO COc1cc(C[NH+]2CCN(c3cccc(C)c3C)CC2)cc(OC)c1OC ZINC000001227712 132381388 /nfs/dbraw/zinc/38/13/88/132381388.db2.gz WUVOWDJYAAWURG-UHFFFAOYSA-N 1 1 370.493 3.651 50 0 FHAAMO Fc1cccc(-c2ccc(C[NH+]3CCN(c4ncccn4)CC3)s2)c1 ZINC000040072329 136119208 /nfs/dbraw/zinc/11/92/08/136119208.db2.gz OKKXFUUBDLUPHO-UHFFFAOYSA-N 1 1 354.454 3.666 50 0 FHAAMO Cn1cc(C[N@@H+](C)C2CCN(c3cccc(-c4cscn4)c3)CC2)cn1 ZINC000048156066 136123002 /nfs/dbraw/zinc/12/30/02/136123002.db2.gz CMRVPFZWKPJTMG-UHFFFAOYSA-N 1 1 367.522 3.644 50 0 FHAAMO O[C@@H](C[NH+]1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000058391929 136131685 /nfs/dbraw/zinc/13/16/85/136131685.db2.gz SZSIYCHMFQTILX-SFHVURJKSA-N 1 1 350.384 3.561 50 0 FHAAMO COc1cccc(C(=O)N2CC[NH+](Cc3ccc4ccccc4c3)CC2)c1 ZINC000019773515 263376873 /nfs/dbraw/zinc/37/68/73/263376873.db2.gz WZSCAEOPUGNSHM-UHFFFAOYSA-N 1 1 360.457 3.806 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(-c2ccc(OC)cc2OC)cc1 ZINC000426361848 263565547 /nfs/dbraw/zinc/56/55/47/263565547.db2.gz XEACCGYHSAXRBV-GOSISDBHSA-N 1 1 368.477 3.585 50 0 FHAAMO CCC[N@H+]1CCCn2nc(CNC(=O)Nc3ccccc3SC)cc2C1 ZINC000082099727 519854857 /nfs/dbraw/zinc/85/48/57/519854857.db2.gz XSAIGBXKXKDKEM-UHFFFAOYSA-N 1 1 373.526 3.542 50 0 FHAAMO CCCCc1nc(C[NH+]2CCC(CO)(CCOc3ccccc3)CC2)c[nH]1 ZINC000020601329 521293778 /nfs/dbraw/zinc/29/37/78/521293778.db2.gz VPZLDDXEAHCRAR-UHFFFAOYSA-N 1 1 371.525 3.796 50 0 FHAAMO CCC[N@@H+](Cc1ccc(C)cc1)CN1C(=O)N[C@@]2(C1=O)[C@H](C)CCC[C@@H]2C ZINC000252457300 521683765 /nfs/dbraw/zinc/68/37/65/521683765.db2.gz WJDURTDAVDJIHQ-OEWRPIJISA-N 1 1 371.525 3.911 50 0 FHAAMO CCC[N@H+](Cc1ccc(C)cc1)CN1C(=O)N[C@@]2(C1=O)[C@H](C)CCC[C@@H]2C ZINC000252457300 521683770 /nfs/dbraw/zinc/68/37/70/521683770.db2.gz WJDURTDAVDJIHQ-OEWRPIJISA-N 1 1 371.525 3.911 50 0 FHAAMO CCc1nn2c(nc(C[N@@H+](C)Cc3ccc(C(C)(C)C)cc3)cc2=O)s1 ZINC000020961979 522707024 /nfs/dbraw/zinc/70/70/24/522707024.db2.gz XRLIGRPUGWEIJM-UHFFFAOYSA-N 1 1 370.522 3.643 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@@H+]1CCC[C@H]1c1ccc(OC)cc1OC ZINC000252452888 523000742 /nfs/dbraw/zinc/00/07/42/523000742.db2.gz LDQPQUBLCKHCJX-LPHOPBHVSA-N 1 1 360.498 3.632 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@H+]1CCC[C@H]1c1ccc(OC)cc1OC ZINC000252452888 523000760 /nfs/dbraw/zinc/00/07/60/523000760.db2.gz LDQPQUBLCKHCJX-LPHOPBHVSA-N 1 1 360.498 3.632 50 0 FHAAMO CN(C[C@@H]1Cc2ccccc2C[N@H+]1C)C(=O)c1ccc(-c2ccccc2)n1C ZINC000082138647 523084848 /nfs/dbraw/zinc/08/48/48/523084848.db2.gz HDOXQQJYZXJGCY-NRFANRHFSA-N 1 1 373.500 3.821 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(C)n3)C2)cc1OC ZINC000020538984 523776604 /nfs/dbraw/zinc/77/66/04/523776604.db2.gz KYFJLLREEHNWQD-QGZVFWFLSA-N 1 1 354.450 3.502 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000241961228 524103469 /nfs/dbraw/zinc/10/34/69/524103469.db2.gz UQJKYJKUHCATAX-PBHICJAKSA-N 1 1 365.905 3.727 50 0 FHAAMO COc1ccccc1C[NH2+]Cc1cc(Br)cc(OC)c1OC ZINC000020933971 524488835 /nfs/dbraw/zinc/48/88/35/524488835.db2.gz RKUDDFWNZZDICL-UHFFFAOYSA-N 1 1 366.255 3.765 50 0 FHAAMO Cc1[nH+]ccn1CC1(Cn2cc(-c3ccc(C)c4ncccc34)nn2)CC1 ZINC000091808820 570439639 /nfs/dbraw/zinc/43/96/39/570439639.db2.gz LWAYYBYXQHBXFQ-UHFFFAOYSA-N 1 1 358.449 3.787 50 0 FHAAMO Cc1cccc2cc(C(=O)N3C[C@H]4CC[C@H](C[N@@H+]4CC4CCC4)C3)n(C)c21 ZINC000091830807 570440273 /nfs/dbraw/zinc/44/02/73/570440273.db2.gz APFHZUWRZDWXIV-UYAOXDASSA-N 1 1 365.521 3.823 50 0 FHAAMO COc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)c(F)c1 ZINC000091896603 570442037 /nfs/dbraw/zinc/44/20/37/570442037.db2.gz RMFDCPFZKLQKMP-VQIMIIECSA-N 1 1 368.452 3.571 50 0 FHAAMO COc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)c(F)c1 ZINC000091896603 570442039 /nfs/dbraw/zinc/44/20/39/570442039.db2.gz RMFDCPFZKLQKMP-VQIMIIECSA-N 1 1 368.452 3.571 50 0 FHAAMO Cc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccn2)C3)cc1Cl ZINC000092099934 570447592 /nfs/dbraw/zinc/44/75/92/570447592.db2.gz MXLZPYBCKNZQNY-QFBILLFUSA-N 1 1 369.896 3.780 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCCC[C@@H]1CCc1ccc(O)cc1 ZINC000095354626 570452871 /nfs/dbraw/zinc/45/28/71/570452871.db2.gz XUWBTCKWDBKNAU-LJQANCHMSA-N 1 1 355.482 3.691 50 0 FHAAMO Fc1ccc(C[N@H+]2CCC[C@H](Nc3nccc(C(F)(F)F)n3)C2)cc1 ZINC000095354187 570452928 /nfs/dbraw/zinc/45/29/28/570452928.db2.gz VOOHDQWMLVXQNW-AWEZNQCLSA-N 1 1 354.351 3.711 50 0 FHAAMO Oc1cccc([C@@H]2C[N@@H+](Cc3ccc(F)cc3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000095361949 570454466 /nfs/dbraw/zinc/45/44/66/570454466.db2.gz RUVQERJOGFCBQF-BHDDXSALSA-N 1 1 352.453 3.594 50 0 FHAAMO Oc1cccc([C@@H]2CN(Cc3ccc(F)cc3)[C@H]3[C@@H]2[NH+]2CCC3CC2)c1 ZINC000095361949 570454468 /nfs/dbraw/zinc/45/44/68/570454468.db2.gz RUVQERJOGFCBQF-BHDDXSALSA-N 1 1 352.453 3.594 50 0 FHAAMO Cc1cccc(C[N@H+]2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n1 ZINC000095363945 570455006 /nfs/dbraw/zinc/45/50/06/570455006.db2.gz HMIYACCJPWGIRE-VLCRHTCISA-N 1 1 369.459 3.730 50 0 FHAAMO COc1cccc(C[N@H+]2CCC[C@@H](c3nccn3Cc3cscn3)C2)c1 ZINC000095371420 570456308 /nfs/dbraw/zinc/45/63/08/570456308.db2.gz GJBJSOVVHHKRKB-QGZVFWFLSA-N 1 1 368.506 3.776 50 0 FHAAMO O=C(c1ccc[nH]1)N1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095391159 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CC[C@@H]1C[N@@H+](Cc2cncn2CC(C)C)CCC(=O)N1Cc1ccccc1 ZINC000071524325 571162645 /nfs/dbraw/zinc/16/26/45/571162645.db2.gz LUMDHCCRVSSDMA-HXUWFJFHSA-N 1 1 368.525 3.552 50 0 FHAAMO CCCC(=O)N1CCC([N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000071638993 571162873 /nfs/dbraw/zinc/16/28/73/571162873.db2.gz UURHGJMREOLPLY-SFHVURJKSA-N 1 1 350.890 3.504 50 0 FHAAMO CCCC(=O)N1CCC([N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000071638993 571162876 /nfs/dbraw/zinc/16/28/76/571162876.db2.gz UURHGJMREOLPLY-SFHVURJKSA-N 1 1 350.890 3.504 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)Cc2cccnc2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071681826 571163344 /nfs/dbraw/zinc/16/33/44/571163344.db2.gz ZVYCTQCROGTOFO-NRFANRHFSA-N 1 1 369.484 3.522 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+](C)CCC3(O)CCCC3)c(C)o2)c(F)c1 ZINC000071745597 571164399 /nfs/dbraw/zinc/16/43/99/571164399.db2.gz QCZGFQLANIRSTR-UHFFFAOYSA-N 1 1 362.445 3.925 50 0 FHAAMO COc1ccc(-c2nc(C[N@@H+](C)CCC3(O)CCCC3)c(C)o2)c(F)c1 ZINC000071745597 571164401 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OC[C@]1(O)CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 ZINC000072120881 571170110 /nfs/dbraw/zinc/17/01/10/571170110.db2.gz CVENJRORGGSIBY-SFHVURJKSA-N 1 1 370.276 3.963 50 0 FHAAMO Cc1cccc2[nH]c([C@@H]3CCC[N@H+](Cc4cnc(N(C)C)s4)C3)nc21 ZINC000072125568 571170317 /nfs/dbraw/zinc/17/03/17/571170317.db2.gz QEKITBDCPHQYCC-CQSZACIVSA-N 1 1 355.511 3.773 50 0 FHAAMO Cc1cccc2nc([C@@H]3CCC[N@@H+](Cc4cnc(N(C)C)s4)C3)[nH]c21 ZINC000072125568 571170319 /nfs/dbraw/zinc/17/03/19/571170319.db2.gz QEKITBDCPHQYCC-CQSZACIVSA-N 1 1 355.511 3.773 50 0 FHAAMO Cc1cccc2nc([C@@H]3CCC[N@H+](Cc4cnc(N(C)C)s4)C3)[nH]c21 ZINC000072125568 571170320 /nfs/dbraw/zinc/17/03/20/571170320.db2.gz QEKITBDCPHQYCC-CQSZACIVSA-N 1 1 355.511 3.773 50 0 FHAAMO Cc1cccc(Cl)c1NC(=O)N1CCCC[C@@H]1CC[NH+]1CCOCC1 ZINC000072126312 571170386 /nfs/dbraw/zinc/17/03/86/571170386.db2.gz HUJHKEVZBNWYLB-MRXNPFEDSA-N 1 1 365.905 3.757 50 0 FHAAMO Cc1nccn1C[C@H]1CCC[N@@H+](Cc2c(C)cc(C)cc2-n2cccn2)C1 ZINC000072138833 571171620 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CSc1ncc(C[N@@H+]2CCC[C@H](c3nc4cccc(C)c4[nH]3)C2)cn1 ZINC000072162959 571176197 /nfs/dbraw/zinc/17/61/97/571176197.db2.gz RFEIDMKRVIMAPZ-HNNXBMFYSA-N 1 1 353.495 3.763 50 0 FHAAMO CSc1ncc(C[N@H+]2CCC[C@H](c3nc4cccc(C)c4[nH]3)C2)cn1 ZINC000072162959 571176198 /nfs/dbraw/zinc/17/61/98/571176198.db2.gz RFEIDMKRVIMAPZ-HNNXBMFYSA-N 1 1 353.495 3.763 50 0 FHAAMO COc1cccc([C@@H]2C[N@H+](Cc3csc(C)n3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000072164818 571176484 /nfs/dbraw/zinc/17/64/84/571176484.db2.gz DRGKURWKOCKNJW-PWRODBHTSA-N 1 1 369.534 3.522 50 0 FHAAMO COc1cccc([C@@H]2C[N@@H+](Cc3csc(C)n3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000072164818 571176485 /nfs/dbraw/zinc/17/64/85/571176485.db2.gz DRGKURWKOCKNJW-PWRODBHTSA-N 1 1 369.534 3.522 50 0 FHAAMO CC[N@@H+](Cc1ccncc1)[C@H]1CCCN(C(=O)C(C)(C)c2ccccc2)C1 ZINC000072172919 571177618 /nfs/dbraw/zinc/17/76/18/571177618.db2.gz AGFDABFFRKWZKW-NRFANRHFSA-N 1 1 365.521 3.872 50 0 FHAAMO O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(O)c(Cl)c1 ZINC000013022299 571189914 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3.671 50 0 FHAAMO Cc1cc(-n2cccn2)ccc1CN1CC[C@@]2(C1)CCC[N@H+](CC1CC1)C2 ZINC000072419757 571192916 /nfs/dbraw/zinc/19/29/16/571192916.db2.gz BCIGAYVNGOCHCT-QHCPKHFHSA-N 1 1 364.537 3.879 50 0 FHAAMO Cc1cc(-n2cccn2)ccc1CN1CC[C@@]2(C1)CCC[N@@H+](CC1CC1)C2 ZINC000072419757 571192918 /nfs/dbraw/zinc/19/29/18/571192918.db2.gz BCIGAYVNGOCHCT-QHCPKHFHSA-N 1 1 364.537 3.879 50 0 FHAAMO CN1CC[N@@H+](Cc2ccc(CCC(C)(C)O)cc2)C[C@H]1c1ccccc1 ZINC000072421695 571193218 /nfs/dbraw/zinc/19/32/18/571193218.db2.gz CTVHJWOOGYPIAS-QFIPXVFZSA-N 1 1 352.522 3.879 50 0 FHAAMO C[N@@H+]1CCN(Cc2ccc(CCC(C)(C)O)cc2)C[C@H]1c1ccccc1 ZINC000072421695 571193219 /nfs/dbraw/zinc/19/32/19/571193219.db2.gz CTVHJWOOGYPIAS-QFIPXVFZSA-N 1 1 352.522 3.879 50 0 FHAAMO C[N@H+]1CCN(Cc2ccc(CCC(C)(C)O)cc2)C[C@H]1c1ccccc1 ZINC000072421695 571193220 /nfs/dbraw/zinc/19/32/20/571193220.db2.gz CTVHJWOOGYPIAS-QFIPXVFZSA-N 1 1 352.522 3.879 50 0 FHAAMO Cc1[nH+]ccn1CC[C@H](NC(=O)c1ncoc1C(C)C)c1ccccc1 ZINC000299769234 571195567 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0 FHAAMO O=C1CC[C@]2(CCC[N@H+](CCCC(F)(F)F)C2)CN1Cc1ccccn1 ZINC000072470265 571198315 /nfs/dbraw/zinc/19/83/15/571198315.db2.gz CNYNIISHTQUKSG-SFHVURJKSA-N 1 1 369.431 3.629 50 0 FHAAMO Cc1noc(C)c1CCCNC(=O)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299785138 571199122 /nfs/dbraw/zinc/19/91/22/571199122.db2.gz QKJDOVUJUCIOTO-HBMCJLEFSA-N 1 1 367.493 3.566 50 0 FHAAMO Cc1oc(-c2ccccc2Cl)nc1C[NH+]1CCC(c2nncn2C)CC1 ZINC000072479186 571199701 /nfs/dbraw/zinc/19/97/01/571199701.db2.gz RPSKOQDWTUDPMC-UHFFFAOYSA-N 1 1 371.872 3.812 50 0 FHAAMO CN1C[C@]2(CCC[N@@H+](Cc3cccc(Oc4ccccc4)c3)C2)OC1=O ZINC000072479580 571199911 /nfs/dbraw/zinc/19/99/11/571199911.db2.gz YPRYSJFQQLVCIR-NRFANRHFSA-N 1 1 352.434 3.896 50 0 FHAAMO COc1ccc(Oc2cccc(C[N@H+]3CC[C@]4(CN(C)C(=O)O4)C3)c2)cc1 ZINC000072481075 571200154 /nfs/dbraw/zinc/20/01/54/571200154.db2.gz ZWTUCLKQALSNNA-NRFANRHFSA-N 1 1 368.433 3.514 50 0 FHAAMO CC(C)C[NH+]1CCC(N2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)CC1 ZINC000097086739 571203441 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FHAAMO CC[C@@H](CO)[N@H+](Cc1cnc(-c2cccc(C)c2)nc1)Cc1ccccn1 ZINC000055401252 205218225 /nfs/dbraw/zinc/21/82/25/205218225.db2.gz OCTWRNNQKNEQRJ-NRFANRHFSA-N 1 1 362.477 3.620 50 0 FHAAMO CC[C@@H](CO)[N@@H+](Cc1cnc(-c2cccc(C)c2)nc1)Cc1ccccn1 ZINC000055401252 205218229 /nfs/dbraw/zinc/21/82/29/205218229.db2.gz OCTWRNNQKNEQRJ-NRFANRHFSA-N 1 1 362.477 3.620 50 0 FHAAMO Cc1ccccc1C[NH+]1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1 ZINC000058288925 205267939 /nfs/dbraw/zinc/26/79/39/205267939.db2.gz XTYXKQHBBHNPAC-GOSISDBHSA-N 1 1 362.477 3.924 50 0 FHAAMO C[C@@H](NC(=O)C1=CC[N@@H+](Cc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000064818065 205305685 /nfs/dbraw/zinc/30/56/85/205305685.db2.gz YARGZAVHGCOKDN-OAHLLOKOSA-N 1 1 356.416 3.974 50 0 FHAAMO O=C(C[N@@H+]1CCCC[C@H]1c1ccccn1)NCCc1cccc(Cl)c1 ZINC000065426072 205350984 /nfs/dbraw/zinc/35/09/84/205350984.db2.gz FWBPGMPMEILGTP-IBGZPJMESA-N 1 1 357.885 3.621 50 0 FHAAMO O=C(C[N@H+]1CCCC[C@H]1c1ccccn1)NCCc1cccc(Cl)c1 ZINC000065426072 205350989 /nfs/dbraw/zinc/35/09/89/205350989.db2.gz FWBPGMPMEILGTP-IBGZPJMESA-N 1 1 357.885 3.621 50 0 FHAAMO C[C@@H](C[NH2+]Cc1csc(C23CC4CC(CC(C4)C2)C3)n1)n1cncn1 ZINC000065470317 205354230 /nfs/dbraw/zinc/35/42/30/205354230.db2.gz WBKLAWPFPMQZJT-IWUURBKTSA-N 1 1 357.527 3.553 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)Nc1c(C)cnn1Cc1ccc(Cl)cc1 ZINC000065372575 205341744 /nfs/dbraw/zinc/34/17/44/205341744.db2.gz CIRHZCCLXPNCLR-UHFFFAOYSA-N 1 1 371.872 3.681 50 0 FHAAMO COc1cc(F)ccc1-c1cc([C@@H]2CC[N@@H+](Cc3nccn3C)C2)ccn1 ZINC000065405300 205347111 /nfs/dbraw/zinc/34/71/11/205347111.db2.gz AVXDTTHGAGCWOW-MRXNPFEDSA-N 1 1 366.440 3.619 50 0 FHAAMO Cc1nn(C)c(Cl)c1C[N@H+]1CC[C@@H](c2ccnc(-c3ccncc3)c2)C1 ZINC000065421033 205349268 /nfs/dbraw/zinc/34/92/68/205349268.db2.gz ICOHCAAEWDHPFK-QGZVFWFLSA-N 1 1 367.884 3.828 50 0 FHAAMO Cc1ccsc1[C@@H]1CC[N@@H+](Cc2ccc(-c3cc[nH]n3)s2)C[C@H]1O ZINC000067460152 205372302 /nfs/dbraw/zinc/37/23/02/205372302.db2.gz BJMRMVSDVRCJIP-GDBMZVCRSA-N 1 1 359.520 3.859 50 0 FHAAMO Oc1cc(-c2cccc(Cl)c2)cc2c1OCC[N@H+](CCn1ccnc1)C2 ZINC000067833984 205395731 /nfs/dbraw/zinc/39/57/31/205395731.db2.gz KZPKICRDGMASQV-UHFFFAOYSA-N 1 1 369.852 3.804 50 0 FHAAMO Oc1cc(-c2cccc(Cl)c2)cc2c1OCC[N@@H+](CCn1ccnc1)C2 ZINC000067833984 205395736 /nfs/dbraw/zinc/39/57/36/205395736.db2.gz KZPKICRDGMASQV-UHFFFAOYSA-N 1 1 369.852 3.804 50 0 FHAAMO CC[N@@H+](Cc1cccc(C(=O)Nc2ncccc2C)c1)[C@@H]1CCCC[C@H]1O ZINC000067833990 205395956 /nfs/dbraw/zinc/39/59/56/205395956.db2.gz VSDPUKYIMYTLJC-WOJBJXKFSA-N 1 1 367.493 3.768 50 0 FHAAMO COc1ccc(OC)c([C@H](C)NC(=O)C[N@H+]2CCC[C@@H]2C2CCCCC2)c1 ZINC000075358641 205573808 /nfs/dbraw/zinc/57/38/08/205573808.db2.gz ZXQDMCKJNVRGKZ-OXJNMPFZSA-N 1 1 374.525 3.926 50 0 FHAAMO Cc1ccccc1[C@@H]1CC[N@@H+](CCNc2ncnc3cc(F)ccc32)C1 ZINC000091444590 205674544 /nfs/dbraw/zinc/67/45/44/205674544.db2.gz JTPYYHLHZBVFLS-MRXNPFEDSA-N 1 1 350.441 3.979 50 0 FHAAMO c1c[nH]c([C@@H]([NH2+]CCc2nccn2Cc2ccccc2)c2ccccc2)n1 ZINC000095940779 205795263 /nfs/dbraw/zinc/79/52/63/205795263.db2.gz LXTUYRLBZZGGDT-NRFANRHFSA-N 1 1 357.461 3.576 50 0 FHAAMO COc1ccc([C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)CCn2cc[nH+]c2C)cc1 ZINC000102026018 205967929 /nfs/dbraw/zinc/96/79/29/205967929.db2.gz SYFQCIBFVQXYER-REPLKXPHSA-N 1 1 353.466 3.527 50 0 FHAAMO Cc1cccc(C(=O)NCc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000048333594 206082015 /nfs/dbraw/zinc/08/20/15/206082015.db2.gz OLPFMEGVIKVWEV-ROUUACIJSA-N 1 1 352.478 3.534 50 0 FHAAMO Cc1cccc(C(=O)NCc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000048333592 206082349 /nfs/dbraw/zinc/08/23/49/206082349.db2.gz OLPFMEGVIKVWEV-HDICACEKSA-N 1 1 352.478 3.534 50 0 FHAAMO Cc1cccc(C(=O)NCc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000048333592 206082362 /nfs/dbraw/zinc/08/23/62/206082362.db2.gz OLPFMEGVIKVWEV-HDICACEKSA-N 1 1 352.478 3.534 50 0 FHAAMO Cn1cccc1C[N@H+](Cc1ccccc1)C[C@@H](O)COCc1ccccc1 ZINC000004590998 206237363 /nfs/dbraw/zinc/23/73/63/206237363.db2.gz OCIGWSWKXJQUQQ-HSZRJFAPSA-N 1 1 364.489 3.605 50 0 FHAAMO O=C(COc1cc[nH+]c2c1CCCC2)Nc1nc(-c2ccco2)cs1 ZINC000207011667 206283816 /nfs/dbraw/zinc/28/38/16/206283816.db2.gz NJFRQUAKVGVALI-UHFFFAOYSA-N 1 1 355.419 3.694 50 0 FHAAMO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012866185 206297340 /nfs/dbraw/zinc/29/73/40/206297340.db2.gz CGDQEHABHYKPNM-AWEZNQCLSA-N 1 1 374.868 3.879 50 0 FHAAMO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012866185 206297344 /nfs/dbraw/zinc/29/73/44/206297344.db2.gz CGDQEHABHYKPNM-AWEZNQCLSA-N 1 1 374.868 3.879 50 0 FHAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029511 206313780 /nfs/dbraw/zinc/31/37/80/206313780.db2.gz GUTPUOLIWMWIQH-CYBMUJFWSA-N 1 1 360.841 3.836 50 0 FHAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029511 206313783 /nfs/dbraw/zinc/31/37/83/206313783.db2.gz GUTPUOLIWMWIQH-CYBMUJFWSA-N 1 1 360.841 3.836 50 0 FHAAMO CC[N@H+]1CCC[C@H]1CNC(=O)C[C@H](Cn1cccc1)c1ccc(Cl)cc1 ZINC000108246196 206313857 /nfs/dbraw/zinc/31/38/57/206313857.db2.gz UHJPXULDELKMGQ-QUCCMNQESA-N 1 1 373.928 3.916 50 0 FHAAMO CCN(CC)C(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019862690 206328094 /nfs/dbraw/zinc/32/80/94/206328094.db2.gz VFMPQJVAYSPQCF-UHFFFAOYSA-N 1 1 351.494 3.855 50 0 FHAAMO CCCCOc1ccc(-c2n[nH]c3c2C[N@@H+](C[C@@H]2CCOC2)CC3)cc1 ZINC000019731776 206333986 /nfs/dbraw/zinc/33/39/86/206333986.db2.gz RMNPYGOSDQYCQB-INIZCTEOSA-N 1 1 355.482 3.650 50 0 FHAAMO CC[NH+]1CCN(C(=O)c2c(C)c(-c3ccccc3)nc3ccccc32)CC1 ZINC000055080837 206340775 /nfs/dbraw/zinc/34/07/75/206340775.db2.gz VFHFVWZXNPHHEL-UHFFFAOYSA-N 1 1 359.473 3.988 50 0 FHAAMO COc1c2c(cc3c1[C@@H](c1c[nH]c4ccc(C)cc41)[N@H+](C)CC3)OCO2 ZINC000020759113 206342388 /nfs/dbraw/zinc/34/23/88/206342388.db2.gz CQYGCOBNUPWBOY-LJQANCHMSA-N 1 1 350.418 3.791 50 0 FHAAMO COc1c2c(cc3c1[C@@H](c1c[nH]c4ccc(C)cc41)[N@@H+](C)CC3)OCO2 ZINC000020759113 206342395 /nfs/dbraw/zinc/34/23/95/206342395.db2.gz CQYGCOBNUPWBOY-LJQANCHMSA-N 1 1 350.418 3.791 50 0 FHAAMO Cc1nc(C(=O)NC[C@H](c2ccc(Cl)cc2)[NH+]2CCCC2)c(C)s1 ZINC000215311867 206346666 /nfs/dbraw/zinc/34/66/66/206346666.db2.gz PKZVSWLPFYTHPT-MRXNPFEDSA-N 1 1 363.914 3.980 50 0 FHAAMO NC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC000215512344 206347378 /nfs/dbraw/zinc/34/73/78/206347378.db2.gz OWMSQITZMKIBMN-QGZVFWFLSA-N 1 1 362.832 3.680 50 0 FHAAMO NC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC000215512344 206347381 /nfs/dbraw/zinc/34/73/81/206347381.db2.gz OWMSQITZMKIBMN-QGZVFWFLSA-N 1 1 362.832 3.680 50 0 FHAAMO Cn1nc(C[NH+]2CCC(OCc3ccccn3)CC2)c2c1cccc2Cl ZINC000215734732 206349751 /nfs/dbraw/zinc/34/97/51/206349751.db2.gz YUBZLTSMMCJTEX-UHFFFAOYSA-N 1 1 370.884 3.803 50 0 FHAAMO CC[NH+]1CCN([C@@H](c2cccs2)[C@@H](C)NC(=O)c2cccc(C)c2)CC1 ZINC000022460070 206378537 /nfs/dbraw/zinc/37/85/37/206378537.db2.gz BNNOXCNTTHVEHA-YLJYHZDGSA-N 1 1 371.550 3.554 50 0 FHAAMO C[C@@H](C(=O)N1CCOc2ccc(Cl)cc2C1)[N@@H+]1CCc2ccccc2C1 ZINC000219350751 206383858 /nfs/dbraw/zinc/38/38/58/206383858.db2.gz YZNOOSLAVPZJEX-HNNXBMFYSA-N 1 1 370.880 3.508 50 0 FHAAMO C[C@@H](C(=O)N1CCOc2ccc(Cl)cc2C1)[N@H+]1CCc2ccccc2C1 ZINC000219350751 206383861 /nfs/dbraw/zinc/38/38/61/206383861.db2.gz YZNOOSLAVPZJEX-HNNXBMFYSA-N 1 1 370.880 3.508 50 0 FHAAMO Cc1nc(C)c(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)s1 ZINC000216325288 206358754 /nfs/dbraw/zinc/35/87/54/206358754.db2.gz SHUAAEMCYGZMBT-INIZCTEOSA-N 1 1 363.914 3.980 50 0 FHAAMO C[C@@H]1C[C@H](Nc2ccccc2N2CCC(O)CC2)C[N@H+]1Cc1ccccc1 ZINC000095997203 132216640 /nfs/dbraw/zinc/21/66/40/132216640.db2.gz GLCWBGLYXDCCKI-QUCCMNQESA-N 1 1 365.521 3.723 50 0 FHAAMO Cc1ccccc1N1CC[N@H+](Cc2cnc(-c3ccccn3)nc2)[C@@H](C)C1 ZINC000106974607 132240809 /nfs/dbraw/zinc/24/08/09/132240809.db2.gz JRSSKAXGJWCROG-SFHVURJKSA-N 1 1 359.477 3.558 50 0 FHAAMO Cc1ccccc1N1CC[N@@H+](Cc2cnc(-c3ccccn3)nc2)[C@@H](C)C1 ZINC000106974607 132240810 /nfs/dbraw/zinc/24/08/10/132240810.db2.gz JRSSKAXGJWCROG-SFHVURJKSA-N 1 1 359.477 3.558 50 0 FHAAMO Cc1[nH+]cn(CCNC(=O)c2cc(N3CCCCC3)ccc2Cl)c1C ZINC000220343167 132275585 /nfs/dbraw/zinc/27/55/85/132275585.db2.gz CKRUUMMFJBLLOH-UHFFFAOYSA-N 1 1 360.889 3.574 50 0 FHAAMO CC(C)CC(=O)Nc1ccc(N2CC[NH+](Cc3ccc(F)cc3)CC2)nc1 ZINC000034667861 136117679 /nfs/dbraw/zinc/11/76/79/136117679.db2.gz UQNFLJKBTYGYIM-UHFFFAOYSA-N 1 1 370.472 3.528 50 0 FHAAMO CC[C@@H]1CN(c2ccc(-c3nc(-c4ccccc4C)no3)cn2)CC[N@H+]1C ZINC000039442648 136119096 /nfs/dbraw/zinc/11/90/96/136119096.db2.gz YRSQPIRQQWVQOL-QGZVFWFLSA-N 1 1 363.465 3.637 50 0 FHAAMO OCC[C@@H]1CN(c2cc(C(F)(F)F)ccn2)CC[N@H+]1CC1CCCCC1 ZINC000072479051 136149476 /nfs/dbraw/zinc/14/94/76/136149476.db2.gz UPYXNVHJKWKWRJ-QGZVFWFLSA-N 1 1 371.447 3.554 50 0 FHAAMO CCCCCCOc1ccc(C[NH+]2CCN(c3ncccn3)CC2)cc1 ZINC000023282247 136152598 /nfs/dbraw/zinc/15/25/98/136152598.db2.gz QPCXDKRFTANMDQ-UHFFFAOYSA-N 1 1 354.498 3.758 50 0 FHAAMO COc1ccc2ccccc2c1C[NH+]1CCN(C(=O)Cc2ccccc2)CC1 ZINC000019773895 263376032 /nfs/dbraw/zinc/37/60/32/263376032.db2.gz MBGVRQKBFYMZAB-UHFFFAOYSA-N 1 1 374.484 3.735 50 0 FHAAMO CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020168273 263378338 /nfs/dbraw/zinc/37/83/38/263378338.db2.gz JSUMINOYTNFNDX-RDJZCZTQSA-N 1 1 367.320 3.922 50 0 FHAAMO CCN1CC[NH+](CCCOc2ccc(Cl)cc2Br)CC1 ZINC000020389937 521681717 /nfs/dbraw/zinc/68/17/17/521681717.db2.gz WXTWEJNFZDBKHN-UHFFFAOYSA-N 1 1 361.711 3.509 50 0 FHAAMO CC(C)=CC[N@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1c[nH]nc1-c1ccccc1)C2 ZINC000091468305 519429941 /nfs/dbraw/zinc/42/99/41/519429941.db2.gz NVWPUGARBAANNA-IEBWSBKVSA-N 1 1 364.493 3.579 50 0 FHAAMO CCOC(=O)c1c(C[N@@H+]2CC[C@H](Oc3ccccn3)C2)oc2ccccc21 ZINC000089984830 521405837 /nfs/dbraw/zinc/40/58/37/521405837.db2.gz FWMJACSDGLTVAI-HNNXBMFYSA-N 1 1 366.417 3.658 50 0 FHAAMO CCOC(=O)c1c(C[N@H+]2CC[C@H](Oc3ccccn3)C2)oc2ccccc21 ZINC000089984830 521405852 /nfs/dbraw/zinc/40/58/52/521405852.db2.gz FWMJACSDGLTVAI-HNNXBMFYSA-N 1 1 366.417 3.658 50 0 FHAAMO CCOc1ccccc1CN1CC[N@@H+](Cc2ccc(C)s2)C[C@@H]1CCO ZINC000020270824 521483555 /nfs/dbraw/zinc/48/35/55/521483555.db2.gz SNSPHNWERPDHCW-IBGZPJMESA-N 1 1 374.550 3.524 50 0 FHAAMO CCc1nccc(CN2CCC[N@@H+](Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 ZINC000216486396 522576446 /nfs/dbraw/zinc/57/64/46/522576446.db2.gz RSRCDGIGSJQYHR-OAQYLSRUSA-N 1 1 370.516 3.911 50 0 FHAAMO CCc1nccc(C[N@@H+]2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 ZINC000216486396 522576454 /nfs/dbraw/zinc/57/64/54/522576454.db2.gz RSRCDGIGSJQYHR-OAQYLSRUSA-N 1 1 370.516 3.911 50 0 FHAAMO CCc1nccc(C[N@H+]2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 ZINC000216486396 522576468 /nfs/dbraw/zinc/57/64/68/522576468.db2.gz RSRCDGIGSJQYHR-OAQYLSRUSA-N 1 1 370.516 3.911 50 0 FHAAMO CN(Cc1ccc2nsnc2c1)[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000020449901 523284437 /nfs/dbraw/zinc/28/44/37/523284437.db2.gz UNWFWMMCGJEPQU-IBGZPJMESA-N 1 1 366.534 3.830 50 0 FHAAMO C[N@H+](Cc1ccc2nsnc2c1)[C@H]1CCCN(CCc2ccccc2)C1 ZINC000020449901 523284452 /nfs/dbraw/zinc/28/44/52/523284452.db2.gz UNWFWMMCGJEPQU-IBGZPJMESA-N 1 1 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O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1cc(-c2cccs2)on1 ZINC000015859722 570846226 /nfs/dbraw/zinc/84/62/26/570846226.db2.gz WABQXEZVXWUXPD-AWEZNQCLSA-N 1 1 357.435 3.563 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000016474803 570856780 /nfs/dbraw/zinc/85/67/80/570856780.db2.gz NPNLEOZQMCXHFE-KRWDZBQOSA-N 1 1 354.498 3.746 50 0 FHAAMO CCN1CC[NH+](Cc2ccc(NC(=O)c3cccc(C)c3C)cc2)CC1 ZINC000032916033 570857682 /nfs/dbraw/zinc/85/76/82/570857682.db2.gz UJVCWBFQELGMMF-UHFFFAOYSA-N 1 1 351.494 3.693 50 0 FHAAMO Cc1ccc(CN2CCN(C3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000019361693 570887157 /nfs/dbraw/zinc/88/71/57/570887157.db2.gz WWPQTAJTFMGJBT-UHFFFAOYSA-N 1 1 363.549 3.777 50 0 FHAAMO CSC[C@@H](C)N(C)c1cc(C(C)C)nc(C[N@H+](C)[C@@H](C)CSC)n1 ZINC000107364098 570896701 /nfs/dbraw/zinc/89/67/01/570896701.db2.gz SFZDKWXQLFPNND-LSDHHAIUSA-N 1 1 370.632 3.971 50 0 FHAAMO CSC[C@@H](C)N(C)c1cc(C(C)C)nc(C[N@@H+](C)[C@@H](C)CSC)n1 ZINC000107364098 570896703 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C[C@H](C(=O)N1CC[NH+](C)CC1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12 ZINC000020624358 570922186 /nfs/dbraw/zinc/92/21/86/570922186.db2.gz GTRQTKJYOSAIOM-ZDUSSCGKSA-N 1 1 355.869 3.852 50 0 FHAAMO CC(C)N(C(=O)Cn1c(C[NH+]2CCCCC2)nc2ccccc21)C(C)C ZINC000021171095 570929044 /nfs/dbraw/zinc/92/90/44/570929044.db2.gz RIPSAFUMWUJQEZ-UHFFFAOYSA-N 1 1 356.514 3.668 50 0 FHAAMO C[NH+]1CCN(Cc2ccc(C(=O)c3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000022027936 570937782 /nfs/dbraw/zinc/93/77/82/570937782.db2.gz VOQJSIBEKQISJJ-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO O=c1c(Cl)c(Cl)cnn1C[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000048289314 570941185 /nfs/dbraw/zinc/94/11/85/570941185.db2.gz OKEHELWQJGYIHI-UHFFFAOYSA-N 1 1 356.228 3.706 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccco1 ZINC000022381192 570943333 /nfs/dbraw/zinc/94/33/33/570943333.db2.gz IZMQUPXKSBHTQU-KRWDZBQOSA-N 1 1 372.396 3.623 50 0 FHAAMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)Nc2cccc3ccccc32)C[C@H](C)O1 ZINC000022357887 570943416 /nfs/dbraw/zinc/94/34/16/570943416.db2.gz MTXMEBPNJBWLBJ-IYBDPMFKSA-N 1 1 355.482 3.849 50 0 FHAAMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)Nc2cccc3ccccc32)C[C@H](C)O1 ZINC000022357887 570943421 /nfs/dbraw/zinc/94/34/21/570943421.db2.gz MTXMEBPNJBWLBJ-IYBDPMFKSA-N 1 1 355.482 3.849 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2ccc(N(C)c3ccccc3)cc2)C[C@@H]1CCO ZINC000023374845 570962803 /nfs/dbraw/zinc/96/28/03/570962803.db2.gz MICNLUMOVGBWHU-QHCPKHFHSA-N 1 1 367.537 3.732 50 0 FHAAMO Cc1[nH+]ccn1CC(=O)Nc1c(-c2cccc(C)c2)cnn1-c1ccccc1 ZINC000023380160 570962814 /nfs/dbraw/zinc/96/28/14/570962814.db2.gz YOSMITDGOVIVFE-UHFFFAOYSA-N 1 1 371.444 3.991 50 0 FHAAMO Clc1ccc(-c2noc(CN3CC[NH+](Cc4ccccc4)CC3)n2)cc1 ZINC000023424580 570963694 /nfs/dbraw/zinc/96/36/94/570963694.db2.gz KHJAIOZFRPVFKR-UHFFFAOYSA-N 1 1 368.868 3.708 50 0 FHAAMO COc1ccccc1[C@H](CNC(=O)COc1ccc(C(C)C)cc1)[NH+](C)C ZINC000025457419 570995901 /nfs/dbraw/zinc/99/59/01/570995901.db2.gz MDSXEHMMULQFQE-FQEVSTJZSA-N 1 1 370.493 3.617 50 0 FHAAMO CC(C)C[C@@H](CNC(=O)N[C@@H](C)c1cc2ccccc2o1)[NH+]1CCOCC1 ZINC000026303965 571004232 /nfs/dbraw/zinc/00/42/32/571004232.db2.gz KIYNBCODIVZGBW-WMZOPIPTSA-N 1 1 373.497 3.540 50 0 FHAAMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2sccc2-c2ccccc2)C1 ZINC000028011657 571026301 /nfs/dbraw/zinc/02/63/01/571026301.db2.gz YLHMMXAFQXWODP-KRWDZBQOSA-N 1 1 358.507 3.502 50 0 FHAAMO O[C@@H](COc1c(Cl)cccc1Cl)C[N@@H+]1CCc2sccc2C1 ZINC000028174363 571027086 /nfs/dbraw/zinc/02/70/86/571027086.db2.gz MYTUZEJXFPTGSU-GFCCVEGCSA-N 1 1 358.290 3.853 50 0 FHAAMO O[C@@H](COc1c(Cl)cccc1Cl)C[N@H+]1CCc2sccc2C1 ZINC000028174363 571027090 /nfs/dbraw/zinc/02/70/90/571027090.db2.gz MYTUZEJXFPTGSU-GFCCVEGCSA-N 1 1 358.290 3.853 50 0 FHAAMO CC[N@@H+](C)[C@H](C(=O)NCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1 ZINC000225569688 571046230 /nfs/dbraw/zinc/04/62/30/571046230.db2.gz WBUSPIOMMDPLAH-KRWDZBQOSA-N 1 1 372.337 3.691 50 0 FHAAMO COc1ccc(C[N@@H+](C)Cc2cc(=O)oc3ccc(C)cc23)cc1OC ZINC000033018664 571061217 /nfs/dbraw/zinc/06/12/17/571061217.db2.gz QAATZGSJJJXQAF-UHFFFAOYSA-N 1 1 353.418 3.751 50 0 FHAAMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(=O)oc2ccc(OC)cc12 ZINC000033018733 571061280 /nfs/dbraw/zinc/06/12/80/571061280.db2.gz HCLQSNXGPOSEIL-UHFFFAOYSA-N 1 1 353.418 3.832 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)Nc1cc(-c2ccccc2)ns1)c1ccco1 ZINC000072309658 571069705 /nfs/dbraw/zinc/06/97/05/571069705.db2.gz DPVUACPFMANBEW-OAHLLOKOSA-N 1 1 356.451 3.828 50 0 FHAAMO CCOc1cc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)ccc1OC ZINC000019805711 571070534 /nfs/dbraw/zinc/07/05/34/571070534.db2.gz CBKWQKYYWFKNFT-JXMROGBWSA-N 1 1 366.505 3.925 50 0 FHAAMO COC(=O)c1ccc(CN2CC[N@H+]3CCC[C@@H]3[C@@H]2C2CCCCC2)cc1 ZINC000022078134 571071388 /nfs/dbraw/zinc/07/13/88/571071388.db2.gz MUUBGNGAEVGIIP-RTWAWAEBSA-N 1 1 356.510 3.702 50 0 FHAAMO COc1cc(CN2CC[N@H+]3CCC[C@H]3[C@H]2C2CCCCC2)cc2c1OCO2 ZINC000247889071 571075023 /nfs/dbraw/zinc/07/50/23/571075023.db2.gz MAZLTZVQVGVUSI-GHTZIAJQSA-N 1 1 372.509 3.653 50 0 FHAAMO FC(F)(F)c1cccc(C[NH+]2CCC(CCN3CCOCC3)CC2)c1 ZINC000060242056 571076252 /nfs/dbraw/zinc/07/62/52/571076252.db2.gz QITVNKVYSPGMNY-UHFFFAOYSA-N 1 1 356.432 3.640 50 0 FHAAMO Cn1c2ccccc2[nH+]c1NC[C@@H](c1ccccc1Cl)N1CCOCC1 ZINC000084314087 571081793 /nfs/dbraw/zinc/08/17/93/571081793.db2.gz RJCWHOOBPJHSAW-IBGZPJMESA-N 1 1 370.884 3.712 50 0 FHAAMO O=C(Cc1c(F)cccc1Cl)NC[C@H](c1ccsc1)[NH+]1CCC1 ZINC000225594070 571094051 /nfs/dbraw/zinc/09/40/51/571094051.db2.gz IGXUFTSORDMQHW-MRXNPFEDSA-N 1 1 352.862 3.646 50 0 FHAAMO CCN(CC(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C)c1ccccc1 ZINC000070004334 571107567 /nfs/dbraw/zinc/10/75/67/571107567.db2.gz AWSIIJSYLNXIAS-IBGZPJMESA-N 1 1 359.901 3.585 50 0 FHAAMO C[N@@H+](CC(=O)[O-])[C@H]1CCC[NH+](CCCc2cccc3ccccc32)CC1 ZINC000241776812 571110216 /nfs/dbraw/zinc/11/02/16/571110216.db2.gz RSVJPJLSNVIJPD-FQEVSTJZSA-N 1 1 354.494 3.643 50 0 FHAAMO C[NH+](CC(=O)[O-])[C@H]1CCC[N@H+](CCCc2cccc3ccccc32)CC1 ZINC000241776812 571110219 /nfs/dbraw/zinc/11/02/19/571110219.db2.gz RSVJPJLSNVIJPD-FQEVSTJZSA-N 1 1 354.494 3.643 50 0 FHAAMO C[NH+](CC(=O)[O-])[C@H]1CCC[N@@H+](CCCc2cccc3ccccc32)CC1 ZINC000241776812 571110221 /nfs/dbraw/zinc/11/02/21/571110221.db2.gz RSVJPJLSNVIJPD-FQEVSTJZSA-N 1 1 354.494 3.643 50 0 FHAAMO Cc1nc(C)c(C(=O)NC[C@H](c2ccc(F)cc2)[NH+]2CCCCC2)s1 ZINC000243932659 571112928 /nfs/dbraw/zinc/11/29/28/571112928.db2.gz BXKZKLTXYXHDMB-QGZVFWFLSA-N 1 1 361.486 3.856 50 0 FHAAMO Cc1ncsc1CCN(C)C(=O)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000244718776 571115317 /nfs/dbraw/zinc/11/53/17/571115317.db2.gz LQOKSSYJYRJVQQ-SFHVURJKSA-N 1 1 357.523 3.507 50 0 FHAAMO CC(=O)Nc1ccccc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC000244794665 571116627 /nfs/dbraw/zinc/11/66/27/571116627.db2.gz QREYYWCVRXKBOQ-OAHLLOKOSA-N 1 1 371.868 3.726 50 0 FHAAMO CC(=O)Nc1ccccc1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC000244794665 571116630 /nfs/dbraw/zinc/11/66/30/571116630.db2.gz QREYYWCVRXKBOQ-OAHLLOKOSA-N 1 1 371.868 3.726 50 0 FHAAMO Cc1cc(C)c(C[N@H+](Cc2ccccn2)C[C@H]2CCCO2)c(C)c1CO ZINC000055153821 571117047 /nfs/dbraw/zinc/11/70/47/571117047.db2.gz IOYWPOYGLYUHIP-HXUWFJFHSA-N 1 1 354.494 3.680 50 0 FHAAMO Cc1cc(C(F)(F)F)cc(N[C@@H](Cc2ccccn2)[C@H]2C[C@H](O)C2)[nH+]1 ZINC000244866535 571118220 /nfs/dbraw/zinc/11/82/20/571118220.db2.gz VXUYYHYMOSRIBN-RCBQFDQVSA-N 1 1 351.372 3.598 50 0 FHAAMO Cc1ccc(NC(=O)CC[N@@H+]2CCC[C@H](c3nccn3C)C2)cc1Cl ZINC000244882425 571118758 /nfs/dbraw/zinc/11/87/58/571118758.db2.gz XRMATJQYSZMNRT-HNNXBMFYSA-N 1 1 360.889 3.590 50 0 FHAAMO COc1cccc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3F)C2)c1OC ZINC000244899822 571120076 /nfs/dbraw/zinc/12/00/76/571120076.db2.gz ZRBNZPXVXFQHBV-OAHLLOKOSA-N 1 1 372.440 3.661 50 0 FHAAMO COCC(=O)Nc1ccc(Nc2cc(C)[nH+]c(NC3CCCCC3)n2)cc1 ZINC000042384896 571122046 /nfs/dbraw/zinc/12/20/46/571122046.db2.gz FJHLWORDXCASDY-UHFFFAOYSA-N 1 1 369.469 3.858 50 0 FHAAMO CCCCNC(=O)C1CC[NH+](Cc2nc3ccccc3n2C(C)C)CC1 ZINC000248180985 571128198 /nfs/dbraw/zinc/12/81/98/571128198.db2.gz YODMRMQWOGJNMI-UHFFFAOYSA-N 1 1 356.514 3.746 50 0 FHAAMO O=C(c1n[nH]cc1Cl)N1CCC[C@@]2(CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000252480442 571131360 /nfs/dbraw/zinc/13/13/60/571131360.db2.gz CAEVQEIXJXVOJF-HXUWFJFHSA-N 1 1 372.900 3.582 50 0 FHAAMO O=C(c1[nH]ncc1Cl)N1CCC[C@@]2(CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000252480442 571131363 /nfs/dbraw/zinc/13/13/63/571131363.db2.gz CAEVQEIXJXVOJF-HXUWFJFHSA-N 1 1 372.900 3.582 50 0 FHAAMO O=C(c1[nH]ncc1Cl)N1CCC[C@@]2(CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000252480442 571131365 /nfs/dbraw/zinc/13/13/65/571131365.db2.gz CAEVQEIXJXVOJF-HXUWFJFHSA-N 1 1 372.900 3.582 50 0 FHAAMO Cc1ccc(C[N@H+](CCN2CCN(Cc3ccccc3)CC2)C2CC2)s1 ZINC000252482267 571131916 /nfs/dbraw/zinc/13/19/16/571131916.db2.gz DBWZXOAHPHOXLR-UHFFFAOYSA-N 1 1 369.578 3.839 50 0 FHAAMO Cc1ccc(C[N@@H+](CCN2CCN(Cc3ccccc3)CC2)C2CC2)s1 ZINC000252482267 571131918 /nfs/dbraw/zinc/13/19/18/571131918.db2.gz DBWZXOAHPHOXLR-UHFFFAOYSA-N 1 1 369.578 3.839 50 0 FHAAMO C[C@@H]1c2cccn2CC[N@H+]1C[C@H](O)COc1ccc(-c2ccccc2)cc1 ZINC000035267006 571138571 /nfs/dbraw/zinc/13/85/71/571138571.db2.gz ASWMBYQABRPGKY-NQIIRXRSSA-N 1 1 362.473 3.972 50 0 FHAAMO C[C@@H]1c2cccn2CC[N@@H+]1C[C@H](O)COc1ccc(-c2ccccc2)cc1 ZINC000035267006 571138573 /nfs/dbraw/zinc/13/85/73/571138573.db2.gz ASWMBYQABRPGKY-NQIIRXRSSA-N 1 1 362.473 3.972 50 0 FHAAMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2C(C)C)cc1OC ZINC000012926346 571145971 /nfs/dbraw/zinc/14/59/71/571145971.db2.gz YQJZIUABXLRYRG-GOSISDBHSA-N 1 1 373.493 3.699 50 0 FHAAMO C[N@@H+]1CCOc2c(O)cc(-c3ncc(C(F)(F)F)cc3Cl)cc2C1 ZINC000067881495 571151111 /nfs/dbraw/zinc/15/11/11/571151111.db2.gz ZDMJLFJLKTZDGD-UHFFFAOYSA-N 1 1 358.747 3.951 50 0 FHAAMO C[N@H+]1CCOc2c(O)cc(-c3ncc(C(F)(F)F)cc3Cl)cc2C1 ZINC000067881495 571151112 /nfs/dbraw/zinc/15/11/12/571151112.db2.gz ZDMJLFJLKTZDGD-UHFFFAOYSA-N 1 1 358.747 3.951 50 0 FHAAMO Cc1oc(-c2cccc(C(F)(F)F)c2)nc1CN1CCC[N@H+](C)CC1 ZINC000067886682 571151155 /nfs/dbraw/zinc/15/11/55/571151155.db2.gz LXXUBZHOSPSILC-UHFFFAOYSA-N 1 1 353.388 3.806 50 0 FHAAMO CCc1ccccc1C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccco3)C2)C1 ZINC000067921621 571151824 /nfs/dbraw/zinc/15/18/24/571151824.db2.gz CSPZGJVNLVUSLY-QFIPXVFZSA-N 1 1 352.478 3.970 50 0 FHAAMO COc1ccc2cc([C@H]3C[N@H+](CCCn4cccn4)CCO3)ccc2c1 ZINC000071422362 571161292 /nfs/dbraw/zinc/16/12/92/571161292.db2.gz WBTVEPVXXKJDQM-OAQYLSRUSA-N 1 1 351.450 3.509 50 0 FHAAMO COc1ccc2cc([C@H]3C[N@@H+](CCCn4cccn4)CCO3)ccc2c1 ZINC000071422362 571161293 /nfs/dbraw/zinc/16/12/93/571161293.db2.gz WBTVEPVXXKJDQM-OAQYLSRUSA-N 1 1 351.450 3.509 50 0 FHAAMO CC(=O)NCC[N@@H+]1CCC[C@@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 ZINC000071439643 571161627 /nfs/dbraw/zinc/16/16/27/571161627.db2.gz GSKUDWPBAKWROH-LJQANCHMSA-N 1 1 366.461 3.510 50 0 FHAAMO CC(=O)NCC[N@H+]1CCC[C@@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 ZINC000071439643 571161629 /nfs/dbraw/zinc/16/16/29/571161629.db2.gz GSKUDWPBAKWROH-LJQANCHMSA-N 1 1 366.461 3.510 50 0 FHAAMO CC(C)(C[N@H+]1CCC[C@@H](CCc2ccc(F)c(F)c2)C1)N1CCOCC1 ZINC000071439749 571161787 /nfs/dbraw/zinc/16/17/87/571161787.db2.gz ZGJYJMDZZKLFMC-SFHVURJKSA-N 1 1 366.496 3.720 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2ccc(F)cn2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071613825 571162888 /nfs/dbraw/zinc/16/28/88/571162888.db2.gz XWKHWTKVRMJWBM-HXUWFJFHSA-N 1 1 373.447 3.733 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H](C(=O)c2ccc(-c3ccccc3)cc2)C1)NC1CC1 ZINC000071681720 571163182 /nfs/dbraw/zinc/16/31/82/571163182.db2.gz NAPWHLRMGCNNEC-FQEVSTJZSA-N 1 1 362.473 3.527 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H](C(=O)c2ccc(-c3ccccc3)cc2)C1)NC1CC1 ZINC000071681720 571163184 /nfs/dbraw/zinc/16/31/84/571163184.db2.gz NAPWHLRMGCNNEC-FQEVSTJZSA-N 1 1 362.473 3.527 50 0 FHAAMO CC(C)[C@@H]1CN(Cc2cc(-c3cccnc3)no2)CCC[N@H+]1CC1CC1 ZINC000071662283 571163239 /nfs/dbraw/zinc/16/32/39/571163239.db2.gz XSYNZDIGWJWXMF-NRFANRHFSA-N 1 1 354.498 3.679 50 0 FHAAMO Cc1ccccc1Cn1nc(C[NH2+]Cc2ccncc2)c(-c2ccccc2)n1 ZINC000261492461 571164481 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KWMNYLOWPPIJSG-UHFFFAOYSA-N 1 1 364.401 3.901 50 0 FHAAMO CC[N@H+]1CCC[C@@H](NC(=O)c2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000040157632 208240147 /nfs/dbraw/zinc/24/01/47/208240147.db2.gz HBOWMRUGUMLAJO-LJQANCHMSA-N 1 1 356.441 3.619 50 0 FHAAMO CC[N@@H+]1CCC[C@@H]1CNCc1ccc(OC(C)C)c(Br)c1 ZINC000040719694 208263484 /nfs/dbraw/zinc/26/34/84/208263484.db2.gz AHBHUUCHYVQFBR-OAHLLOKOSA-N 1 1 355.320 3.810 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNCc1ccc(OC(C)C)c(Br)c1 ZINC000040719694 208263489 /nfs/dbraw/zinc/26/34/89/208263489.db2.gz AHBHUUCHYVQFBR-OAHLLOKOSA-N 1 1 355.320 3.810 50 0 FHAAMO CCOC(=O)CCCCCC(=O)c1cccc(C[NH+]2CCSCC2)c1 ZINC000043211353 208302535 /nfs/dbraw/zinc/30/25/35/208302535.db2.gz SUCBSSMVKPZQHH-UHFFFAOYSA-N 1 1 363.523 3.932 50 0 FHAAMO Cc1ncc(C[N@H+](C)C[C@H](O)COc2ccc(-c3ccccc3)cc2)s1 ZINC000047258864 208375950 /nfs/dbraw/zinc/37/59/50/208375950.db2.gz IVANZPSFCZQAGB-IBGZPJMESA-N 1 1 368.502 3.990 50 0 FHAAMO Cc1ncc(C[N@@H+](C)C[C@H](O)COc2ccc(-c3ccccc3)cc2)s1 ZINC000047258864 208375956 /nfs/dbraw/zinc/37/59/56/208375956.db2.gz IVANZPSFCZQAGB-IBGZPJMESA-N 1 1 368.502 3.990 50 0 FHAAMO COc1ccc(F)c(C[NH+]2CCC(n3cc(C4CC4)nn3)CC2)c1Cl ZINC000055358187 208476400 /nfs/dbraw/zinc/47/64/00/208476400.db2.gz NVUHBUYNYBTDKQ-UHFFFAOYSA-N 1 1 364.852 3.794 50 0 FHAAMO Cc1c(-c2n[nH]c3c2C[N@@H+](C[C@H]2CCOC2)CC3)cccc1C(F)(F)F ZINC000020858706 220342639 /nfs/dbraw/zinc/34/26/39/220342639.db2.gz XQFGTEVTAVKQDV-CYBMUJFWSA-N 1 1 365.399 3.799 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)N1CCC[C@]2(C=Cc3ccccc3O2)CC1 ZINC000065525938 208686672 /nfs/dbraw/zinc/68/66/72/208686672.db2.gz PYIYXTQDDMZXOX-QFIPXVFZSA-N 1 1 365.477 3.693 50 0 FHAAMO COc1ccc(C(=O)N2CC[NH+](CC[C@H](C)c3ccc(C)o3)CC2)cc1 ZINC000072130762 208805068 /nfs/dbraw/zinc/80/50/68/208805068.db2.gz JENFABSATVZTPA-INIZCTEOSA-N 1 1 356.466 3.548 50 0 FHAAMO O=c1cc(CN2CCC[N@H+](C3CCCCC3)CC2)[nH]c2c(F)cccc12 ZINC000091876793 209002612 /nfs/dbraw/zinc/00/26/12/209002612.db2.gz FPKQPLGALHSCID-UHFFFAOYSA-N 1 1 357.473 3.920 50 0 FHAAMO OCc1ccc(C[C@@H]2CC[N@@H+](Cc3c[nH]nc3-c3ccc(F)cc3)C2)cc1 ZINC000091966137 209006813 /nfs/dbraw/zinc/00/68/13/209006813.db2.gz YDDZBARJRLBLRK-SFHVURJKSA-N 1 1 365.452 3.773 50 0 FHAAMO Fc1ccc(C[N@H+]2CCCN(c3ccc(Br)cn3)CC2)cc1 ZINC000095960772 209091704 /nfs/dbraw/zinc/09/17/04/209091704.db2.gz HSCKMBKKQKLIAD-UHFFFAOYSA-N 1 1 364.262 3.696 50 0 FHAAMO c1[nH]nc(-c2ccccc2)c1CN1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccncc1)C2 ZINC000092004350 209011488 /nfs/dbraw/zinc/01/14/88/209011488.db2.gz GNTBITSSYFEIBE-SIKLNZKXSA-N 1 1 373.504 3.568 50 0 FHAAMO COCC[N@@H+](Cc1cc(=O)c2cccc(F)c2[nH]1)Cc1ccccc1C ZINC000092096465 209016626 /nfs/dbraw/zinc/01/66/26/209016626.db2.gz KZHNPGODIYWECT-UHFFFAOYSA-N 1 1 354.425 3.624 50 0 FHAAMO O=C(c1ccnc2ccccc21)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000092097171 209017049 /nfs/dbraw/zinc/01/70/49/209017049.db2.gz JMJDGQGXOFZVOE-VQTJNVASSA-N 1 1 371.484 3.971 50 0 FHAAMO Clc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CN(Cc2cscn2)C3)s1 ZINC000095353664 209024043 /nfs/dbraw/zinc/02/40/43/209024043.db2.gz XIPFFTYXIJGIOW-GXTWGEPZSA-N 1 1 353.944 3.954 50 0 FHAAMO Clc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2cscn2)C3)s1 ZINC000095353664 209024048 /nfs/dbraw/zinc/02/40/48/209024048.db2.gz XIPFFTYXIJGIOW-GXTWGEPZSA-N 1 1 353.944 3.954 50 0 FHAAMO Cc1nc2ncccc2c(N[C@H]2CCC[N@@H+](Cc3ccccc3F)C2)n1 ZINC000095354887 209024234 /nfs/dbraw/zinc/02/42/34/209024234.db2.gz CTJJLICSMYVKOH-INIZCTEOSA-N 1 1 351.429 3.549 50 0 FHAAMO CN(Cc1cccc2ncccc12)C(=O)[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000095354927 209024430 /nfs/dbraw/zinc/02/44/30/209024430.db2.gz KEEJDMQLGLVRFW-HXUWFJFHSA-N 1 1 351.425 3.635 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCCC[C@H]1CCc1ccc(O)cc1 ZINC000095354627 209025291 /nfs/dbraw/zinc/02/52/91/209025291.db2.gz XUWBTCKWDBKNAU-IBGZPJMESA-N 1 1 355.482 3.691 50 0 FHAAMO Cc1nc2ccccn2c1CN1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccccc2)C1 ZINC000095361098 209027185 /nfs/dbraw/zinc/02/71/85/209027185.db2.gz LTTVHFSGVYFBHP-LEWJYISDSA-N 1 1 360.505 3.739 50 0 FHAAMO CN(Cc1ccc2ncccc2c1)C(=O)[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000095359450 209027323 /nfs/dbraw/zinc/02/73/23/209027323.db2.gz HQZOWGQJLBXDEE-HXUWFJFHSA-N 1 1 351.425 3.635 50 0 FHAAMO CCCCSc1nc(N)cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000095360066 209027700 /nfs/dbraw/zinc/02/77/00/209027700.db2.gz XGOQUIFPXLRRIW-INIZCTEOSA-N 1 1 357.527 3.637 50 0 FHAAMO Cc1nn(-c2ccc(F)cc2)c(C)c1CNC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000095363450 209029518 /nfs/dbraw/zinc/02/95/18/209029518.db2.gz PXHYIVBBKKGXOI-GOSISDBHSA-N 1 1 372.488 3.509 50 0 FHAAMO C[NH+](C)[C@@H](C(=O)NCCc1ccccc1C(F)(F)F)c1ccc(F)cc1 ZINC000095387523 209043706 /nfs/dbraw/zinc/04/37/06/209043706.db2.gz XFOGSJOQAQTHHC-QGZVFWFLSA-N 1 1 368.374 3.806 50 0 FHAAMO Cn1ccc2ccc(C[N@H+]3C[C@H]4CC[C@@H]3CN(Cc3cccnc3)C4)cc21 ZINC000095371972 209034700 /nfs/dbraw/zinc/03/47/00/209034700.db2.gz HSPQUFKAJOHGPB-RBBKRZOGSA-N 1 1 360.505 3.670 50 0 FHAAMO CC(C)n1ccnc1[C@H]1CCC[N@H+](CC(=O)NC2CCCCCCC2)C1 ZINC000095375909 209036927 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CCCC(=O)OC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(C)cc1 ZINC000036101773 208147297 /nfs/dbraw/zinc/14/72/97/208147297.db2.gz NKLPNBMDCKCXHD-OAQYLSRUSA-N 1 1 355.478 3.701 50 0 FHAAMO Cc1ccccc1C[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)COC(C)C ZINC000036104605 208147428 /nfs/dbraw/zinc/14/74/28/208147428.db2.gz KZPJPALHQQPRKX-HXUWFJFHSA-N 1 1 371.477 3.512 50 0 FHAAMO COc1ccccc1C[N@@H+](CCC(C)C)C[C@H](O)COc1ccccc1 ZINC000036096203 208147618 /nfs/dbraw/zinc/14/76/18/208147618.db2.gz WONQCICTHQFCOF-FQEVSTJZSA-N 1 1 357.494 3.983 50 0 FHAAMO CCC[C@@H](O)C[N@H+](Cc1cccc(F)c1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145903 208148885 /nfs/dbraw/zinc/14/88/85/208148885.db2.gz BXZTWFPRDKOTPY-RTWAWAEBSA-N 1 1 370.468 3.982 50 0 FHAAMO O=C1NC2(CCCCCC2)C(=O)N1C[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000040155483 208238035 /nfs/dbraw/zinc/23/80/35/208238035.db2.gz ZJBZBTAOHZQNQX-LJQANCHMSA-N 1 1 367.493 3.741 50 0 FHAAMO O=C1NC2(CCCCCC2)C(=O)N1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000040155483 208238042 /nfs/dbraw/zinc/23/80/42/208238042.db2.gz ZJBZBTAOHZQNQX-LJQANCHMSA-N 1 1 367.493 3.741 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cccc3c[nH]nc32)cc1 ZINC000048252258 208393650 /nfs/dbraw/zinc/39/36/50/208393650.db2.gz CYTFFFZYZJFQCB-MRXNPFEDSA-N 1 1 362.477 3.867 50 0 FHAAMO COc1cccc(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)c1 ZINC000019773942 220295400 /nfs/dbraw/zinc/29/54/00/220295400.db2.gz UDWZADLRFNBUQK-UHFFFAOYSA-N 1 1 360.457 3.806 50 0 FHAAMO O=C(c1cccnc1)N1C[C@H]2CC[C@H](C[N@H+]2Cc2ccc(Cl)s2)C1 ZINC000091849382 209001044 /nfs/dbraw/zinc/00/10/44/209001044.db2.gz BZWIYFOTYMLHNO-UKRRQHHQSA-N 1 1 361.898 3.533 50 0 FHAAMO O=C(c1cccnc1)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccc(Cl)s2)C1 ZINC000091849382 209001045 /nfs/dbraw/zinc/00/10/45/209001045.db2.gz BZWIYFOTYMLHNO-UKRRQHHQSA-N 1 1 361.898 3.533 50 0 FHAAMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1ccc2nccn2c1 ZINC000091876739 209002097 /nfs/dbraw/zinc/00/20/97/209002097.db2.gz FNPYBDCYRLENAM-SFHVURJKSA-N 1 1 368.868 3.555 50 0 FHAAMO FC(F)(F)c1csc(NCc2cccc(C[NH+]3CCOCC3)c2)n1 ZINC000095966334 209092033 /nfs/dbraw/zinc/09/20/33/209092033.db2.gz ZYUCCJGPQOILLE-UHFFFAOYSA-N 1 1 357.401 3.606 50 0 FHAAMO CC[C@H](Oc1ccccc1F)C(=O)Nc1ccc(-n2cc[nH+]c2C)nc1 ZINC000095963530 209091875 /nfs/dbraw/zinc/09/18/75/209091875.db2.gz FUJJHRLQXJAYNG-INIZCTEOSA-N 1 1 354.385 3.511 50 0 FHAAMO Cc1cccc(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](C)C3)n1 ZINC000095353947 209025126 /nfs/dbraw/zinc/02/51/26/209025126.db2.gz LGXKUUODEOIELF-FQEVSTJZSA-N 1 1 363.505 3.732 50 0 FHAAMO O=C(C1CCCC1)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000095354813 209025198 /nfs/dbraw/zinc/02/51/98/209025198.db2.gz YRWFSAARPWLTIV-PWIZWCRZSA-N 1 1 360.448 3.544 50 0 FHAAMO Cc1noc2nc(C)nc(NCC[N@H+]3CCC[C@@H](c4ccccc4)C3)c12 ZINC000095357536 209026912 /nfs/dbraw/zinc/02/69/12/209026912.db2.gz UKGDALNVNTYMQR-QGZVFWFLSA-N 1 1 351.454 3.526 50 0 FHAAMO CC[C@@H](CNC(=O)c1ccc2nc(-c3ccc(F)cc3)cn2c1)[N@@H+](C)CC ZINC000095361612 209028844 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3.797 50 0 FHAAMO COc1ccc2[nH]cc(C3=CC[N@H+]([C@H]4CCCN(C(C)C)C4=O)CC3)c2c1 ZINC000095407279 209049187 /nfs/dbraw/zinc/04/91/87/209049187.db2.gz SXRZZYYDSKHJHD-NRFANRHFSA-N 1 1 367.493 3.665 50 0 FHAAMO C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)[C@H](C)[NH+]1CCSCC1 ZINC000095432685 209049509 /nfs/dbraw/zinc/04/95/09/209049509.db2.gz BZMTWOWTOCQKOF-NEPJUHHUSA-N 1 1 361.338 3.950 50 0 FHAAMO c1cnn(-c2cccc(C[N@H+]3CCC[C@H]3c3cccc4c3OCCO4)c2)c1 ZINC000095455416 209052320 /nfs/dbraw/zinc/05/23/20/209052320.db2.gz PCXXQYORDNEAJO-FQEVSTJZSA-N 1 1 361.445 3.981 50 0 FHAAMO CC(C)(C)NC(=O)NCC[N@H+]1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000095452740 209052451 /nfs/dbraw/zinc/05/24/51/209052451.db2.gz XGOVBSKESWZFHM-OAHLLOKOSA-N 1 1 367.921 3.529 50 0 FHAAMO CCC[C@@H]1CN(C(=O)c2ccc(Cl)nc2)CC[N@H+]1Cc1ccccc1 ZINC000095463175 209053380 /nfs/dbraw/zinc/05/33/80/209053380.db2.gz FVRXMESLSUEWDB-GOSISDBHSA-N 1 1 357.885 3.862 50 0 FHAAMO C[N@@H+](Cc1ccc(Cl)nc1)C1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000095459846 209053809 /nfs/dbraw/zinc/05/38/09/209053809.db2.gz QEVSXEJWTSUAPM-UHFFFAOYSA-N 1 1 365.308 3.880 50 0 FHAAMO C[C@H](NC(=O)c1ccc(-n2cccn2)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000095466110 209055389 /nfs/dbraw/zinc/05/53/89/209055389.db2.gz JJQZNWCHTXZVPX-GHTZIAJQSA-N 1 1 374.488 3.513 50 0 FHAAMO C[C@@H](NC(=O)c1ccc(-n2cccn2)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000095466113 209055399 /nfs/dbraw/zinc/05/53/99/209055399.db2.gz JJQZNWCHTXZVPX-NQIIRXRSSA-N 1 1 374.488 3.513 50 0 FHAAMO O=C(Nc1ccc2c(c1)CCC2=O)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000095497994 209059388 /nfs/dbraw/zinc/05/93/88/209059388.db2.gz JZQZNRNMLSYEQE-UHFFFAOYSA-N 1 1 369.490 3.617 50 0 FHAAMO Cc1ccc2[nH]c(CCCNC(=O)[C@@H](C)n3cc[nH+]c3C(C)C)nc2c1C ZINC000095498407 209060891 /nfs/dbraw/zinc/06/08/91/209060891.db2.gz PPESEKVSYJKSSD-MRXNPFEDSA-N 1 1 367.497 3.810 50 0 FHAAMO Cn1ccc2ccc(C(=O)NC[C@H](c3cccnc3)[NH+]3CCCCC3)cc21 ZINC000095500462 209061133 /nfs/dbraw/zinc/06/11/33/209061133.db2.gz HPBMKSSPQOHFNJ-OAQYLSRUSA-N 1 1 362.477 3.530 50 0 FHAAMO Cc1noc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](C2CC2)C3)n1 ZINC000095500286 209062131 /nfs/dbraw/zinc/06/21/31/209062131.db2.gz MFJWWAHZJBDFBL-IBGZPJMESA-N 1 1 366.509 3.612 50 0 FHAAMO C[C@H](NC(=O)CC[N@H+]1CCc2nc(-c3ccccc3)[nH]c2C1)c1ccccc1 ZINC000095500842 209062235 /nfs/dbraw/zinc/06/22/35/209062235.db2.gz UPXOHVBYPPGOHV-KRWDZBQOSA-N 1 1 374.488 3.702 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)N1CCCC[C@H]1CCc1ccc(O)cc1 ZINC000055404154 221069862 /nfs/dbraw/zinc/06/98/62/221069862.db2.gz ZSHLUHJOHZSSIS-SFHVURJKSA-N 1 1 355.482 3.555 50 0 FHAAMO C[N@@H+](CCCNc1cnn(C(C)(C)C)c(=O)c1Cl)Cc1ccccc1 ZINC000070038057 221331928 /nfs/dbraw/zinc/33/19/28/221331928.db2.gz TXCRDRBEESMRNY-UHFFFAOYSA-N 1 1 362.905 3.586 50 0 FHAAMO CC(=O)c1cccc(-c2ccc(NC(=O)N(C)[C@@H]3CC[N@@H+](C)C3)cc2)c1 ZINC000095505694 209065291 /nfs/dbraw/zinc/06/52/91/209065291.db2.gz VLEDBACPIFDNND-HXUWFJFHSA-N 1 1 351.450 3.724 50 0 FHAAMO CC(=O)c1cccc(-c2ccc(NC(=O)N(C)[C@H]3CC[N@@H+](C)C3)cc2)c1 ZINC000095505695 209065211 /nfs/dbraw/zinc/06/52/11/209065211.db2.gz VLEDBACPIFDNND-FQEVSTJZSA-N 1 1 351.450 3.724 50 0 FHAAMO O=C(c1ccccc1)[C@@H]1CCC[N@H+]([C@@H]2CCN(c3ccc(F)cc3)C2)C1 ZINC000095508973 209066770 /nfs/dbraw/zinc/06/67/70/209066770.db2.gz KNMIBDHVTIJEQG-WIYYLYMNSA-N 1 1 352.453 3.999 50 0 FHAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)c1cc[nH]c1C ZINC000095510680 209069134 /nfs/dbraw/zinc/06/91/34/209069134.db2.gz IQOZNDDYJZAOGL-LJQANCHMSA-N 1 1 371.500 3.879 50 0 FHAAMO Clc1ccc(N2CCC[C@@H](c3[nH+]ccn3Cc3ccncc3)C2)nc1 ZINC000092080789 132206020 /nfs/dbraw/zinc/20/60/20/132206020.db2.gz ZHZVDQNGCDQYBN-MRXNPFEDSA-N 1 1 353.857 3.759 50 0 FHAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(c3cc(C)ncn3)CC2)C1 ZINC000092078083 132206107 /nfs/dbraw/zinc/20/61/07/132206107.db2.gz BMGIBFMPTBNGRV-FQEVSTJZSA-N 1 1 350.510 3.881 50 0 FHAAMO Clc1cccnc1N1CCC[C@H](c2[nH+]ccn2Cc2ccccn2)C1 ZINC000095519429 132214068 /nfs/dbraw/zinc/21/40/68/132214068.db2.gz PQGHIWFYCZXSBP-HNNXBMFYSA-N 1 1 353.857 3.759 50 0 FHAAMO O[C@H](C[NH+]1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000058391930 136131767 /nfs/dbraw/zinc/13/17/67/136131767.db2.gz SZSIYCHMFQTILX-GOSISDBHSA-N 1 1 350.384 3.561 50 0 FHAAMO FC(F)(F)c1cccc(N2CCN([C@@H]3CCC[N@H+](C4CCC4)C3)CC2)c1 ZINC000019228660 136152278 /nfs/dbraw/zinc/15/22/78/136152278.db2.gz HUGVFEVVZWKKPX-LJQANCHMSA-N 1 1 367.459 3.844 50 0 FHAAMO COc1cccc(-c2cc(CNC(=O)[C@H](C)n3cc[nH+]c3C(C)C)no2)c1 ZINC000095525524 209076116 /nfs/dbraw/zinc/07/61/16/209076116.db2.gz UNMKKWJDLNTGAP-AWEZNQCLSA-N 1 1 368.437 3.548 50 0 FHAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)C1CC=CC1 ZINC000095525092 209075690 /nfs/dbraw/zinc/07/56/90/209075690.db2.gz OASDGSHHHQHLAH-LJQANCHMSA-N 1 1 358.501 3.895 50 0 FHAAMO Cc1ccc([C@@H]2C[N@H+](Cc3ccc(Cn4cccn4)cc3)C[C@H]2N(C)C)cc1 ZINC000095528062 209077640 /nfs/dbraw/zinc/07/76/40/209077640.db2.gz PMAXVCVOILOKEF-BJKOFHAPSA-N 1 1 374.532 3.769 50 0 FHAAMO Cc1ccc([C@@H]2CN(Cc3ccc(Cn4cccn4)cc3)C[C@H]2[NH+](C)C)cc1 ZINC000095528062 209077642 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CCc1ccc([C@H](CNS(=O)(=O)c2ccc(Cl)s2)[NH+](C)C)cc1 ZINC000016088157 570849950 /nfs/dbraw/zinc/84/99/50/570849950.db2.gz VCKHRWXSKNWLES-AWEZNQCLSA-N 1 1 372.943 3.545 50 0 FHAAMO CC(C)[C@@H](NC(=O)C[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000016338658 570854803 /nfs/dbraw/zinc/85/48/03/570854803.db2.gz KQZOXWFPCZBAEO-HRAATJIYSA-N 1 1 360.498 3.536 50 0 FHAAMO CCCc1nn(-c2ccccc2)c(C(C)C)c1C(=O)N1CC[NH+](CC)CC1 ZINC000085705796 570862954 /nfs/dbraw/zinc/86/29/54/570862954.db2.gz RHTVLEGMPRHWKM-UHFFFAOYSA-N 1 1 368.525 3.726 50 0 FHAAMO CC(C)(CNc1nc(-c2cccs2)nc2ccccc21)[NH+]1CCOCC1 ZINC000019309307 570885628 /nfs/dbraw/zinc/88/56/28/570885628.db2.gz QFODGFWTFJUAGL-UHFFFAOYSA-N 1 1 368.506 3.881 50 0 FHAAMO Fc1ccc(C[NH+]2CCN(Cc3cccc(Br)c3)CC2)cc1 ZINC000019361459 570887387 /nfs/dbraw/zinc/88/73/87/570887387.db2.gz AQVQSMYUEFETCD-UHFFFAOYSA-N 1 1 363.274 3.906 50 0 FHAAMO CC(C)CC[N@H+]1CCC[C@@H]1c1ccc(C(=O)NCCn2ccnc2)s1 ZINC000019743188 570901738 /nfs/dbraw/zinc/90/17/38/570901738.db2.gz 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FHAAMO Cc1ccc([C@H](CC(=O)N[C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)c2ccco2)cc1 ZINC000102683670 209239974 /nfs/dbraw/zinc/23/99/74/209239974.db2.gz ALGBIQNSNSQKKV-KVPLUYHFSA-N 1 1 354.494 3.955 50 0 FHAAMO O=C(CCCc1ccc(Cl)cc1)NCCC1=CSC2=[NH+]CCCN12 ZINC000102043609 209232445 /nfs/dbraw/zinc/23/24/45/209232445.db2.gz NQBQSXVYQMJSNO-UHFFFAOYSA-N 1 1 363.914 3.819 50 0 FHAAMO CCSc1ncc(C[N@H+]2CC[C@@H](c3cccc(OC)c3OC)C2)cn1 ZINC000097696146 209193204 /nfs/dbraw/zinc/19/32/04/209193204.db2.gz QLDPNYDAGMZGJY-OAHLLOKOSA-N 1 1 359.495 3.595 50 0 FHAAMO O=C(NC1(c2cccc(Cl)c2)CC1)[C@@H](c1cccnc1)[NH+]1CCCC1 ZINC000097604056 209188398 /nfs/dbraw/zinc/18/83/98/209188398.db2.gz QPGVXXAAITZDHF-GOSISDBHSA-N 1 1 355.869 3.677 50 0 FHAAMO OC1(c2cccnc2)CC[NH+](Cc2ccc(C(F)(F)F)cc2F)CC1 ZINC000097173187 209173815 /nfs/dbraw/zinc/17/38/15/209173815.db2.gz QZBIFPVCLUXNRP-UHFFFAOYSA-N 1 1 354.347 3.723 50 0 FHAAMO CC[N@H+]1CCCC[C@@H]1CNC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 ZINC000097164671 209172740 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O=C(NC[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000096125613 209116443 /nfs/dbraw/zinc/11/64/43/209116443.db2.gz UOVDWAMJYCHVQU-DNVCBOLYSA-N 1 1 372.900 3.724 50 0 FHAAMO C[C@@H]1C[N@H+](CCCOc2ccc(Br)cc2Cl)C[C@H](C)O1 ZINC000016247646 220181392 /nfs/dbraw/zinc/18/13/92/220181392.db2.gz CRJHFZBEQQKMED-TXEJJXNPSA-N 1 1 362.695 3.981 50 0 FHAAMO CC1CCN(C(=O)C2CC[NH+](Cc3c(F)cccc3Cl)CC2)CC1 ZINC000000778807 206829577 /nfs/dbraw/zinc/82/95/77/206829577.db2.gz NELDVPRLTMODON-UHFFFAOYSA-N 1 1 352.881 3.950 50 0 FHAAMO C[N@@H+](C[C@H]1CCCO1)C1CCN(C(=S)Nc2cccc(Cl)c2)CC1 ZINC000003058113 206955332 /nfs/dbraw/zinc/95/53/32/206955332.db2.gz RBEPVCSXNNCGRG-QGZVFWFLSA-N 1 1 367.946 3.612 50 0 FHAAMO O=C(C[NH+]1CCC(c2nc3ccccc3s2)CC1)NCc1ccccc1 ZINC000004966368 207066312 /nfs/dbraw/zinc/06/63/12/207066312.db2.gz FSWCAKFDIOFUES-UHFFFAOYSA-N 1 1 365.502 3.792 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000005261975 207090783 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CC(C)Cc1cc(C[NH+]2CCC(CO)(CCOc3ccccc3)CC2)[nH]n1 ZINC000011664536 207317362 /nfs/dbraw/zinc/31/73/62/207317362.db2.gz ZKNNOOKHTYFINQ-UHFFFAOYSA-N 1 1 371.525 3.652 50 0 FHAAMO c1cc(CN2CCC[C@@H](c3ccnc(SCC[NH+]4CCCC4)n3)C2)co1 ZINC000011787682 207321661 /nfs/dbraw/zinc/32/16/61/207321661.db2.gz LAAJXJQOOXDKID-GOSISDBHSA-N 1 1 372.538 3.637 50 0 FHAAMO Clc1ccc(C[N@H+]2CC[C@@H](C3CCN(Cc4ncc[nH]4)CC3)C2)cc1 ZINC000011819517 207322848 /nfs/dbraw/zinc/32/28/48/207322848.db2.gz QJHLXDIDUMWVGM-GOSISDBHSA-N 1 1 358.917 3.797 50 0 FHAAMO Cc1nc[nH]c1CN(C)C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC000011936765 207330166 /nfs/dbraw/zinc/33/01/66/207330166.db2.gz DKHCPVUGZSMKND-GOSISDBHSA-N 1 1 360.933 3.758 50 0 FHAAMO O=C(N[C@H]1CCC[N@@H+](CCc2ccccc2)C1)c1ccc(Cl)cc1F ZINC000012000066 207332611 /nfs/dbraw/zinc/33/26/11/207332611.db2.gz FYWUAJGIDBFYFU-KRWDZBQOSA-N 1 1 360.860 3.916 50 0 FHAAMO CN1C[C@@H]2C[C@@H](c3ccc(OCc4ccccc4)cc3)[N@H+]3CCC[C@@]23C1=O ZINC000011998435 207333456 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374.506 3.849 50 0 FHAAMO O=C(NCC1([NH+]2CCOCC2)CCCCC1)c1ccc2ccccc2c1 ZINC000049581056 570965040 /nfs/dbraw/zinc/96/50/40/570965040.db2.gz BYSFBJACSGISND-UHFFFAOYSA-N 1 1 352.478 3.605 50 0 FHAAMO Cc1cc2oc(C(=O)NC[C@@H](c3cccs3)[NH+](C)C)cc(=O)c2cc1C ZINC000028289106 571029586 /nfs/dbraw/zinc/02/95/86/571029586.db2.gz CPSGFOQSHFBQBC-HNNXBMFYSA-N 1 1 370.474 3.504 50 0 FHAAMO CC[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1C ZINC000225407298 571033662 /nfs/dbraw/zinc/03/36/62/571033662.db2.gz NAEYBSNWYFKLSF-CHWSQXEVSA-N 1 1 352.862 3.560 50 0 FHAAMO CC[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1C ZINC000225407298 571033664 /nfs/dbraw/zinc/03/36/64/571033664.db2.gz NAEYBSNWYFKLSF-CHWSQXEVSA-N 1 1 352.862 3.560 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc(-n2ccnc2)cc1)c1ccccc1Cl ZINC000029402778 571039089 /nfs/dbraw/zinc/03/90/89/571039089.db2.gz STMSVCOCNUJVLQ-IBGZPJMESA-N 1 1 368.868 3.558 50 0 FHAAMO Cc1oc(C(=O)NC[C@]2(C)CC[N@H+](C)C2)cc1COc1ccc(C)cc1 ZINC000670472112 571049286 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c1ccc(CC[NH+]2CCC(N3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000022455813 571071553 /nfs/dbraw/zinc/07/15/53/571071553.db2.gz KZKBTTOVKVRHNJ-UHFFFAOYSA-N 1 1 363.549 3.511 50 0 FHAAMO COc1cccc(CN2CC[N@H+]3CCC[C@H]3[C@@H]2C2CCCCC2)c1OC ZINC000022860364 571071558 /nfs/dbraw/zinc/07/15/58/571071558.db2.gz WZXQIVKQISBHGM-FPOVZHCZSA-N 1 1 358.526 3.933 50 0 FHAAMO COc1ccccc1CC(=O)NCc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000040107120 571078168 /nfs/dbraw/zinc/07/81/68/571078168.db2.gz JNVOCKAOYRORCC-SFHVURJKSA-N 1 1 366.505 3.786 50 0 FHAAMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2ccc[nH]c2=S)C1 ZINC000040112279 571079293 /nfs/dbraw/zinc/07/92/93/571079293.db2.gz YXNZZADBJCODRF-HNNXBMFYSA-N 1 1 355.507 3.532 50 0 FHAAMO Cc1ccc(-c2cc(C(=O)NC[C@@H](C)[N@@H+]3C[C@H](C)C[C@H](C)C3)no2)cc1 ZINC000227156152 571086489 /nfs/dbraw/zinc/08/64/89/571086489.db2.gz AAHHKUZURBSFGS-IXDOHACOSA-N 1 1 355.482 3.746 50 0 FHAAMO COCc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)sc2cccc(F)c21 ZINC000229713880 571095050 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CCOc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2c(C)nn(CC)c2C)cc1 ZINC000244678540 571114400 /nfs/dbraw/zinc/11/44/00/571114400.db2.gz IFMKOEKRYCOCGN-OAHLLOKOSA-N 1 1 358.486 3.550 50 0 FHAAMO COCCc1noc([C@H]2CCC[N@@H+](Cc3cc(C4CCCCC4)no3)C2)n1 ZINC000244716118 571115065 /nfs/dbraw/zinc/11/50/65/571115065.db2.gz LIUPAGXFDUGXLE-INIZCTEOSA-N 1 1 374.485 3.674 50 0 FHAAMO O=C(c1cc(F)c(F)cc1Cl)N1CC[NH+](CCc2ccccc2)CC1 ZINC000055062874 571115792 /nfs/dbraw/zinc/11/57/92/571115792.db2.gz CGWWZVFTLIYFKW-UHFFFAOYSA-N 1 1 364.823 3.619 50 0 FHAAMO CC(C)[C@@H](C)[N@@H+](Cc1ccco1)Cc1cn(CC(N)=O)c2ccccc12 ZINC000055166924 571117490 /nfs/dbraw/zinc/11/74/90/571117490.db2.gz WOIZKVIIMTYYAH-MRXNPFEDSA-N 1 1 353.466 3.766 50 0 FHAAMO CCCOc1ccc(CC[NH2+]C[C@@H]2CCCN3CCCC[C@H]23)cc1OC ZINC000055225439 571117800 /nfs/dbraw/zinc/11/78/00/571117800.db2.gz MJVXHNPIPIKWFZ-VQTJNVASSA-N 1 1 360.542 3.881 50 0 FHAAMO CC(C)Cc1noc([C@@H]2CCC[N@@H+](Cc3cc(-c4cccnc4)no3)C2)n1 ZINC000244874280 571118095 /nfs/dbraw/zinc/11/80/95/571118095.db2.gz WXZVDTVRUGXYQD-MRXNPFEDSA-N 1 1 367.453 3.698 50 0 FHAAMO CC(C)Cc1noc([C@H]2CCC[N@@H+](Cc3cc(-c4cccnc4)no3)C2)n1 ZINC000244874279 571118346 /nfs/dbraw/zinc/11/83/46/571118346.db2.gz WXZVDTVRUGXYQD-INIZCTEOSA-N 1 1 367.453 3.698 50 0 FHAAMO Cc1ccnc(C[C@@H](C)[N@@H+](C)Cc2cccnc2NC(=O)C(C)(C)C)c1 ZINC000055283553 571119183 /nfs/dbraw/zinc/11/91/83/571119183.db2.gz LFCKXVPHIRPJQO-MRXNPFEDSA-N 1 1 354.498 3.833 50 0 FHAAMO COc1cc(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(F)cc2)cc2c1OCO2 ZINC000055413806 571120573 /nfs/dbraw/zinc/12/05/73/571120573.db2.gz UJCLIVNUZPGCBF-UHFFFAOYSA-N 1 1 369.396 3.585 50 0 FHAAMO CCCCc1ccc(-n2cc(C[NH2+][C@@H](C)Cc3cc(C)[nH]n3)cn2)cc1 ZINC000055575534 571121167 /nfs/dbraw/zinc/12/11/67/571121167.db2.gz WCQPVRSTFKLGIF-INIZCTEOSA-N 1 1 351.498 3.967 50 0 FHAAMO c1coc([C@H](C[NH2+]Cc2csc(-c3ncccn3)n2)N2CCCCC2)c1 ZINC000058108194 571125399 /nfs/dbraw/zinc/12/53/99/571125399.db2.gz IUFGNBLNWONTIL-INIZCTEOSA-N 1 1 369.494 3.510 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2ccc(N(C)c3ccccc3)cc2)C[C@H]1CCO ZINC000104545731 571126217 /nfs/dbraw/zinc/12/62/17/571126217.db2.gz MICNLUMOVGBWHU-HSZRJFAPSA-N 1 1 367.537 3.732 50 0 FHAAMO CCN(C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1)C(C)C ZINC000248036202 571127436 /nfs/dbraw/zinc/12/74/36/571127436.db2.gz ZBEKESNKHPNIQI-KRWDZBQOSA-N 1 1 356.514 3.525 50 0 FHAAMO Cn1c(C[N@@H+]2CCC[C@@H](C(=O)Nc3ccc(F)cc3)C2)nc2ccccc21 ZINC000248094306 571127898 /nfs/dbraw/zinc/12/78/98/571127898.db2.gz XANODGMJYKPICQ-OAHLLOKOSA-N 1 1 366.440 3.563 50 0 FHAAMO Cn1c(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(F)cc3)C2)nc2ccccc21 ZINC000248094306 571127899 /nfs/dbraw/zinc/12/78/99/571127899.db2.gz XANODGMJYKPICQ-OAHLLOKOSA-N 1 1 366.440 3.563 50 0 FHAAMO Cc1cccc2[nH]c([C@@H]3CCC[N@H+]3CCC(=O)NCc3cccs3)nc21 ZINC000252484343 571132181 /nfs/dbraw/zinc/13/21/81/571132181.db2.gz FUMUHAYHHWRAKW-KRWDZBQOSA-N 1 1 368.506 3.776 50 0 FHAAMO Cc1cccc2nc([C@@H]3CCC[N@@H+]3CCC(=O)NCc3cccs3)[nH]c21 ZINC000252484343 571132182 /nfs/dbraw/zinc/13/21/82/571132182.db2.gz FUMUHAYHHWRAKW-KRWDZBQOSA-N 1 1 368.506 3.776 50 0 FHAAMO Cc1cccc2nc([C@@H]3CCC[N@H+]3CCC(=O)NCc3cccs3)[nH]c21 ZINC000252484343 571132183 /nfs/dbraw/zinc/13/21/83/571132183.db2.gz FUMUHAYHHWRAKW-KRWDZBQOSA-N 1 1 368.506 3.776 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)NCc2ccc(Cl)cc2)cc1 ZINC000012870772 571134363 /nfs/dbraw/zinc/13/43/63/571134363.db2.gz BRCHGFGGXKGMBQ-LJQANCHMSA-N 1 1 358.869 3.802 50 0 FHAAMO Cc1cc(C)c2oc(=O)cc(C[N@@H+](C)CC[C@H](O)c3ccccc3)c2c1 ZINC000065380798 571142358 /nfs/dbraw/zinc/14/23/58/571142358.db2.gz ZRJPMBZFHNBUGN-FQEVSTJZSA-N 1 1 351.446 3.965 50 0 FHAAMO COC(=O)c1cccc(C[N@H+]2CC[C@H](c3ccnc(-c4ccccc4)c3)C2)n1 ZINC000065385570 571142619 /nfs/dbraw/zinc/14/26/19/571142619.db2.gz CCQKHTIIYAVLML-IBGZPJMESA-N 1 1 373.456 3.920 50 0 FHAAMO CCc1ccc2oc(=O)cc(C[N@H+](C)[C@H](COC)c3ccccn3)c2c1 ZINC000065396374 571142892 /nfs/dbraw/zinc/14/28/92/571142892.db2.gz CURRWXHFWWMEQM-LJQANCHMSA-N 1 1 352.434 3.570 50 0 FHAAMO CCc1ccc2oc(=O)cc(C[N@@H+](C)[C@H](COC)c3ccccn3)c2c1 ZINC000065396374 571142893 /nfs/dbraw/zinc/14/28/93/571142893.db2.gz CURRWXHFWWMEQM-LJQANCHMSA-N 1 1 352.434 3.570 50 0 FHAAMO Cc1noc(-c2ccnc(-c3ccc([C@H](C)[NH+]4CCOCC4)cc3)c2)n1 ZINC000065430847 571143255 /nfs/dbraw/zinc/14/32/55/571143255.db2.gz QMUDYBFYHPDNKV-AWEZNQCLSA-N 1 1 350.422 3.500 50 0 FHAAMO Cn1cc(C2=CC[N@@H+](Cc3ccc4c5c3cccc5C(=O)OC4)CC2)cn1 ZINC000065434133 571143724 /nfs/dbraw/zinc/14/37/24/571143724.db2.gz UWGQBJWRXBALMB-UHFFFAOYSA-N 1 1 359.429 3.533 50 0 FHAAMO CC(C)Cc1noc([C@@H]2CCC[N@@H+](Cc3coc4ccccc4c3=O)C2)n1 ZINC000065492650 571144056 /nfs/dbraw/zinc/14/40/56/571144056.db2.gz CGDKVXDFXNXXLI-OAHLLOKOSA-N 1 1 367.449 3.754 50 0 FHAAMO Cc1cnn(C)c1NC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)cc1 ZINC000065492319 571144125 /nfs/dbraw/zinc/14/41/25/571144125.db2.gz CHYJBEYQADVUPK-INIZCTEOSA-N 1 1 363.465 3.569 50 0 FHAAMO C[C@H](c1ccc2c(c1)OCCO2)[N@@H+](C)CCC(=O)Nc1ccccc1F ZINC000065502381 571144180 /nfs/dbraw/zinc/14/41/80/571144180.db2.gz CPCSWTNBMGXXBB-CQSZACIVSA-N 1 1 358.413 3.619 50 0 FHAAMO CC[C@@H]1COCC[N@@H+]1Cc1ccc(C(=O)Nc2c(C)cccc2OC)cc1 ZINC000065488799 571144215 /nfs/dbraw/zinc/14/42/15/571144215.db2.gz BSQLGTLDOZCZHZ-LJQANCHMSA-N 1 1 368.477 3.867 50 0 FHAAMO CC[C@@H]1COCC[N@H+]1Cc1ccc(C(=O)Nc2c(C)cccc2OC)cc1 ZINC000065488799 571144216 /nfs/dbraw/zinc/14/42/16/571144216.db2.gz BSQLGTLDOZCZHZ-LJQANCHMSA-N 1 1 368.477 3.867 50 0 FHAAMO c1[nH+]c2ccccn2c1CCn1cnc(-c2ccccc2)c1[C@H]1CCOC1 ZINC000065500482 571144232 /nfs/dbraw/zinc/14/42/32/571144232.db2.gz XGRFGTJOGABOSW-SFHVURJKSA-N 1 1 358.445 3.944 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccc(F)cc2)cc1 ZINC000012918153 571144768 /nfs/dbraw/zinc/14/47/68/571144768.db2.gz PSPBAPPKMZWSEN-YWZLYKJASA-N 1 1 356.441 3.849 50 0 FHAAMO Nc1ncccc1C[N@@H+]1CCc2[nH]nc(-c3cccc4ccccc43)c2C1 ZINC000067588630 571147461 /nfs/dbraw/zinc/14/74/61/571147461.db2.gz CAWHUOFSIFMBOL-UHFFFAOYSA-N 1 1 355.445 3.765 50 0 FHAAMO Nc1ncccc1C[N@H+]1CCc2[nH]nc(-c3cccc4ccccc43)c2C1 ZINC000067588630 571147467 /nfs/dbraw/zinc/14/74/67/571147467.db2.gz CAWHUOFSIFMBOL-UHFFFAOYSA-N 1 1 355.445 3.765 50 0 FHAAMO Cc1ccccc1-c1cc(O)c2c(c1)C[N@H+](CCCn1cccn1)CCO2 ZINC000067852446 571150390 /nfs/dbraw/zinc/15/03/90/571150390.db2.gz LOKIVVUEDHLAMI-UHFFFAOYSA-N 1 1 363.461 3.849 50 0 FHAAMO c1cc2c(nc[nH+]c2N2CCC[C@H](c3n[nH]cc3Cc3ccccc3)C2)[nH]1 ZINC000067974247 571152854 /nfs/dbraw/zinc/15/28/54/571152854.db2.gz RGBULQSICCJZDY-INIZCTEOSA-N 1 1 358.449 3.656 50 0 FHAAMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@H+](C)CC(=O)Nc1ccccc1Cl ZINC000012946701 571153374 /nfs/dbraw/zinc/15/33/74/571153374.db2.gz FOYMDKLHIXQSOZ-AWEZNQCLSA-N 1 1 369.856 3.552 50 0 FHAAMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)CC(=O)Nc1ccccc1Cl ZINC000012946701 571153377 /nfs/dbraw/zinc/15/33/77/571153377.db2.gz FOYMDKLHIXQSOZ-AWEZNQCLSA-N 1 1 369.856 3.552 50 0 FHAAMO C[C@H](c1ccc(-n2cncn2)cc1)[N@H+](C)CC(=O)Nc1ccccc1Cl ZINC000012946697 571153431 /nfs/dbraw/zinc/15/34/31/571153431.db2.gz FOYMDKLHIXQSOZ-CQSZACIVSA-N 1 1 369.856 3.552 50 0 FHAAMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)CC(=O)Nc1ccccc1Cl ZINC000012946697 571153433 /nfs/dbraw/zinc/15/34/33/571153433.db2.gz FOYMDKLHIXQSOZ-CQSZACIVSA-N 1 1 369.856 3.552 50 0 FHAAMO C[N@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCC3)[C@H]1CCCc2ccccc21 ZINC000007327928 571162458 /nfs/dbraw/zinc/16/24/58/571162458.db2.gz QAVVATJJLKOPQK-INIZCTEOSA-N 1 1 365.502 3.983 50 0 FHAAMO C[N@@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCC3)[C@H]1CCCc2ccccc21 ZINC000007327928 571162460 /nfs/dbraw/zinc/16/24/60/571162460.db2.gz QAVVATJJLKOPQK-INIZCTEOSA-N 1 1 365.502 3.983 50 0 FHAAMO CCN(C(=O)CC[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 ZINC000071575149 571162966 /nfs/dbraw/zinc/16/29/66/571162966.db2.gz QFNXKLFRIASSSR-FQEVSTJZSA-N 1 1 356.441 3.642 50 0 FHAAMO CCN(C(=O)CC[N@H+]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 ZINC000071575149 571162967 /nfs/dbraw/zinc/16/29/67/571162967.db2.gz QFNXKLFRIASSSR-FQEVSTJZSA-N 1 1 356.441 3.642 50 0 FHAAMO CCc1[nH+]ccn1CCN1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000071682208 571163271 /nfs/dbraw/zinc/16/32/71/571163271.db2.gz MWLNNOPJQQAJIX-INIZCTEOSA-N 1 1 354.281 3.826 50 0 FHAAMO CCNC(=O)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc4ccccc4c3)oc2C)C1 ZINC000071759643 571165584 /nfs/dbraw/zinc/16/55/84/571165584.db2.gz PYYLVUVSEVUKDC-LJQANCHMSA-N 1 1 363.461 3.761 50 0 FHAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@@H](CCc2ccc(F)c(F)c2)C1 ZINC000071763926 571165783 /nfs/dbraw/zinc/16/57/83/571165783.db2.gz VKLHDJGKEKOQHP-INIZCTEOSA-N 1 1 361.436 3.595 50 0 FHAAMO CC(C)c1[nH+]ccn1[C@H](C)c1nn2c(Cc3ccccc3)nnc2s1 ZINC000071763553 571165816 /nfs/dbraw/zinc/16/58/16/571165816.db2.gz XKLXLSOUXPSPTE-CYBMUJFWSA-N 1 1 352.467 3.706 50 0 FHAAMO CNC(=O)c1ccc(C[N@H+]2CCC[C@@H](CCc3ccc(F)cc3F)C2)o1 ZINC000072121628 571170082 /nfs/dbraw/zinc/17/00/82/571170082.db2.gz UHRHWRIMSAQSAC-AWEZNQCLSA-N 1 1 362.420 3.762 50 0 FHAAMO COc1cc(C[N@@H+]2CCC[C@@H](OCc3cccnc3)C2)cc(Cl)c1O ZINC000072129140 571170660 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50 0 FHAAMO C[C@@H](C1CCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)CC1)[NH+]1CCCC1 ZINC000091602364 571240982 /nfs/dbraw/zinc/24/09/82/571240982.db2.gz OKJWAFIUYFEUHA-HNNXBMFYSA-N 1 1 357.473 3.776 50 0 FHAAMO CNc1nc(CN2CCC3(CC2)C[C@@H](c2ccccc2)C[N@@H+](C)C3)cs1 ZINC000091643671 571241631 /nfs/dbraw/zinc/24/16/31/571241631.db2.gz IPKHVDZTOSRSHL-GOSISDBHSA-N 1 1 370.566 3.886 50 0 FHAAMO COc1ccc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(C(=O)c2ccccc2C)C3)cc1 ZINC000091713848 571242806 /nfs/dbraw/zinc/24/28/06/571242806.db2.gz HNZBOTLAJZHIPM-VQTJNVASSA-N 1 1 364.489 3.740 50 0 FHAAMO FC(F)(F)CN1CCC[N@@H+](CCOc2cccc3ccccc32)CC1 ZINC000065040920 571251155 /nfs/dbraw/zinc/25/11/55/571251155.db2.gz NERHKJQJYVYNRT-UHFFFAOYSA-N 1 1 352.400 3.789 50 0 FHAAMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)CCc1cc2cc(C)ccc2[nH]c1=O ZINC000065245485 571257586 /nfs/dbraw/zinc/25/75/86/571257586.db2.gz YUHJNFUSXXIYML-LJQANCHMSA-N 1 1 369.509 3.562 50 0 FHAAMO FC(F)(F)c1cc(-c2cccs2)nc(N2CC[N@H+]3CCC[C@@H]3C2)n1 ZINC000036613510 571257895 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Cc1[nH+]ccn1CCN(C)C(=O)c1cccc(-c2ccc(Cl)c(C)n2)c1 ZINC000584898229 571315725 /nfs/dbraw/zinc/31/57/25/571315725.db2.gz WLJOXBOTPRRAPN-UHFFFAOYSA-N 1 1 368.868 3.988 50 0 FHAAMO COc1cc(C[N@@H+](Cc2ccccc2)[C@H](CO)C(C)C)cc(OC)c1OC ZINC000093529966 571326820 /nfs/dbraw/zinc/32/68/20/571326820.db2.gz QJFTWBDUANZXQF-LJQANCHMSA-N 1 1 373.493 3.732 50 0 FHAAMO CCC(=O)N[C@@H](C)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288400 571328762 /nfs/dbraw/zinc/32/87/62/571328762.db2.gz IVCGEFQTGJPGLD-JXFKEZNVSA-N 1 1 357.523 3.526 50 0 FHAAMO CN(C)C(=S)Oc1cccc(C[NH2+]Cc2csc(C(C)(C)C)n2)c1 ZINC000095467806 571330550 /nfs/dbraw/zinc/33/05/50/571330550.db2.gz NAZIOVCFUVHEBN-UHFFFAOYSA-N 1 1 363.552 3.956 50 0 FHAAMO Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000028240676 571338759 /nfs/dbraw/zinc/33/87/59/571338759.db2.gz CQCLZDAMYACAEG-NRFANRHFSA-N 1 1 360.461 3.784 50 0 FHAAMO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@H](C)O1 ZINC000028842727 571341171 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O=C(c1ccc(C(F)(F)F)cc1)N1CC[N@H+]2CCc3ccccc3[C@H]2C1 ZINC000036125825 207263026 /nfs/dbraw/zinc/26/30/26/207263026.db2.gz ZPOXIIFLTDWBPY-GOSISDBHSA-N 1 1 360.379 3.761 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)C1=Cc2sc3c(c2CS1)CCCC3 ZINC000009211385 207261468 /nfs/dbraw/zinc/26/14/68/207261468.db2.gz ZQLCQDBTTMOTRM-CYBMUJFWSA-N 1 1 362.564 3.815 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H]1c1cccs1)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000009647380 207280264 /nfs/dbraw/zinc/28/02/64/207280264.db2.gz OIHMHRBWPJIMTE-LBPRGKRZSA-N 1 1 366.389 3.845 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H]1c1cccs1)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000009647380 207280269 /nfs/dbraw/zinc/28/02/69/207280269.db2.gz OIHMHRBWPJIMTE-LBPRGKRZSA-N 1 1 366.389 3.845 50 0 FHAAMO COc1ccc([C@H]2CCCCC[N@H+]2Cc2cc(=O)n3ccsc3n2)cc1 ZINC000009913999 207289000 /nfs/dbraw/zinc/28/90/00/207289000.db2.gz AWTKPJCACNPHSN-GOSISDBHSA-N 1 1 369.490 3.882 50 0 FHAAMO COc1cccc(C[N@H+]2CCC[C@@H](NC(=O)c3ccc4[nH]ccc4c3)C2)c1 ZINC000011710406 207319501 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CCCCc1nc(C[N@@H+]2CCC[C@@](CO)(CCc3ccccc3)C2)c[nH]1 ZINC000012434221 207375464 /nfs/dbraw/zinc/37/54/64/207375464.db2.gz TYZPMIFSLCJSDS-JOCHJYFZSA-N 1 1 355.526 3.960 50 0 FHAAMO CCCCc1nc(C[N@H+]2CCC[C@@](CO)(CCc3ccccc3)C2)c[nH]1 ZINC000012434221 207375470 /nfs/dbraw/zinc/37/54/70/207375470.db2.gz TYZPMIFSLCJSDS-JOCHJYFZSA-N 1 1 355.526 3.960 50 0 FHAAMO Cc1ncsc1C(=O)N(C)C[C@H]1CCC[N@@H+](CCc2ccccc2C)C1 ZINC000012433211 207376817 /nfs/dbraw/zinc/37/68/17/207376817.db2.gz SSNNMJMYKKZCTO-GOSISDBHSA-N 1 1 371.550 3.787 50 0 FHAAMO CCn1cc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCC2CCCCC2)C3)cn1 ZINC000012454191 207379385 /nfs/dbraw/zinc/37/93/85/207379385.db2.gz MHQIKXPMCQGJPR-QFIPXVFZSA-N 1 1 372.557 3.802 50 0 FHAAMO C[N@H+](CC(=O)NCCC1=CCCCC1)Cc1ccccc1N1CCCC1 ZINC000012523453 207385812 /nfs/dbraw/zinc/38/58/12/207385812.db2.gz VYQIFPGIUOLXPO-UHFFFAOYSA-N 1 1 355.526 3.725 50 0 FHAAMO C[N@@H+](CC(=O)NCCC1=CCCCC1)Cc1ccccc1N1CCCC1 ZINC000012523453 207385817 /nfs/dbraw/zinc/38/58/17/207385817.db2.gz 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ZINC000033318327 208085484 /nfs/dbraw/zinc/08/54/84/208085484.db2.gz HKFSRTBBENIEHP-UHFFFAOYSA-N 1 1 365.412 3.986 50 0 FHAAMO Cc1nc(Nc2ccc(NC(=O)c3cccc(F)c3)cc2)cc(N(C)C)[nH+]1 ZINC000033318327 208085488 /nfs/dbraw/zinc/08/54/88/208085488.db2.gz HKFSRTBBENIEHP-UHFFFAOYSA-N 1 1 365.412 3.986 50 0 FHAAMO CC[NH+]1CCN(C(=O)c2cc3occc3n2Cc2ccccc2Cl)CC1 ZINC000035475360 208126827 /nfs/dbraw/zinc/12/68/27/208126827.db2.gz HYFJHYFEGPKHLJ-UHFFFAOYSA-N 1 1 371.868 3.714 50 0 FHAAMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2cncc(-c3ccc(OCC)cc3)c2)C1 ZINC000034670319 208105106 /nfs/dbraw/zinc/10/51/06/208105106.db2.gz XMDCZBHDGIFUAA-LJQANCHMSA-N 1 1 368.477 3.922 50 0 FHAAMO CC(C)C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc(F)cc3)cn2)CC1 ZINC000034681655 208106120 /nfs/dbraw/zinc/10/61/20/208106120.db2.gz FWVKILJNASIJBL-UHFFFAOYSA-N 1 1 370.472 3.641 50 0 FHAAMO CC(=O)N(CC(C)C)C[C@H]1C[N@@H+](Cc2cccn2C)C[C@@H]1c1ccccc1 ZINC000034740397 208109762 /nfs/dbraw/zinc/10/97/62/208109762.db2.gz QYVUAOZEEFLPGF-FYYLOGMGSA-N 1 1 367.537 3.745 50 0 FHAAMO O=C1NC2(CC[NH+](Cc3cccc(Cl)c3)CC2)Nc2cccc(F)c21 ZINC000034812269 208111634 /nfs/dbraw/zinc/11/16/34/208111634.db2.gz HPISCYZAJADNHC-UHFFFAOYSA-N 1 1 359.832 3.627 50 0 FHAAMO COc1ccc([C@@H](CC(=O)N2CCCC2)c2c[nH+]c3n2CC[C@@H](C)C3)cc1 ZINC000034920019 208117570 /nfs/dbraw/zinc/11/75/70/208117570.db2.gz VPINDDGBMXRGAR-VQIMIIECSA-N 1 1 367.493 3.618 50 0 FHAAMO Cc1ccc(C[N@H+](Cc2ccc(F)cc2)C[C@H](O)COCc2ccco2)o1 ZINC000036031391 208141147 /nfs/dbraw/zinc/14/11/47/208141147.db2.gz BJEXIZMGXLEMKK-IBGZPJMESA-N 1 1 373.424 3.900 50 0 FHAAMO C[C@H](c1nc2ccccc2s1)[N@H+](C)C[C@H](O)COc1ccc(F)cc1 ZINC000036033829 208141753 /nfs/dbraw/zinc/14/17/53/208141753.db2.gz SMTLLCZTTANBQR-HIFRSBDPSA-N 1 1 360.454 3.868 50 0 FHAAMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)C[C@H](O)COc1ccc(F)cc1 ZINC000036033829 208141758 /nfs/dbraw/zinc/14/17/58/208141758.db2.gz SMTLLCZTTANBQR-HIFRSBDPSA-N 1 1 360.454 3.868 50 0 FHAAMO COCCC[N@H+](Cc1ccc(C)cc1)C[C@H](O)COc1ccccc1C ZINC000036094992 208143108 /nfs/dbraw/zinc/14/31/08/208143108.db2.gz NDWDYZBYYDCTGO-NRFANRHFSA-N 1 1 357.494 3.582 50 0 FHAAMO Cc1ccc(C[N@@H+](Cc2nc(C(=O)NC3CC3)co2)[C@H](C)C(C)C)cc1 ZINC000036063921 208143271 /nfs/dbraw/zinc/14/32/71/208143271.db2.gz BQPHYHXJPYCYCR-MRXNPFEDSA-N 1 1 355.482 3.922 50 0 FHAAMO Cc1ccc(C[N@H+](Cc2nc(C(=O)NC3CC3)co2)[C@H](C)C(C)C)cc1 ZINC000036063921 208143273 /nfs/dbraw/zinc/14/32/73/208143273.db2.gz BQPHYHXJPYCYCR-MRXNPFEDSA-N 1 1 355.482 3.922 50 0 FHAAMO COc1ccc(C[N@@H+](CCC(C)C)C[C@@H](O)COCc2ccco2)cc1 ZINC000036095297 208143603 /nfs/dbraw/zinc/14/36/03/208143603.db2.gz RTDRAIRVIHLJJI-LJQANCHMSA-N 1 1 361.482 3.714 50 0 FHAAMO COc1cccc(C[N@@H+](CC(C)C)C[C@@H](O)Cc2ccccc2)c1OC ZINC000036097063 208144998 /nfs/dbraw/zinc/14/49/98/208144998.db2.gz BODACLBRTDVWOC-FQEVSTJZSA-N 1 1 357.494 3.765 50 0 FHAAMO Cc1ccc(C[N@@H+](C[C@H](O)COc2ccccc2)C[C@H]2CCCO2)c(C)c1 ZINC000036100849 208145260 /nfs/dbraw/zinc/14/52/60/208145260.db2.gz GWXJGRLKRGYHHP-JTHBVZDNSA-N 1 1 369.505 3.724 50 0 FHAAMO COc1ccc(OC[C@@H](O)C[N@@H+](Cc2ccccc2Cl)C(C)C)cc1 ZINC000036102012 208146581 /nfs/dbraw/zinc/14/65/81/208146581.db2.gz XYJIKRQIUOSLNN-KRWDZBQOSA-N 1 1 363.885 3.999 50 0 FHAAMO Cc1ccccc1C[N@@H+](C[C@H](O)COCc1ccccc1)C[C@@H]1CCCO1 ZINC000036099994 208147552 /nfs/dbraw/zinc/14/75/52/208147552.db2.gz MCKFJXVKFHXMKJ-GOTSBHOMSA-N 1 1 369.505 3.554 50 0 FHAAMO CC[N@@H+](C[C@H](O)c1ccccc1)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036146307 208150111 /nfs/dbraw/zinc/15/01/11/208150111.db2.gz JXAMYVRVCYAMKB-QUCCMNQESA-N 1 1 358.869 3.889 50 0 FHAAMO CC(=O)CCc1ccc(OC[C@H](O)C[N@H+]2CCC[C@H]3CCCC[C@@H]32)cc1 ZINC000037201814 208177730 /nfs/dbraw/zinc/17/77/30/208177730.db2.gz QEPLIBYYEBCJRH-SJBKTWHCSA-N 1 1 359.510 3.603 50 0 FHAAMO Cc1c2cccc(C)c2[nH]c1CN1CC[N@@H+](C2CCCC2)[C@H](CCO)C1 ZINC000039516028 208211770 /nfs/dbraw/zinc/21/17/70/208211770.db2.gz QSJKAJTZELLKGF-LJQANCHMSA-N 1 1 355.526 3.596 50 0 FHAAMO O=C(Nc1ccc(-c2cc[nH]n2)cc1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000039447338 208212147 /nfs/dbraw/zinc/21/21/47/208212147.db2.gz MFAIEJNNKYQMKS-IBGZPJMESA-N 1 1 360.461 3.927 50 0 FHAAMO CN(C)C(=O)[C@H](c1ccccc1)[N@H+](C)Cc1ccc(Br)cc1 ZINC000039985895 208216363 /nfs/dbraw/zinc/21/63/63/208216363.db2.gz OSDJFMYLRWVEGC-KRWDZBQOSA-N 1 1 361.283 3.710 50 0 FHAAMO CN(C)C(=O)[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(Br)cc1 ZINC000039985895 208216368 /nfs/dbraw/zinc/21/63/68/208216368.db2.gz OSDJFMYLRWVEGC-KRWDZBQOSA-N 1 1 361.283 3.710 50 0 FHAAMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1cnc(-c2ccccc2)s1 ZINC000040108595 208229817 /nfs/dbraw/zinc/22/98/17/208229817.db2.gz QLWOFBNMNSUABX-INIZCTEOSA-N 1 1 367.474 3.970 50 0 FHAAMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(C2SCCCS2)cc1 ZINC000040155368 208238871 /nfs/dbraw/zinc/23/88/71/208238871.db2.gz LCSYQNHVKTUIHM-UHFFFAOYSA-N 1 1 361.536 3.880 50 0 FHAAMO COc1cc(CNCC[NH+](C)C)cc(Cl)c1OCc1ccccc1C ZINC000040720575 208263648 /nfs/dbraw/zinc/26/36/48/208263648.db2.gz DBCHIIPPKUXOIK-UHFFFAOYSA-N 1 1 362.901 3.887 50 0 FHAAMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2)C1 ZINC000046934458 208369945 /nfs/dbraw/zinc/36/99/45/208369945.db2.gz QQJIKJLBKAZJTN-OAHLLOKOSA-N 1 1 352.434 3.900 50 0 FHAAMO O=C1N(CC2CC2)CCC[C@@]12CC[N@H+](Cc1ccc(F)cc1Cl)C2 ZINC000091872192 209002359 /nfs/dbraw/zinc/00/23/59/209002359.db2.gz BUXBKXOVMMOLTF-IBGZPJMESA-N 1 1 350.865 3.704 50 0 FHAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3cc(C)no3)CC2)C1 ZINC000091951288 209007671 /nfs/dbraw/zinc/00/76/71/209007671.db2.gz ZRYRIVXQJCOHNC-LJQANCHMSA-N 1 1 367.493 3.715 50 0 FHAAMO CC[C@H](Oc1ccccc1Cl)C(=O)Nc1c[nH+]ccc1-n1cccn1 ZINC000095963644 209091120 /nfs/dbraw/zinc/09/11/20/209091120.db2.gz SYJQLTDDCRAQTA-INIZCTEOSA-N 1 1 356.813 3.717 50 0 FHAAMO O=C(NCC[N@H+]1CC[C@@H](c2ccccc2)C1)c1cc2c(s1)CCCC2 ZINC000092028975 209012782 /nfs/dbraw/zinc/01/27/82/209012782.db2.gz QRCPHFNMAYOWCI-GOSISDBHSA-N 1 1 354.519 3.846 50 0 FHAAMO Cc1ccc(C)c(NC(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2cccnc2)C3)c1 ZINC000092028085 209013638 /nfs/dbraw/zinc/01/36/38/209013638.db2.gz RLMXCLQUTLHRSH-VQTJNVASSA-N 1 1 364.493 3.827 50 0 FHAAMO CCCn1ncc(CN2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)c1C ZINC000092081895 209016350 /nfs/dbraw/zinc/01/63/50/209016350.db2.gz VSCLKDLNTAVSRO-RBBKRZOGSA-N 1 1 352.526 3.698 50 0 FHAAMO O=C(c1cccc(Cl)c1Cl)N1CCCC[C@@H]1CC[NH+]1CCOCC1 ZINC000092065780 209016758 /nfs/dbraw/zinc/01/67/58/209016758.db2.gz DKJHATTUYMGWAJ-CQSZACIVSA-N 1 1 371.308 3.710 50 0 FHAAMO FC(F)Oc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2ccccn2)C3)cc1 ZINC000095354370 209024946 /nfs/dbraw/zinc/02/49/46/209024946.db2.gz XYUFESVJPLFQCI-PKOBYXMFSA-N 1 1 373.447 3.779 50 0 FHAAMO FC(F)Oc1ccc(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2ccccn2)C3)cc1 ZINC000095354370 209024950 /nfs/dbraw/zinc/02/49/50/209024950.db2.gz XYUFESVJPLFQCI-PKOBYXMFSA-N 1 1 373.447 3.779 50 0 FHAAMO FC(F)Oc1ccc(CN2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccn2)C3)cc1 ZINC000095354370 209024951 /nfs/dbraw/zinc/02/49/51/209024951.db2.gz XYUFESVJPLFQCI-PKOBYXMFSA-N 1 1 373.447 3.779 50 0 FHAAMO COc1ccnc(CN2C[C@H]3CC[C@@H]2C[N@@H+](CCCc2ccccc2)C3)c1 ZINC000095358111 209025556 /nfs/dbraw/zinc/02/55/56/209025556.db2.gz KHJFBNPGLMNQOD-RBBKRZOGSA-N 1 1 365.521 3.619 50 0 FHAAMO Cc1ccc(OCCN(C)C(=O)C[N@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000095359584 209027867 /nfs/dbraw/zinc/02/78/67/209027867.db2.gz PQESOLHXLUFJQX-NRFANRHFSA-N 1 1 366.505 3.712 50 0 FHAAMO Cc1nn(C(C)C)c(C)c1CN(C)C(=O)[C@@H](c1ccccc1C)[NH+](C)C ZINC000095359440 209028376 /nfs/dbraw/zinc/02/83/76/209028376.db2.gz LMHRKPUHMUUQJZ-HXUWFJFHSA-N 1 1 356.514 3.651 50 0 FHAAMO COc1cc(CN2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)cc(OC)c1 ZINC000095362745 209029844 /nfs/dbraw/zinc/02/98/44/209029844.db2.gz OGGZORMSQHHCPQ-PZJWPPBQSA-N 1 1 366.505 3.800 50 0 FHAAMO COc1cc(C[N@@H+]2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3)cc(OC)c1 ZINC000095362745 209029848 /nfs/dbraw/zinc/02/98/48/209029848.db2.gz OGGZORMSQHHCPQ-PZJWPPBQSA-N 1 1 366.505 3.800 50 0 FHAAMO COc1cc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3)cc(OC)c1 ZINC000095362745 209029852 /nfs/dbraw/zinc/02/98/52/209029852.db2.gz OGGZORMSQHHCPQ-PZJWPPBQSA-N 1 1 366.505 3.800 50 0 FHAAMO Cc1cccc([C@H](C(=O)NCc2cc(-c3ccc(F)cc3)no2)[NH+](C)C)c1 ZINC000092046794 209015020 /nfs/dbraw/zinc/01/50/20/209015020.db2.gz GNZMKLRZUQYRQH-HXUWFJFHSA-N 1 1 367.424 3.708 50 0 FHAAMO Cc1noc2nc(C)nc(N[C@H](CCn3cc[nH+]c3C)c3ccccc3)c12 ZINC000095364712 209030761 /nfs/dbraw/zinc/03/07/61/209030761.db2.gz DVAWXKBKVOMDFN-QGZVFWFLSA-N 1 1 362.437 3.983 50 0 FHAAMO O=C(CC[N@H+]1CCC[C@H](c2nccn2CC2CCC2)C1)NC1CCCCC1 ZINC000095367388 209030900 /nfs/dbraw/zinc/03/09/00/209030900.db2.gz NHMROIWDHQCEBN-IBGZPJMESA-N 1 1 372.557 3.702 50 0 FHAAMO O=C(CCc1ccc(F)cc1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000095384209 209042802 /nfs/dbraw/zinc/04/28/02/209042802.db2.gz LGNUVKHTOKTAGE-RBBKRZOGSA-N 1 1 366.480 3.881 50 0 FHAAMO Cc1nc(C)c(C(=O)N2CCC3(CC2)C[C@@H](c2ccccc2)C[N@H+](C)C3)o1 ZINC000095387650 209043654 /nfs/dbraw/zinc/04/36/54/209043654.db2.gz UMLZLPZBWJKNAR-LJQANCHMSA-N 1 1 367.493 3.633 50 0 FHAAMO COc1cc(C[NH2+][C@@H](c2nnc3ccccn32)C(C)C)ccc1SC ZINC000095393030 209047730 /nfs/dbraw/zinc/04/77/30/209047730.db2.gz VDQXTIUBTMKTGT-GOSISDBHSA-N 1 1 356.495 3.947 50 0 FHAAMO Cn1cc[nH+]c1CC1CCN(C(=O)Nc2ccccc2OC(F)F)CC1 ZINC000095430996 209048736 /nfs/dbraw/zinc/04/87/36/209048736.db2.gz FUMGYAKJTPXKGQ-UHFFFAOYSA-N 1 1 364.396 3.508 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(OC)c1 ZINC000095457008 209053638 /nfs/dbraw/zinc/05/36/38/209053638.db2.gz WTEDKEBKTKQMJS-MRXNPFEDSA-N 1 1 364.486 3.535 50 0 FHAAMO Cc1nc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](CCCc2ccccc2)C3)cs1 ZINC000095498057 209059399 /nfs/dbraw/zinc/05/93/99/209059399.db2.gz MYEICXWASSRMGU-RBUKOAKNSA-N 1 1 369.534 3.621 50 0 FHAAMO COCC[NH+]1CCN(C(=O)Nc2ccccc2Oc2cccc(C)c2)CC1 ZINC000095498545 209061931 /nfs/dbraw/zinc/06/19/31/209061931.db2.gz PLYJRCQFDCSQKG-UHFFFAOYSA-N 1 1 369.465 3.583 50 0 FHAAMO COc1cccc(-c2cccc(NC(=O)[C@@H]3CCCC[N@H+]3CCCO)c2)c1 ZINC000095509391 209067868 /nfs/dbraw/zinc/06/78/68/209067868.db2.gz AKUAKYJEGIPJNW-NRFANRHFSA-N 1 1 368.477 3.538 50 0 FHAAMO CC(C)c1nnc(N2CCC(c3[nH+]ccn3Cc3ccccn3)CC2)s1 ZINC000095517758 209071144 /nfs/dbraw/zinc/07/11/44/209071144.db2.gz MLGPUJYTVQPDNB-UHFFFAOYSA-N 1 1 368.510 3.685 50 0 FHAAMO COc1cccc(N2CCC([N@H+]3CC[C@@](O)(C4CCC4)[C@H](C)C3)CC2)c1 ZINC000091713115 132203305 /nfs/dbraw/zinc/20/33/05/132203305.db2.gz KOMBZGHLNNQJIE-VGSWGCGISA-N 1 1 358.526 3.537 50 0 FHAAMO Cc1cccc(C)c1OCC[N@H+](C)Cc1ccccc1N1CCOCC1 ZINC000095469157 132211604 /nfs/dbraw/zinc/21/16/04/132211604.db2.gz TXSNSTVOSNFUMF-UHFFFAOYSA-N 1 1 354.494 3.651 50 0 FHAAMO C[C@H]1C[C@@H](Nc2ccccc2N2CCC(O)CC2)C[N@H+]1Cc1ccccc1 ZINC000095997206 132216759 /nfs/dbraw/zinc/21/67/59/132216759.db2.gz GLCWBGLYXDCCKI-AZUAARDMSA-N 1 1 365.521 3.723 50 0 FHAAMO CCOc1ccc(C(=O)c2c[nH+]c3ccccc3c2N2CCOCC2)cc1 ZINC000101552121 132234100 /nfs/dbraw/zinc/23/41/00/132234100.db2.gz IYCZYMGXQXOGHV-UHFFFAOYSA-N 1 1 362.429 3.701 50 0 FHAAMO Cc1cnc(C)c(N2CC[NH+](Cc3ccc([C@@H]4CCCCO4)s3)CC2)n1 ZINC000215441692 132270132 /nfs/dbraw/zinc/27/01/32/132270132.db2.gz VVBYTBUBEJJWKQ-SFHVURJKSA-N 1 1 372.538 3.719 50 0 FHAAMO FC(F)(F)c1cccc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1 ZINC000000752288 132378184 /nfs/dbraw/zinc/37/81/84/132378184.db2.gz IRGFQGTYFALVCK-UHFFFAOYSA-N 1 1 364.367 3.756 50 0 FHAAMO COc1ccc(C[NH+]2CCN(c3cccc(C)c3C)CC2)c(OC)c1OC ZINC000001227360 132381285 /nfs/dbraw/zinc/38/12/85/132381285.db2.gz YWFIETHAJKDZSE-UHFFFAOYSA-N 1 1 370.493 3.651 50 0 FHAAMO CCOc1ccccc1N1CC[NH+](Cc2ccc(OC)c(OCC)c2)CC1 ZINC000001227133 132381365 /nfs/dbraw/zinc/38/13/65/132381365.db2.gz LUQMGVBNGPHDCB-UHFFFAOYSA-N 1 1 370.493 3.815 50 0 FHAAMO CC(C)CNC(=O)c1ccc(C[NH+]2CCN(c3ccccc3F)CC2)cc1 ZINC000034668371 136117701 /nfs/dbraw/zinc/11/77/01/136117701.db2.gz ZDZAXGPJBRRLEE-UHFFFAOYSA-N 1 1 369.484 3.534 50 0 FHAAMO CC(=O)Nc1sc2c(c1C[NH+]1CCN(c3ccccc3)CC1)CCCC2 ZINC000054072955 136125228 /nfs/dbraw/zinc/12/52/28/136125228.db2.gz AVKXEZTVKKTJNY-UHFFFAOYSA-N 1 1 369.534 3.908 50 0 FHAAMO CCC[C@@H]1CC[N@H+](C2CCN(c3cccc(N4CCCC4=O)c3)CC2)C1 ZINC000063857279 136133027 /nfs/dbraw/zinc/13/30/27/136133027.db2.gz SNSGZLTUWPNHNA-GOSISDBHSA-N 1 1 355.526 3.904 50 0 FHAAMO Fc1cccc(-c2ccc(N3CCC([N@@H+]4CCCNCC4)CC3)cc2)c1 ZINC000063845213 136133046 /nfs/dbraw/zinc/13/30/46/136133046.db2.gz IUWDTMCYLAYFEE-UHFFFAOYSA-N 1 1 353.485 3.757 50 0 FHAAMO Fc1cccc(-c2ccc(N3CCC([N@H+]4CCCNCC4)CC3)cc2)c1 ZINC000063845213 136133047 /nfs/dbraw/zinc/13/30/47/136133047.db2.gz IUWDTMCYLAYFEE-UHFFFAOYSA-N 1 1 353.485 3.757 50 0 FHAAMO CN(C)c1ncc(C[NH+]2CCN(c3ccc4ccccc4c3)CC2)s1 ZINC000072151669 136142809 /nfs/dbraw/zinc/14/28/09/136142809.db2.gz NXVINFZQUKLKDQ-UHFFFAOYSA-N 1 1 352.507 3.685 50 0 FHAAMO Cc1nn(C)c2nc(NC[C@H]3CCC[N@@H+](Cc4ccccc4)C3)sc12 ZINC000095525212 209076554 /nfs/dbraw/zinc/07/65/54/209076554.db2.gz NNCHGWAUDZCICP-MRXNPFEDSA-N 1 1 355.511 3.662 50 0 FHAAMO C(=C/c1ccccc1)\C[NH+]1CCN(Cc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000019781767 263376552 /nfs/dbraw/zinc/37/65/52/263376552.db2.gz YIAWHPIFPMILCC-JXMROGBWSA-N 1 1 358.489 3.908 50 0 FHAAMO CCOc1cc(CN2CCC[C@@H]([N@H+]3CCc4ccccc4C3)C2)ccc1O ZINC000019787852 263377450 /nfs/dbraw/zinc/37/74/50/263377450.db2.gz VSXVHQMNGSTDBF-OAQYLSRUSA-N 1 1 366.505 3.814 50 0 FHAAMO CCC[NH+]1CCN(C(=O)c2ccc(N3CCc4ccccc43)s2)CC1 ZINC000020985948 519856947 /nfs/dbraw/zinc/85/69/47/519856947.db2.gz AJDCIQBRVQOVBG-UHFFFAOYSA-N 1 1 355.507 3.610 50 0 FHAAMO CCCC(=O)N[C@@H](C)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288410 519874892 /nfs/dbraw/zinc/87/48/92/519874892.db2.gz ZPOBFBGXGLHTPU-UWJYYQICSA-N 1 1 371.550 3.916 50 0 FHAAMO CCCC(=O)N[C@H](C)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288412 519876035 /nfs/dbraw/zinc/87/60/35/519876035.db2.gz ZPOBFBGXGLHTPU-UTKZUKDTSA-N 1 1 371.550 3.916 50 0 FHAAMO CCCCOc1ccc(C(=O)N2CCCC[C@H]2CC[NH+]2CCOCC2)cc1 ZINC000020869039 520865693 /nfs/dbraw/zinc/86/56/93/520865693.db2.gz CTKGQJWXCUAAPH-FQEVSTJZSA-N 1 1 374.525 3.583 50 0 FHAAMO CCCc1cc(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)[nH]n1 ZINC000091351073 521359787 /nfs/dbraw/zinc/35/97/87/521359787.db2.gz JHMXPYQVQPDPCF-SFHVURJKSA-N 1 1 360.889 3.583 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNCc1cccc(OC)c1OCc1ccccc1F ZINC000020029443 521640614 /nfs/dbraw/zinc/64/06/14/521640614.db2.gz VWZSBFYGZBKDQS-LJQANCHMSA-N 1 1 372.484 3.987 50 0 FHAAMO CCN1CCC[C@@H]1C[NH2+]Cc1cccc(OC)c1OCc1ccccc1F ZINC000020029443 521640616 /nfs/dbraw/zinc/64/06/16/521640616.db2.gz VWZSBFYGZBKDQS-LJQANCHMSA-N 1 1 372.484 3.987 50 0 FHAAMO CC[NH+]1CCN(c2c(Cl)cccc2NC(=O)c2ccc(F)cc2)CC1 ZINC000000680113 521696540 /nfs/dbraw/zinc/69/65/40/521696540.db2.gz BRXVSUNWVIOTSG-UHFFFAOYSA-N 1 1 361.848 3.873 50 0 FHAAMO COc1cc(C[N@H+](C)[C@H]2CCN(c3ccccc3F)C2=O)ccc1SC ZINC000079027761 522358463 /nfs/dbraw/zinc/35/84/63/522358463.db2.gz DFQHYPAHKSCGFB-KRWDZBQOSA-N 1 1 374.481 3.794 50 0 FHAAMO COc1cc(C[N@@H+](C)[C@H]2CCN(c3ccccc3F)C2=O)ccc1SC ZINC000079027761 522358473 /nfs/dbraw/zinc/35/84/73/522358473.db2.gz DFQHYPAHKSCGFB-KRWDZBQOSA-N 1 1 374.481 3.794 50 0 FHAAMO COc1cc(CN2CC[N@H+]3CCC[C@H]3[C@H]2C2CCCCC2)cc(OC)c1 ZINC000239338917 522385146 /nfs/dbraw/zinc/38/51/46/522385146.db2.gz LKLRJFSEZURBRF-FCHUYYIVSA-N 1 1 358.526 3.933 50 0 FHAAMO C[N@@H+](Cc1ccccc1)[C@H]1CCCN(CC(=O)Nc2ccc(F)cc2)CC1 ZINC000089361358 523352770 /nfs/dbraw/zinc/35/27/70/523352770.db2.gz ICXDSFKFHYLEEB-NRFANRHFSA-N 1 1 369.484 3.751 50 0 FHAAMO C[N@@H+](Cc1ccoc1)Cc1ccc(-c2nc(-c3ccccn3)cc(=O)[nH]2)cc1 ZINC000020866300 523475070 /nfs/dbraw/zinc/47/50/70/523475070.db2.gz PTPJFJDAFYPYBZ-UHFFFAOYSA-N 1 1 372.428 3.724 50 0 FHAAMO COc1ccccc1NC(=O)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccccc2)C1 ZINC000091462010 524612969 /nfs/dbraw/zinc/61/29/69/524612969.db2.gz NNGVYTYQKLHPGW-RTBURBONSA-N 1 1 365.477 3.824 50 0 FHAAMO Cc1cccc(OCC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)c1 ZINC000019842032 524715243 /nfs/dbraw/zinc/71/52/43/524715243.db2.gz CKQQCWPITQFKQV-UHFFFAOYSA-N 1 1 374.484 3.871 50 0 FHAAMO C[C@@H](Oc1ccc2ccccc2c1)C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020311862 525933804 /nfs/dbraw/zinc/93/38/04/525933804.db2.gz WUHZWXWMGNXTCB-LJQANCHMSA-N 1 1 374.484 3.952 50 0 FHAAMO Cc1ccc([C@H](CC(=O)N[C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)c2ccco2)cc1 ZINC000239274607 525952280 /nfs/dbraw/zinc/95/22/80/525952280.db2.gz ALGBIQNSNSQKKV-IZBJGVDFSA-N 1 1 354.494 3.955 50 0 FHAAMO Fc1ccc(OCCN2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccc2)C3)cc1 ZINC000091625462 526356970 /nfs/dbraw/zinc/35/69/70/526356970.db2.gz XIMDDDPXSMFNLW-PZJWPPBQSA-N 1 1 354.469 3.801 50 0 FHAAMO Fc1ccc(OCC[N@@H+]2C[C@H]3CC[C@@H]2CN(Cc2ccccc2)C3)cc1 ZINC000091625462 526356975 /nfs/dbraw/zinc/35/69/75/526356975.db2.gz XIMDDDPXSMFNLW-PZJWPPBQSA-N 1 1 354.469 3.801 50 0 FHAAMO Fc1ccc(OCC[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2ccccc2)C3)cc1 ZINC000091625462 526356982 /nfs/dbraw/zinc/35/69/82/526356982.db2.gz XIMDDDPXSMFNLW-PZJWPPBQSA-N 1 1 354.469 3.801 50 0 FHAAMO c1ccc(CCC[C@H]2CCCCN2c2nc(N3CCOCC3)cc[nH+]2)cc1 ZINC000089830492 526465637 /nfs/dbraw/zinc/46/56/37/526465637.db2.gz JYUGZMOHQKVCGC-HXUWFJFHSA-N 1 1 366.509 3.695 50 0 FHAAMO CCCO[C@H]1CCC[N@H+](C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000095388952 535239859 /nfs/dbraw/zinc/23/98/59/535239859.db2.gz WZPBSEHXXPINGQ-KRWDZBQOSA-N 1 1 371.447 3.960 50 0 FHAAMO CC[C@H](C)NC(=O)c1ccc(C[NH+]2CCN(c3ccccc3F)CC2)cc1 ZINC000034668377 536169014 /nfs/dbraw/zinc/16/90/14/536169014.db2.gz QCPYKIZNYYEBTR-KRWDZBQOSA-N 1 1 369.484 3.676 50 0 FHAAMO CC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]2C[N@H+](Cc2ccccc2)C3)s1 ZINC000214950497 568033939 /nfs/dbraw/zinc/03/39/39/568033939.db2.gz CXTSRSGDLPJYMA-MSOLQXFVSA-N 1 1 368.502 3.687 50 0 FHAAMO CC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]2C[N@@H+](Cc2ccccc2)C3)s1 ZINC000214950497 568033940 /nfs/dbraw/zinc/03/39/40/568033940.db2.gz CXTSRSGDLPJYMA-MSOLQXFVSA-N 1 1 368.502 3.687 50 0 FHAAMO OCc1ccc2c(c1)C[N@@H+](Cc1ccc([C@@H]3CCCCO3)s1)CCO2 ZINC000215314247 568063400 /nfs/dbraw/zinc/06/34/00/568063400.db2.gz UCXBQLJKXUXKBH-IBGZPJMESA-N 1 1 359.491 3.877 50 0 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FHAAMO CC(=O)c1cccc(OC[C@H](O)C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000023674135 570966436 /nfs/dbraw/zinc/96/64/36/570966436.db2.gz VZAHBJUSERMORJ-CXAGYDPISA-N 1 1 363.404 3.600 50 0 FHAAMO CC(=O)c1cccc(OC[C@H](O)C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000023674135 570966440 /nfs/dbraw/zinc/96/64/40/570966440.db2.gz VZAHBJUSERMORJ-CXAGYDPISA-N 1 1 363.404 3.600 50 0 FHAAMO CC[N@@H+]1CCC[C@H]1CN[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000025606652 570997883 /nfs/dbraw/zinc/99/78/83/570997883.db2.gz XFYNEJAINDSACU-HKUYNNGSSA-N 1 1 367.493 3.880 50 0 FHAAMO CC[N@H+]1CCC[C@H]1CN[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000025606652 570997886 /nfs/dbraw/zinc/99/78/86/570997886.db2.gz XFYNEJAINDSACU-HKUYNNGSSA-N 1 1 367.493 3.880 50 0 FHAAMO C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+](C)CCC(=O)NC1CC1 ZINC000026913058 571009130 /nfs/dbraw/zinc/00/91/30/571009130.db2.gz HKLQFHYQMAODCN-MRXNPFEDSA-N 1 1 365.477 3.600 50 0 FHAAMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1ccc(-n2cccn2)cc1 ZINC000027541789 571013443 /nfs/dbraw/zinc/01/34/43/571013443.db2.gz RMXAATIYJQJYQM-QGZVFWFLSA-N 1 1 358.449 3.646 50 0 FHAAMO CN(C)c1cc(-c2noc([C@@H]3CCC[N@@H+](Cc4ccccc4)C3)n2)ccn1 ZINC000083854215 571053327 /nfs/dbraw/zinc/05/33/27/571053327.db2.gz OJECVRRVYLISKB-GOSISDBHSA-N 1 1 363.465 3.577 50 0 FHAAMO CCCc1nn2c(nc(C[N@@H+](CCC)Cc3ccc(F)cc3)cc2=O)s1 ZINC000046032204 571061465 /nfs/dbraw/zinc/06/14/65/571061465.db2.gz KHXXKCUNTGXOJZ-UHFFFAOYSA-N 1 1 374.485 3.655 50 0 FHAAMO C[N@H+](Cc1ccc(Br)cc1)C[C@H](O)COCc1cccs1 ZINC000068047596 571062526 /nfs/dbraw/zinc/06/25/26/571062526.db2.gz IDVJPODBTNEHMR-HNNXBMFYSA-N 1 1 370.312 3.520 50 0 FHAAMO COc1ccc2[nH]cc(C3=CC[N@@H+](Cc4cccc(C(N)=O)c4)CC3)c2c1 ZINC000053074311 571062643 /nfs/dbraw/zinc/06/26/43/571062643.db2.gz LUYOHMNPVKTGMP-UHFFFAOYSA-N 1 1 361.445 3.565 50 0 FHAAMO CCCCNC(=O)[C@@H](C)[N@H+]1CC=C(c2c[nH]c3ccc(OC)cc32)CC1 ZINC000053073937 571062803 /nfs/dbraw/zinc/06/28/03/571062803.db2.gz JBBIEAXOEXCLAA-OAHLLOKOSA-N 1 1 355.482 3.570 50 0 FHAAMO CCCCNC(=O)[C@@H](C)[N@@H+]1CC=C(c2c[nH]c3ccc(OC)cc32)CC1 ZINC000053073937 571062806 /nfs/dbraw/zinc/06/28/06/571062806.db2.gz JBBIEAXOEXCLAA-OAHLLOKOSA-N 1 1 355.482 3.570 50 0 FHAAMO COc1cccc(CN2CC[N@H+]3CCC[C@@H]3[C@@H]2C2CCCCC2)c1OC ZINC000022859273 571071549 /nfs/dbraw/zinc/07/15/49/571071549.db2.gz WZXQIVKQISBHGM-CTNGQTDRSA-N 1 1 358.526 3.933 50 0 FHAAMO C[C@H]1c2cccn2CC[N@H+]1C[C@@H](O)COc1ccc(-c2ccccc2)cc1 ZINC000012750912 571075859 /nfs/dbraw/zinc/07/58/59/571075859.db2.gz ASWMBYQABRPGKY-GHTZIAJQSA-N 1 1 362.473 3.972 50 0 FHAAMO C[C@H]1c2cccn2CC[N@@H+]1C[C@@H](O)COc1ccc(-c2ccccc2)cc1 ZINC000012750912 571075863 /nfs/dbraw/zinc/07/58/63/571075863.db2.gz ASWMBYQABRPGKY-GHTZIAJQSA-N 1 1 362.473 3.972 50 0 FHAAMO CCOC(=O)c1cc(C(C)C)sc1NC(=O)C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000012765163 571084051 /nfs/dbraw/zinc/08/40/51/571084051.db2.gz LDKPHILEGVYYTH-KBPBESRZSA-N 1 1 366.527 3.965 50 0 FHAAMO CCC[N@H+]1CCC[C@H](NC(=O)c2cccc(-c3ccccc3OC)c2)C1 ZINC000230485714 571095991 /nfs/dbraw/zinc/09/59/91/571095991.db2.gz JSFGREFYXIURDE-IBGZPJMESA-N 1 1 352.478 3.966 50 0 FHAAMO Clc1ccc(OCCN2CCN(CCCOc3ccccc3)CC2)cc1 ZINC000069385795 571097862 /nfs/dbraw/zinc/09/78/62/571097862.db2.gz AKFKHGYDTROHPR-UHFFFAOYSA-N 1 1 374.912 3.806 50 0 FHAAMO Clc1ccc(OCC[NH+]2CCN(CCCOc3ccccc3)CC2)cc1 ZINC000069385795 571097864 /nfs/dbraw/zinc/09/78/64/571097864.db2.gz AKFKHGYDTROHPR-UHFFFAOYSA-N 1 1 374.912 3.806 50 0 FHAAMO CCCn1c(Cn2cc[nH+]c2C)nc2cc(NC(=O)CC(C)C)ccc21 ZINC000015669133 571101367 /nfs/dbraw/zinc/10/13/67/571101367.db2.gz NJCVVMRKRPHYGD-UHFFFAOYSA-N 1 1 353.470 3.984 50 0 FHAAMO C[C@H]1C[N@H+](Cc2cccc(CNc3ncnc4c(F)cccc34)c2)CCO1 ZINC000241739106 571110287 /nfs/dbraw/zinc/11/02/87/571110287.db2.gz RAAJCXLMKUZWQN-HNNXBMFYSA-N 1 1 366.440 3.602 50 0 FHAAMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ncnc4c(F)cccc34)c2)CCO1 ZINC000241739106 571110288 /nfs/dbraw/zinc/11/02/88/571110288.db2.gz RAAJCXLMKUZWQN-HNNXBMFYSA-N 1 1 366.440 3.602 50 0 FHAAMO C[C@H]1C[C@@H](c2nc(-c3ccc(OCc4cccnc4)cc3)no2)CC[N@H+]1C ZINC000241684886 571110378 /nfs/dbraw/zinc/11/03/78/571110378.db2.gz QGCGHFHRJREPME-YJBOKZPZSA-N 1 1 364.449 3.908 50 0 FHAAMO C[N@@H+](CC(=O)[O-])[C@@H]1CCC[NH+](CCCc2cccc3ccccc32)CC1 ZINC000241776813 571110389 /nfs/dbraw/zinc/11/03/89/571110389.db2.gz RSVJPJLSNVIJPD-HXUWFJFHSA-N 1 1 354.494 3.643 50 0 FHAAMO C[NH+](CC(=O)[O-])[C@@H]1CCC[N@H+](CCCc2cccc3ccccc32)CC1 ZINC000241776813 571110394 /nfs/dbraw/zinc/11/03/94/571110394.db2.gz RSVJPJLSNVIJPD-HXUWFJFHSA-N 1 1 354.494 3.643 50 0 FHAAMO C[NH+](CC(=O)[O-])[C@@H]1CCC[N@@H+](CCCc2cccc3ccccc32)CC1 ZINC000241776813 571110397 /nfs/dbraw/zinc/11/03/97/571110397.db2.gz RSVJPJLSNVIJPD-HXUWFJFHSA-N 1 1 354.494 3.643 50 0 FHAAMO O=C(c1cc(C2CC2)on1)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000242339049 571111183 /nfs/dbraw/zinc/11/11/83/571111183.db2.gz ZELWIXISQVUZJQ-AZUAARDMSA-N 1 1 365.477 3.679 50 0 FHAAMO CCn1c2ccccc2c2cc(NC(=O)[C@H](C)[NH+]3CCC(O)CC3)ccc21 ZINC000033040080 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COc1ccccc1C[C@@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1F ZINC000244840268 571117845 /nfs/dbraw/zinc/11/78/45/571117845.db2.gz UKDQWBUUIZHSOQ-CYBMUJFWSA-N 1 1 364.848 3.989 50 0 FHAAMO c1cc(C[N@@H+](Cc2cc(-c3cccnc3)no2)C[C@@H]2CCCO2)cs1 ZINC000244853082 571117932 /nfs/dbraw/zinc/11/79/32/571117932.db2.gz VEVDDCZPSTUGHG-KRWDZBQOSA-N 1 1 355.463 3.979 50 0 FHAAMO c1cc(C[N@H+](Cc2cc(-c3cccnc3)no2)C[C@@H]2CCCO2)cs1 ZINC000244853082 571117935 /nfs/dbraw/zinc/11/79/35/571117935.db2.gz VEVDDCZPSTUGHG-KRWDZBQOSA-N 1 1 355.463 3.979 50 0 FHAAMO Cc1nccn1CC[C@@H]1CCCC[N@H+]1Cc1cc(C(N)=O)oc1C(C)(C)C ZINC000244873185 571118116 /nfs/dbraw/zinc/11/81/16/571118116.db2.gz WLIKDIOZOUGASG-KRWDZBQOSA-N 1 1 372.513 3.626 50 0 FHAAMO COc1ccc(C[N@H+]2CCC[C@@H](COc3ccc(C)cc3)C2)cc1CO ZINC000055252555 571118349 /nfs/dbraw/zinc/11/83/49/571118349.db2.gz PRRBQDBONOATIY-LJQANCHMSA-N 1 1 355.478 3.787 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)Nc1ccc(NC(=O)c2coc(C)c2)cc1 ZINC000055252972 571118404 /nfs/dbraw/zinc/11/84/04/571118404.db2.gz RJJZDLXSKJIMSC-UHFFFAOYSA-N 1 1 366.421 3.628 50 0 FHAAMO Cc1ccc(F)c(C(=O)N[C@H]2CCC[N@H+](Cc3cccnc3)C2)c1Cl ZINC000244899500 571119868 /nfs/dbraw/zinc/11/98/68/571119868.db2.gz ZKUSRWCFSCJAFQ-HNNXBMFYSA-N 1 1 361.848 3.577 50 0 FHAAMO Cc1ccc(F)c(C(=O)N[C@H]2CCC[N@@H+](Cc3cccnc3)C2)c1Cl ZINC000244899500 571119870 /nfs/dbraw/zinc/11/98/70/571119870.db2.gz ZKUSRWCFSCJAFQ-HNNXBMFYSA-N 1 1 361.848 3.577 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(COc2ccccc2)o1 ZINC000057997342 571123836 /nfs/dbraw/zinc/12/38/36/571123836.db2.gz FNVJUZRUUFHDNT-QGZVFWFLSA-N 1 1 356.466 3.853 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)Nc1cccnc1Oc1ccccc1)c1ccco1 ZINC000058014504 571124161 /nfs/dbraw/zinc/12/41/61/571124161.db2.gz SANGQHVSZCYNLX-QGZVFWFLSA-N 1 1 366.421 3.891 50 0 FHAAMO CC[NH+]1CCN(C(=O)c2cn(-c3ccccc3)nc2-c2ccc(C)cc2)CC1 ZINC000058148843 571125643 /nfs/dbraw/zinc/12/56/43/571125643.db2.gz SFKOQROVGRVWFI-UHFFFAOYSA-N 1 1 374.488 3.625 50 0 FHAAMO Cc1ccccc1C[N@H+]1CCN(Cc2ccccc2Cl)C[C@H]1CCO ZINC000104508915 571126208 /nfs/dbraw/zinc/12/62/08/571126208.db2.gz WDCFHXUGGFCMLO-HXUWFJFHSA-N 1 1 358.913 3.717 50 0 FHAAMO Cc1ccc(CN2CC[N@@H+](Cc3cc4ccccc4o3)C[C@H]2CCO)cc1 ZINC000104330286 571126245 /nfs/dbraw/zinc/12/62/45/571126245.db2.gz LECBLZCDJKUKLY-OAQYLSRUSA-N 1 1 364.489 3.810 50 0 FHAAMO Cc1ccc(C[N@@H+]2CCN(Cc3cc4ccccc4o3)C[C@H]2CCO)cc1 ZINC000104330286 571126250 /nfs/dbraw/zinc/12/62/50/571126250.db2.gz LECBLZCDJKUKLY-OAQYLSRUSA-N 1 1 364.489 3.810 50 0 FHAAMO Cc1ccc(C[N@H+]2CCN(Cc3cc4ccccc4o3)C[C@H]2CCO)cc1 ZINC000104330286 571126253 /nfs/dbraw/zinc/12/62/53/571126253.db2.gz LECBLZCDJKUKLY-OAQYLSRUSA-N 1 1 364.489 3.810 50 0 FHAAMO O=C(c1ccccc1SCc1cscn1)N1CCC[N@H+](C2CC2)CC1 ZINC000058167214 571126728 /nfs/dbraw/zinc/12/67/28/571126728.db2.gz XKLOVDPKBJAMNQ-UHFFFAOYSA-N 1 1 373.547 3.746 50 0 FHAAMO CCCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000248008358 571126908 /nfs/dbraw/zinc/12/69/08/571126908.db2.gz 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/nfs/dbraw/zinc/21/32/47/132213247.db2.gz UDSGMSSEWYLEGN-UHFFFAOYSA-N 1 1 373.551 3.600 50 0 FHAAMO C[C@@H]1C[C@@H](Nc2ccccc2N2CCC(O)CC2)C[N@H+]1Cc1ccccc1 ZINC000095997205 132216851 /nfs/dbraw/zinc/21/68/51/132216851.db2.gz GLCWBGLYXDCCKI-UYAOXDASSA-N 1 1 365.521 3.723 50 0 FHAAMO Cc1[nH]c2ccc(N3CCOCC3)cc2c(=O)c1C[N@H+](C)C1CCCCC1 ZINC000008717464 132260152 /nfs/dbraw/zinc/26/01/52/132260152.db2.gz ZPPANMOXRDWLLX-UHFFFAOYSA-N 1 1 369.509 3.850 50 0 FHAAMO Cc1cc(C)c2c(C[NH+]3CCN(c4ccccc4F)CC3)cc(=O)oc2c1 ZINC000054105978 132376144 /nfs/dbraw/zinc/37/61/44/132376144.db2.gz GEROCZZYBKECQS-UHFFFAOYSA-N 1 1 366.436 3.871 50 0 FHAAMO CCCNC(=O)c1cccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)c1 ZINC000034684591 136117948 /nfs/dbraw/zinc/11/79/48/136117948.db2.gz VZIVOEXNNMUWBN-UHFFFAOYSA-N 1 1 371.912 3.802 50 0 FHAAMO O=C(CC[NH+]1CCN(c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000052537673 136124363 /nfs/dbraw/zinc/12/43/63/136124363.db2.gz CNFHGQXRVXBRRD-UHFFFAOYSA-N 1 1 373.294 3.844 50 0 FHAAMO CCC[C@H]1CC[N@H+](C2CCN(c3cccc(N4CCN(C)C4=O)c3)CC2)C1 ZINC000063868889 136133032 /nfs/dbraw/zinc/13/30/32/136133032.db2.gz ORIIFVYIEXDAIA-SFHVURJKSA-N 1 1 370.541 3.649 50 0 FHAAMO O[C@H]1CCCN(c2ncccc2CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000067677146 136137409 /nfs/dbraw/zinc/13/74/09/136137409.db2.gz MUIBZCKOEZRZPD-INIZCTEOSA-N 1 1 368.868 3.856 50 0 FHAAMO COc1ccc2cc([C@H]3CN(c4[nH+]cnc5[nH]ccc54)CCO3)ccc2c1 ZINC000071746695 136140079 /nfs/dbraw/zinc/14/00/79/136140079.db2.gz JWEIBUHXJSZNPS-LJQANCHMSA-N 1 1 360.417 3.698 50 0 FHAAMO c1cnc(N2CCC3(CCC[N@@H+]3Cc3ccc4ccccc4n3)CC2)nc1 ZINC000072424359 136146253 /nfs/dbraw/zinc/14/62/53/136146253.db2.gz QTTVZGGTZBQIEE-UHFFFAOYSA-N 1 1 359.477 3.660 50 0 FHAAMO CC[NH+]1CCN(c2c(Cl)cccc2NC(=O)c2cccc(OC)c2)CC1 ZINC000006570022 136151850 /nfs/dbraw/zinc/15/18/50/136151850.db2.gz PBVQGPYETYAGMI-UHFFFAOYSA-N 1 1 373.884 3.743 50 0 FHAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1)C(=O)c1ccc[nH]1 ZINC000095527981 209077882 /nfs/dbraw/zinc/07/78/82/209077882.db2.gz QIAXELYXWYTVEW-QGZVFWFLSA-N 1 1 359.901 3.695 50 0 FHAAMO Cc1ccccc1CC[NH+]1CCC(C[N@@H+](CC(=O)[O-])C2CCCC2)CC1 ZINC000095527677 209077962 /nfs/dbraw/zinc/07/79/62/209077962.db2.gz JLZULVWCQQCWIB-UHFFFAOYSA-N 1 1 358.526 3.579 50 0 FHAAMO CC(C)c1nnc(N2CCC(c3[nH+]ccn3Cc3ccncc3)CC2)s1 ZINC000095531567 209078816 /nfs/dbraw/zinc/07/88/16/209078816.db2.gz HOFXQHZAVLZGKR-UHFFFAOYSA-N 1 1 368.510 3.685 50 0 FHAAMO CCCc1ccc(-c2n[nH]c3c2C[N@H+](Cc2cnn4cccnc24)CC3)cc1 ZINC000020818938 263382612 /nfs/dbraw/zinc/38/26/12/263382612.db2.gz AGJALUZMBLCQJW-UHFFFAOYSA-N 1 1 372.476 3.630 50 0 FHAAMO CCCc1ccc(-c2n[nH]c3c2C[N@@H+](Cc2cnn4cccnc24)CC3)cc1 ZINC000020818938 263382614 /nfs/dbraw/zinc/38/26/14/263382614.db2.gz AGJALUZMBLCQJW-UHFFFAOYSA-N 1 1 372.476 3.630 50 0 FHAAMO Cc1[nH+]ccn1CC[C@@H]1CCCCN1C(=O)Nc1ccc2[nH]c(=O)oc2c1 ZINC000426370186 263567280 /nfs/dbraw/zinc/56/72/80/263567280.db2.gz AVLXFYFONFQQRC-HNNXBMFYSA-N 1 1 369.425 3.515 50 0 FHAAMO CC[N@H+]1CCC[C@H](CNC(=O)N(Cc2c(F)cccc2Cl)C2CC2)C1 ZINC000426533713 263623511 /nfs/dbraw/zinc/62/35/11/263623511.db2.gz DENQAXKZSXISKF-CQSZACIVSA-N 1 1 367.896 3.885 50 0 FHAAMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 ZINC000019853917 518372151 /nfs/dbraw/zinc/37/21/51/518372151.db2.gz QAMVWSTVXMMZHU-QQRRWSATSA-N 1 1 361.533 3.986 50 0 FHAAMO C(=C/c1ccccc1)\CN1CCC[C@@H]([NH+]2CCN(c3ccccc3)CC2)C1 ZINC000019853917 518372154 /nfs/dbraw/zinc/37/21/54/518372154.db2.gz QAMVWSTVXMMZHU-QQRRWSATSA-N 1 1 361.533 3.986 50 0 FHAAMO CCC[N@H+]1CCCn2nc(CNc3cc(C(F)(F)F)ccn3)cc2C1 ZINC000082083536 519855273 /nfs/dbraw/zinc/85/52/73/519855273.db2.gz UAFHZLRKCPEPBG-UHFFFAOYSA-N 1 1 353.392 3.525 50 0 FHAAMO CCCOc1ccc([C@@H](O)[C@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000020790174 520420236 /nfs/dbraw/zinc/42/02/36/520420236.db2.gz TVWLDXUMIAMJBJ-FGZHOGPDSA-N 1 1 355.478 3.625 50 0 FHAAMO CC[C@@H](C)[C@@H]([NH3+])C(=O)Oc1ccc2c(c1)occ(-c1csc(C)n1)c2=O ZINC000020111164 522305956 /nfs/dbraw/zinc/30/59/56/522305956.db2.gz SQZMXPOAPPQOMP-BMLIUANNSA-N 1 1 372.446 3.504 50 0 FHAAMO COc1ccc(/C=C/C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2cscn2)C3)cc1 ZINC000091626409 523405041 /nfs/dbraw/zinc/40/50/41/523405041.db2.gz ACCBDZNFPODVDI-QMUYELLFSA-N 1 1 369.534 3.761 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccc4nonc4c3)C2)c(C)c1 ZINC000084460293 523776383 /nfs/dbraw/zinc/77/63/83/523776383.db2.gz LZVSSDAFJLVGJS-MRXNPFEDSA-N 1 1 365.433 3.635 50 0 FHAAMO C[C@H](C[N@H+](C)Cc1nnc(SCc2ccncc2)n1C)c1ccccc1 ZINC000020784361 524301079 /nfs/dbraw/zinc/30/10/79/524301079.db2.gz BREMKTRAKGNILY-MRXNPFEDSA-N 1 1 367.522 3.738 50 0 FHAAMO C[C@H](C[N@@H+](C)Cc1nnc(SCc2ccncc2)n1C)c1ccccc1 ZINC000020784361 524301085 /nfs/dbraw/zinc/30/10/85/524301085.db2.gz BREMKTRAKGNILY-MRXNPFEDSA-N 1 1 367.522 3.738 50 0 FHAAMO C[C@@H]1CCC[C@H](OCC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000252666187 524412190 /nfs/dbraw/zinc/41/21/90/524412190.db2.gz ASHCZBLTJLUGOC-ZFMNYDKASA-N 1 1 358.526 3.751 50 0 FHAAMO C[C@H]1C[NH+](CCOCCOc2ccccc2-c2ccccc2)C[C@H](C)O1 ZINC000020167809 524600338 /nfs/dbraw/zinc/60/03/38/524600338.db2.gz MEXFMTUUBLFXRD-OALUTQOASA-N 1 1 355.478 3.858 50 0 FHAAMO COc1ccc(OC)c(CN2CC[N@H+]3CCC[C@@H]3[C@H]2C2CCCCC2)c1 ZINC000239432917 524826561 /nfs/dbraw/zinc/82/65/61/524826561.db2.gz WWUIJHJNWLBGLM-IFMALSPDSA-N 1 1 358.526 3.933 50 0 FHAAMO Cc1ccccc1C(=O)NCc1cc2n(n1)CCC[N@H+](C1CCCCC1)C2 ZINC000082109958 525056305 /nfs/dbraw/zinc/05/63/05/525056305.db2.gz SSVQEESEDITWLD-UHFFFAOYSA-N 1 1 366.509 3.660 50 0 FHAAMO Cc1c(C)n(C(=O)CN2CC[NH+](Cc3ccccc3)CC2)c2ccccc12 ZINC000019899424 525679957 /nfs/dbraw/zinc/67/99/57/525679957.db2.gz UNOQLULPJPYZPZ-UHFFFAOYSA-N 1 1 361.489 3.716 50 0 FHAAMO COc1cccc(NC(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000252444522 526192370 /nfs/dbraw/zinc/19/23/70/526192370.db2.gz RVMYKIPAAHCWTF-AZUAARDMSA-N 1 1 351.450 3.843 50 0 FHAAMO O=C(NCc1cccc(F)c1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000091643546 526718067 /nfs/dbraw/zinc/71/80/67/526718067.db2.gz OVGURBWOERILBR-PZJWPPBQSA-N 1 1 367.468 3.632 50 0 FHAAMO O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cnoc1-c1ccc(Cl)cc1 ZINC000089793798 527046541 /nfs/dbraw/zinc/04/65/41/527046541.db2.gz DKGCGXBFFBGLHR-KRWDZBQOSA-N 1 1 373.884 3.989 50 0 FHAAMO COc1cc(OC)c(OC)cc1C[NH+]1CCN(c2cccc(C)c2C)CC1 ZINC000001227204 536866384 /nfs/dbraw/zinc/86/63/84/536866384.db2.gz VFPAODZSTHUTML-UHFFFAOYSA-N 1 1 370.493 3.651 50 0 FHAAMO c1cnn(Cc2ccc(C[N@@H+](Cc3ccccn3)C[C@@H]3CCCO3)cc2)c1 ZINC000215013307 568041487 /nfs/dbraw/zinc/04/14/87/568041487.db2.gz OOOQVAFYIYZBNW-QFIPXVFZSA-N 1 1 362.477 3.508 50 0 FHAAMO CC[C@H](C)Sc1ncc(CN(C)Cc2ccc3c(c2)C[N@H+](C)C3)cn1 ZINC000215025741 568043012 /nfs/dbraw/zinc/04/30/12/568043012.db2.gz ZMMNYTCFQZAYMK-HNNXBMFYSA-N 1 1 356.539 3.945 50 0 FHAAMO Cc1[nH+]ccn1CC[C@@H](NC(=O)CCc1cccc(O)c1)c1ccccc1 ZINC000215057038 568047232 /nfs/dbraw/zinc/04/72/32/568047232.db2.gz YWXWPHYXXJEMMG-OAQYLSRUSA-N 1 1 363.461 3.778 50 0 FHAAMO CCOc1ccc(-c2ccc(C[NH+]3CCC(c4nc[nH]n4)CC3)o2)cc1 ZINC000215187920 568056696 /nfs/dbraw/zinc/05/66/96/568056696.db2.gz FOHSUWBDIQKEGP-UHFFFAOYSA-N 1 1 352.438 3.843 50 0 FHAAMO CCCc1nc(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)cs1 ZINC000215275279 568061400 /nfs/dbraw/zinc/06/14/00/568061400.db2.gz YJDALVIEHARPQL-UHFFFAOYSA-N 1 1 357.523 3.662 50 0 FHAAMO c1csc(-c2ncc(C[N@@H+]3CCc4nc(-c5cccnc5)[nH]c4C3)cn2)c1 ZINC000215396839 568068055 /nfs/dbraw/zinc/06/80/55/568068055.db2.gz GXCHEQWZELLGRP-UHFFFAOYSA-N 1 1 374.473 3.549 50 0 FHAAMO c1csc(-c2ncc(C[N@H+]3CCc4nc(-c5cccnc5)[nH]c4C3)cn2)c1 ZINC000215396839 568068056 /nfs/dbraw/zinc/06/80/56/568068056.db2.gz GXCHEQWZELLGRP-UHFFFAOYSA-N 1 1 374.473 3.549 50 0 FHAAMO COc1cc2c(cc1C[N@@H+](C)Cc1cccc3cnccc31)OCCO2 ZINC000215487547 568073160 /nfs/dbraw/zinc/07/31/60/568073160.db2.gz IXUWIOCDVVAMNG-UHFFFAOYSA-N 1 1 350.418 3.647 50 0 FHAAMO C[N@@H+](Cc1ccc(S(C)(=O)=O)cc1)C[C@@]1(c2ccccc2)CC1(C)C ZINC000215499067 568073841 /nfs/dbraw/zinc/07/38/41/568073841.db2.gz ILTJXQVKCVMSOW-OAQYLSRUSA-N 1 1 357.519 3.890 50 0 FHAAMO Cc1c(C[N@H+]2CCCC[C@H]2c2ccccn2)c(=O)n(-c2ccccc2)n1C ZINC000215681962 568083480 /nfs/dbraw/zinc/08/34/80/568083480.db2.gz BHPXVORJCWMNJE-NRFANRHFSA-N 1 1 362.477 3.607 50 0 FHAAMO CC(C)c1noc([C@@H]2CCC[N@@H+](Cc3cccc(Cn4cccn4)c3)C2)n1 ZINC000215714265 568085106 /nfs/dbraw/zinc/08/51/06/568085106.db2.gz MQQSDWLCSNPCEJ-LJQANCHMSA-N 1 1 365.481 3.817 50 0 FHAAMO CN1CCN(C[C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4F)o3)C2)CC1 ZINC000215824855 568090896 /nfs/dbraw/zinc/09/08/96/568090896.db2.gz YGFLCSKAJQYORB-GOSISDBHSA-N 1 1 371.500 3.545 50 0 FHAAMO CN1CCN(C[C@H]2CCC[N@@H+](Cc3ccc(-c4ccccc4F)o3)C2)CC1 ZINC000215824855 568090897 /nfs/dbraw/zinc/09/08/97/568090897.db2.gz YGFLCSKAJQYORB-GOSISDBHSA-N 1 1 371.500 3.545 50 0 FHAAMO COc1cccc(-c2ccc(C(=O)N(C)C[C@@H]3CCCC[N@H+]3C)cc2)c1 ZINC000215855085 568092657 /nfs/dbraw/zinc/09/26/57/568092657.db2.gz VETSPNYBYBOKKY-FQEVSTJZSA-N 1 1 352.478 3.919 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)NCCc1c(C)[nH]c2ccc(Cl)cc21 ZINC000216052506 568102780 /nfs/dbraw/zinc/10/27/80/568102780.db2.gz QSAOYKKQSIWFRL-UHFFFAOYSA-N 1 1 358.873 3.638 50 0 FHAAMO CCn1ccc2c1cccc2C[N@@H+]1CCCC[C@H]1c1nc(CCOC)no1 ZINC000216252327 568114830 /nfs/dbraw/zinc/11/48/30/568114830.db2.gz IHUOIIHTFUNHGM-IBGZPJMESA-N 1 1 368.481 3.960 50 0 FHAAMO CCn1ccc2c1cccc2C[N@H+]1CCCC[C@H]1c1nc(CCOC)no1 ZINC000216252327 568114831 /nfs/dbraw/zinc/11/48/31/568114831.db2.gz IHUOIIHTFUNHGM-IBGZPJMESA-N 1 1 368.481 3.960 50 0 FHAAMO C[N@H+](Cc1cnc(N2CCCC2)s1)Cc1c[nH]nc1-c1ccccc1 ZINC000216337825 568118524 /nfs/dbraw/zinc/11/85/24/568118524.db2.gz ZQCDGORVBJHBNE-UHFFFAOYSA-N 1 1 353.495 3.765 50 0 FHAAMO C[N@@H+](Cc1cnc(N2CCCC2)s1)Cc1c[nH]nc1-c1ccccc1 ZINC000216337825 568118525 /nfs/dbraw/zinc/11/85/25/568118525.db2.gz ZQCDGORVBJHBNE-UHFFFAOYSA-N 1 1 353.495 3.765 50 0 FHAAMO CC(C)c1noc(C2CC[NH+](Cc3cnn(-c4cccc(F)c4)c3)CC2)n1 ZINC000216346437 568118991 /nfs/dbraw/zinc/11/89/91/568118991.db2.gz DCJYRCHGABSSIS-UHFFFAOYSA-N 1 1 369.444 3.897 50 0 FHAAMO COc1ccc(C[N@@H+](CC(=O)NCC(C)C)[C@H](C)Cc2cccs2)cc1 ZINC000024892320 568229311 /nfs/dbraw/zinc/22/93/11/568229311.db2.gz HNTLBVTZGHBHGD-QGZVFWFLSA-N 1 1 374.550 3.962 50 0 FHAAMO CC1=C(CCN2CCCn3nc([C@@H](O)C[NH+](C)C)cc3C2)C(C)(C)CCC1 ZINC000221421491 568405235 /nfs/dbraw/zinc/40/52/35/568405235.db2.gz CXCWXOHVZDJGEP-NRFANRHFSA-N 1 1 374.573 3.601 50 0 FHAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2ccc(Br)s2)C1 ZINC000000755594 570454962 /nfs/dbraw/zinc/45/49/62/570454962.db2.gz MLTSPDZUHQCLEW-LBPRGKRZSA-N 1 1 359.333 3.591 50 0 FHAAMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc2c(cccc2F)[nH]1 ZINC000072303673 570496921 /nfs/dbraw/zinc/49/69/21/570496921.db2.gz RTHQYSIIOPNOCR-KRWDZBQOSA-N 1 1 365.452 3.901 50 0 FHAAMO CCCC[N@@H+](C)CC(=O)Nc1sc2c(c1C(=O)OCC)CC[C@H](C)C2 ZINC000001778606 570507485 /nfs/dbraw/zinc/50/74/85/570507485.db2.gz GVZRYPSKCNYXLI-ZDUSSCGKSA-N 1 1 366.527 3.720 50 0 FHAAMO C[C@@H]1C[N@@H+](CCC(=O)c2ccc3c(c2)OCCO3)C[C@@H]1c1ccccc1 ZINC000004122134 570577208 /nfs/dbraw/zinc/57/72/08/570577208.db2.gz ZQDSJXICMNDKBG-APWZRJJASA-N 1 1 351.446 3.766 50 0 FHAAMO CCNC(=O)CC[N@@H+]1CC[C@@]2(C1)CCCN(Cc1ccc(C(C)C)cc1)C2 ZINC000426503257 570613297 /nfs/dbraw/zinc/61/32/97/570613297.db2.gz KCEYOHUGQZEISM-HSZRJFAPSA-N 1 1 371.569 3.624 50 0 FHAAMO CCNC(=O)CC[N@H+]1CC[C@@]2(C1)CCCN(Cc1ccc(C(C)C)cc1)C2 ZINC000426503257 570613301 /nfs/dbraw/zinc/61/33/01/570613301.db2.gz KCEYOHUGQZEISM-HSZRJFAPSA-N 1 1 371.569 3.624 50 0 FHAAMO COc1cc(C[NH+]2CCN(c3cc(C)ccc3C)CC2)cc(OC)c1OC ZINC000004980799 570615582 /nfs/dbraw/zinc/61/55/82/570615582.db2.gz DMYVGMUHQFOVKJ-UHFFFAOYSA-N 1 1 370.493 3.651 50 0 FHAAMO C[C@H](c1ccccc1)[N@H+](CC(N)=O)Cc1ccc(OCC(F)(F)F)cc1 ZINC000079098186 570634115 /nfs/dbraw/zinc/63/41/15/570634115.db2.gz XQQPDXASCJHMLX-CQSZACIVSA-N 1 1 366.383 3.676 50 0 FHAAMO C[C@H](c1ccccc1)[N@@H+](CC(N)=O)Cc1ccc(OCC(F)(F)F)cc1 ZINC000079098186 570634116 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Cc1[nH+]c2cc(Nc3ncnc4c3cnn4C)ccc2n1-c1ccccc1 ZINC000012628532 570754242 /nfs/dbraw/zinc/75/42/42/570754242.db2.gz SQSWWVDWICLXQK-UHFFFAOYSA-N 1 1 355.405 3.754 50 0 FHAAMO Fc1ccccc1-c1cnnc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000012710267 570757991 /nfs/dbraw/zinc/75/79/91/570757991.db2.gz BNLCNHUENRNQBW-KRWDZBQOSA-N 1 1 363.440 3.754 50 0 FHAAMO Cc1ccc(C)c(NC(=O)C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1 ZINC000012973481 570769270 /nfs/dbraw/zinc/76/92/70/570769270.db2.gz GTCHZOWSXSSIQI-SFHVURJKSA-N 1 1 365.477 3.593 50 0 FHAAMO Cc1ccc(C)c(NC(=O)C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1 ZINC000012973481 570769272 /nfs/dbraw/zinc/76/92/72/570769272.db2.gz GTCHZOWSXSSIQI-SFHVURJKSA-N 1 1 365.477 3.593 50 0 FHAAMO CC(=O)Nc1ccc([C@H]2C[N@@H+](C)C[C@H]2C(=O)c2ccc(Cl)cc2)cc1 ZINC000013144341 570774577 /nfs/dbraw/zinc/77/45/77/570774577.db2.gz XGHOWVUWSUQUJX-RTBURBONSA-N 1 1 356.853 3.827 50 0 FHAAMO COCCCC1CC[NH+](Cc2nc(Cc3ccccc3Cl)no2)CC1 ZINC000013594732 570780528 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Cc1cc(C)n(-c2ccc(C(=O)N3CC[N@@H+](C)C[C@H]3c3ccccc3)cc2)n1 ZINC000014183066 570810456 /nfs/dbraw/zinc/81/04/56/570810456.db2.gz BCRXZTVKJNVUGY-QFIPXVFZSA-N 1 1 374.488 3.618 50 0 FHAAMO Cc1cc(C)n(-c2ccc(C(=O)N3CC[N@H+](C)C[C@H]3c3ccccc3)cc2)n1 ZINC000014183066 570810458 /nfs/dbraw/zinc/81/04/58/570810458.db2.gz BCRXZTVKJNVUGY-QFIPXVFZSA-N 1 1 374.488 3.618 50 0 FHAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)C1CCCC1 ZINC000014967789 570827458 /nfs/dbraw/zinc/82/74/58/570827458.db2.gz GCHUZGIGOIRLLI-HXUWFJFHSA-N 1 1 372.553 3.988 50 0 FHAAMO CCOC(=O)[C@]1(Cc2ccccc2)CCC[N@@H+](Cc2ccc(COC)o2)C1 ZINC000015075228 570832017 /nfs/dbraw/zinc/83/20/17/570832017.db2.gz GNFYXTSIZKKDNS-QFIPXVFZSA-N 1 1 371.477 3.814 50 0 FHAAMO Cn1cc(C[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)c(-c2ccccc2)n1 ZINC000179623968 570849542 /nfs/dbraw/zinc/84/95/42/570849542.db2.gz ZBPWCAYNWYXKFA-SFHVURJKSA-N 1 1 372.476 3.509 50 0 FHAAMO C[C@H](c1ccc(F)cc1)[N@H+](C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C ZINC000103985543 570855695 /nfs/dbraw/zinc/85/56/95/570855695.db2.gz DGIKYGAJVRAVDP-HUUCEWRRSA-N 1 1 369.440 3.582 50 0 FHAAMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C ZINC000103985543 570855699 /nfs/dbraw/zinc/85/56/99/570855699.db2.gz DGIKYGAJVRAVDP-HUUCEWRRSA-N 1 1 369.440 3.582 50 0 FHAAMO CCn1c(C[NH+]2CCCCC2)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000016647833 570859539 /nfs/dbraw/zinc/85/95/39/570859539.db2.gz SDXNAJAKHLAJGM-UHFFFAOYSA-N 1 1 352.438 3.887 50 0 FHAAMO Cc1cccc(C[N@@H+](C[C@@H](O)COCc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000104973066 570865855 /nfs/dbraw/zinc/86/58/55/570865855.db2.gz KTLXZYAIABAAHU-PKTZIBPZSA-N 1 1 369.505 3.554 50 0 FHAAMO COc1ccccc1CC(=O)NCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000032930262 570869930 /nfs/dbraw/zinc/86/99/30/570869930.db2.gz POPWQFVBTSIXJW-SFHVURJKSA-N 1 1 366.505 3.929 50 0 FHAAMO CCOC(=O)Nc1ccc2c(c1)N(C(=O)C[NH+](C)C)c1ccccc1CC2 ZINC000000538471 570873083 /nfs/dbraw/zinc/87/30/83/570873083.db2.gz KJAMZCVTJDTESW-UHFFFAOYSA-N 1 1 367.449 3.580 50 0 biogenic,world FHAAMO OCC[C@@H]1CN(Cc2c[nH]c3ccccc23)CC[N@H+]1CC1CCCCC1 ZINC000019229547 570883089 /nfs/dbraw/zinc/88/30/89/570883089.db2.gz KQLLRNKLXUIJKP-HXUWFJFHSA-N 1 1 355.526 3.617 50 0 FHAAMO CCC[N@@H+]1CCc2c(sc3nc(SC)n(-c4ccccc4)c(=O)c32)C1 ZINC000019707834 570899054 /nfs/dbraw/zinc/89/90/54/570899054.db2.gz OCYSDKAEANCQCE-UHFFFAOYSA-N 1 1 371.531 3.937 50 0 FHAAMO CCC[N@H+]1CCc2c(sc3nc(SC)n(-c4ccccc4)c(=O)c32)C1 ZINC000019707834 570899055 /nfs/dbraw/zinc/89/90/55/570899055.db2.gz OCYSDKAEANCQCE-UHFFFAOYSA-N 1 1 371.531 3.937 50 0 FHAAMO CCC[N@@H+]1CCc2c(sc3ncn4nc(-c5ccc(F)cc5)nc4c23)C1 ZINC000020548262 570919710 /nfs/dbraw/zinc/91/97/10/570919710.db2.gz KGQZFWGNEWGYAJ-UHFFFAOYSA-N 1 1 367.453 3.913 50 0 FHAAMO CCC[N@H+]1CCc2c(sc3ncn4nc(-c5ccc(F)cc5)nc4c23)C1 ZINC000020548262 570919714 /nfs/dbraw/zinc/91/97/14/570919714.db2.gz KGQZFWGNEWGYAJ-UHFFFAOYSA-N 1 1 367.453 3.913 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCNc1ncnc2onc(-c3ccc(F)cc3)c21 ZINC000020574493 570920433 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50 0 FHAAMO C[C@@H](c1nnc(-c2cccs2)o1)N1CC[NH+](Cc2cccs2)CC1 ZINC000022803736 570949944 /nfs/dbraw/zinc/94/99/44/570949944.db2.gz UQXFSFVSNLRKOV-ZDUSSCGKSA-N 1 1 360.508 3.738 50 0 FHAAMO CCCc1ncc(CN(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)cn1 ZINC000022852433 570951627 /nfs/dbraw/zinc/95/16/27/570951627.db2.gz JQEORYDMNVIEMT-NRFANRHFSA-N 1 1 352.526 3.568 50 0 FHAAMO CN(C)c1ncc(CN(C)[C@H]2CCC[N@@H+](CCCc3ccccc3)C2)s1 ZINC000022852422 570951799 /nfs/dbraw/zinc/95/17/99/570951799.db2.gz BAWBOKJCKKKAMT-IBGZPJMESA-N 1 1 372.582 3.738 50 0 FHAAMO O=C(CC[NH+]1CCN(Cc2cccs2)CC1)Nc1cccc(Cl)c1 ZINC000022933300 570953244 /nfs/dbraw/zinc/95/32/44/570953244.db2.gz RHCYMSZDQOEHTQ-UHFFFAOYSA-N 1 1 363.914 3.548 50 0 FHAAMO CC[N@@H+]1CCC[C@@H]1CNCc1ccc(OCc2ccccc2)c(OC)c1 ZINC000022935995 570953795 /nfs/dbraw/zinc/95/37/95/570953795.db2.gz YQQSSHJWCKOONX-HXUWFJFHSA-N 1 1 354.494 3.848 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNCc1ccc(OCc2ccccc2)c(OC)c1 ZINC000022935995 570953796 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3.579 50 0 FHAAMO C[C@@H](C(=O)N(C)C)[N@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067819974 571150031 /nfs/dbraw/zinc/15/00/31/571150031.db2.gz DKMRMNUHITVOFP-INIZCTEOSA-N 1 1 374.488 3.579 50 0 FHAAMO Cc1nccc(NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)n1 ZINC000067856132 571150520 /nfs/dbraw/zinc/15/05/20/571150520.db2.gz AGKPGUCBKMHVIF-UHFFFAOYSA-N 1 1 360.396 3.988 50 0 FHAAMO Nc1cc(N2CCc3onc(-c4ccc(-c5ccccc5)cc4)c3C2)nc[nH+]1 ZINC000067869297 571150733 /nfs/dbraw/zinc/15/07/33/571150733.db2.gz SVQSYAQCNIFMGP-UHFFFAOYSA-N 1 1 369.428 3.944 50 0 FHAAMO CCc1[nH]c(CN2CCc3nc[nH]c3[C@H]2c2cc3ccccc3[nH]2)c(C)[nH+]1 ZINC000067886576 571151240 /nfs/dbraw/zinc/15/12/40/571151240.db2.gz UCBNKAKEMLXPEJ-OAQYLSRUSA-N 1 1 360.465 3.633 50 0 FHAAMO C[N@@H+](Cc1ccsc1)C[C@]1(O)CCCN(CCC2CCCCC2)C1=O ZINC000067947456 571152170 /nfs/dbraw/zinc/15/21/70/571152170.db2.gz PYAKUELXIFZJEU-HXUWFJFHSA-N 1 1 364.555 3.504 50 0 FHAAMO CC(C)CN(C)C(=O)c1cc(C[NH+]2CCC(Cc3ccccc3)CC2)on1 ZINC000067975133 571152701 /nfs/dbraw/zinc/15/27/01/571152701.db2.gz PGQBARXEYKICQX-UHFFFAOYSA-N 1 1 369.509 3.857 50 0 FHAAMO CCCCc1ncc(C[N@@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)[nH]1 ZINC000071419074 571161339 /nfs/dbraw/zinc/16/13/39/571161339.db2.gz VBYKRDWDJSHXPZ-FQEVSTJZSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1ncc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)[nH]1 ZINC000071419074 571161340 /nfs/dbraw/zinc/16/13/40/571161340.db2.gz VBYKRDWDJSHXPZ-FQEVSTJZSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1nc(C[N@@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)c[nH]1 ZINC000071419074 571161342 /nfs/dbraw/zinc/16/13/42/571161342.db2.gz VBYKRDWDJSHXPZ-FQEVSTJZSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1nc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)c[nH]1 ZINC000071419074 571161344 /nfs/dbraw/zinc/16/13/44/571161344.db2.gz VBYKRDWDJSHXPZ-FQEVSTJZSA-N 1 1 368.525 3.765 50 0 FHAAMO COc1cc(CN2CCC[N@@H+](CC3CC3)[C@@H](C(C)C)C2)cc(Cl)c1O ZINC000071497691 571162715 /nfs/dbraw/zinc/16/27/15/571162715.db2.gz QNRYRPNPKWPOFH-GOSISDBHSA-N 1 1 366.933 3.997 50 0 FHAAMO CC(C)[C@@H]1C[N@@H+](Cc2cccc(O)c2)CCC(=O)N1Cc1ccc(F)cc1 ZINC000071721418 571163817 /nfs/dbraw/zinc/16/38/17/571163817.db2.gz DCRDUSBZBFZHBZ-NRFANRHFSA-N 1 1 370.468 3.790 50 0 FHAAMO C[C@@H]1CCC[N@H+]1Cc1c(C(=O)N(C)Cc2ccccc2)nc2ccccn21 ZINC000071745945 571164340 /nfs/dbraw/zinc/16/43/40/571164340.db2.gz RNOYQCLNFYGCEG-QGZVFWFLSA-N 1 1 362.477 3.591 50 0 FHAAMO Cn1ncc(C[N@@H+]2CCO[C@@H](Cc3cccc4ccccc43)C2)c1C1CC1 ZINC000071748110 571164691 /nfs/dbraw/zinc/16/46/91/571164691.db2.gz GCJJMISDXIPZKU-NRFANRHFSA-N 1 1 361.489 3.894 50 0 FHAAMO Cn1ncc(C[N@H+]2CCO[C@@H](Cc3cccc4ccccc43)C2)c1C1CC1 ZINC000071748110 571164694 /nfs/dbraw/zinc/16/46/94/571164694.db2.gz GCJJMISDXIPZKU-NRFANRHFSA-N 1 1 361.489 3.894 50 0 FHAAMO COc1ccnc(CN2CCC[N@@H+](Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1 ZINC000071776374 571166548 /nfs/dbraw/zinc/16/65/48/571166548.db2.gz SVTUKWAVMGNGCK-JOCHJYFZSA-N 1 1 371.500 3.962 50 0 FHAAMO COc1ccnc(C[N@@H+]2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1 ZINC000071776374 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FHAAMO c1cnn(Cc2cccc(C[N@@H+]3CCC[C@@H](OCc4cccnc4)C3)c2)c1 ZINC000072158169 571175367 /nfs/dbraw/zinc/17/53/67/571175367.db2.gz KVZIZXGLFQRAOO-JOCHJYFZSA-N 1 1 362.477 3.508 50 0 FHAAMO Fc1ccc(N2CCC[N@@H+](Cc3cnc(-c4ccco4)nc3)CC2)cc1 ZINC000072159217 571175618 /nfs/dbraw/zinc/17/56/18/571175618.db2.gz ZLEIVAHIIOFXSB-UHFFFAOYSA-N 1 1 352.413 3.588 50 0 FHAAMO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)c(F)c1 ZINC000072161191 571175691 /nfs/dbraw/zinc/17/56/91/571175691.db2.gz UIRXNLWLIYVJKX-MDNUFGMLSA-N 1 1 366.480 3.902 50 0 FHAAMO Cc1ccc(CN2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CC[NH+]3CC2)c(F)c1 ZINC000072161191 571175692 /nfs/dbraw/zinc/17/56/92/571175692.db2.gz UIRXNLWLIYVJKX-MDNUFGMLSA-N 1 1 366.480 3.902 50 0 FHAAMO Oc1cccc([C@@H]2C[N@@H+](C/C=C/c3ccccc3)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000072161737 571175788 /nfs/dbraw/zinc/17/57/88/571175788.db2.gz LSTMYYMIBBKPBG-DDAQEBKQSA-N 1 1 360.501 3.968 50 0 FHAAMO Oc1cccc([C@@H]2CN(C/C=C/c3ccccc3)[C@H]3[C@@H]2[NH+]2CCC3CC2)c1 ZINC000072161737 571175791 /nfs/dbraw/zinc/17/57/91/571175791.db2.gz LSTMYYMIBBKPBG-DDAQEBKQSA-N 1 1 360.501 3.968 50 0 FHAAMO c1nc(-c2ccccc2)sc1C[N@@H+]1CCCN(Cc2ccncc2)CC1 ZINC000072164722 571176458 /nfs/dbraw/zinc/17/64/58/571176458.db2.gz PPVAXAPGCUPRSG-UHFFFAOYSA-N 1 1 364.518 3.913 50 0 FHAAMO c1ccc2[nH]c(C[C@@H]3CCC[N@@H+](Cc4cccc5nccnc45)C3)nc2c1 ZINC000072168796 571177452 /nfs/dbraw/zinc/17/74/52/571177452.db2.gz LIDILUUWTVWVBW-INIZCTEOSA-N 1 1 357.461 3.961 50 0 FHAAMO CC(=O)Nc1cccc(NC(=O)C[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC000012598865 571188551 /nfs/dbraw/zinc/18/85/51/571188551.db2.gz RMVIPALQFGGLQU-UHFFFAOYSA-N 1 1 365.477 3.538 50 0 FHAAMO C[C@H](CCc1ccccc1)NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000013023475 571189871 /nfs/dbraw/zinc/18/98/71/571189871.db2.gz XQVPHKYEWSZJAI-LJQANCHMSA-N 1 1 351.494 3.535 50 0 FHAAMO Cc1oc(-c2cccc(C(F)(F)F)c2)nc1CN1CC[N@H+]2CCC[C@@H]2C1 ZINC000072406798 571191168 /nfs/dbraw/zinc/19/11/68/571191168.db2.gz FAUPVSZSEWOXGC-MRXNPFEDSA-N 1 1 365.399 3.949 50 0 FHAAMO CCCn1cc(-c2ccncc2)cc1C(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000075509136 571191766 /nfs/dbraw/zinc/19/17/66/571191766.db2.gz SZMOCEPERXTMFY-QGZVFWFLSA-N 1 1 354.498 3.564 50 0 FHAAMO CSc1ccc(NC(=O)N[C@@H]2CCC[N@H+](Cc3cccnc3)C2)cc1 ZINC000299761397 571193437 /nfs/dbraw/zinc/19/34/37/571193437.db2.gz KYOJYNGLILOIDB-QGZVFWFLSA-N 1 1 356.495 3.590 50 0 FHAAMO CSc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1 ZINC000299761397 571193438 /nfs/dbraw/zinc/19/34/38/571193438.db2.gz KYOJYNGLILOIDB-QGZVFWFLSA-N 1 1 356.495 3.590 50 0 FHAAMO CC(C)=CCC/C(C)=C/C[N@@H+]1CCn2nc(CNc3cnccn3)cc2C1 ZINC000299765146 571194610 /nfs/dbraw/zinc/19/46/10/571194610.db2.gz XAXRLMHPXPKSLL-CNHKJKLMSA-N 1 1 366.513 3.794 50 0 FHAAMO CC(C)=CCC/C(C)=C/C[N@H+]1CCn2nc(CNc3cnccn3)cc2C1 ZINC000299765146 571194611 /nfs/dbraw/zinc/19/46/11/571194611.db2.gz XAXRLMHPXPKSLL-CNHKJKLMSA-N 1 1 366.513 3.794 50 0 FHAAMO C[C@@H](C1CCN(Cc2cnc(-c3cccs3)nc2)CC1)[NH+]1CCCC1 ZINC000072428144 571194806 /nfs/dbraw/zinc/19/48/06/571194806.db2.gz HARGAHSDZBJULY-INIZCTEOSA-N 1 1 356.539 3.901 50 0 FHAAMO c1coc(-c2ncc(C[N@H+]3CCC[C@H](c4nc5ccccc5[nH]4)C3)cn2)c1 ZINC000072430571 571195396 /nfs/dbraw/zinc/19/53/96/571195396.db2.gz KVBLXNMDQUCIPR-INIZCTEOSA-N 1 1 359.433 3.993 50 0 FHAAMO COc1cccc(C)c1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000299779439 571197754 /nfs/dbraw/zinc/19/77/54/571197754.db2.gz ROKNHNREJLPRKA-UHFFFAOYSA-N 1 1 374.431 3.676 50 0 FHAAMO O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000299780386 571197991 /nfs/dbraw/zinc/19/79/91/571197991.db2.gz CGZMRYCTNLCVGX-INIZCTEOSA-N 1 1 354.416 3.771 50 0 FHAAMO CC(C)(O)CCc1ccc(C[N@H+]2CCC[C@H](C(=O)c3cccnc3)C2)cc1 ZINC000072468036 571198234 /nfs/dbraw/zinc/19/82/34/571198234.db2.gz DHZZWFXGGMJFLP-NRFANRHFSA-N 1 1 366.505 3.880 50 0 FHAAMO CCc1[nH+]ccn1CCNC(=O)c1cccc(-c2nc(C)c(C)s2)c1 ZINC000299781716 571198346 /nfs/dbraw/zinc/19/83/46/571198346.db2.gz LLQGKPWGVBTHDG-UHFFFAOYSA-N 1 1 354.479 3.616 50 0 FHAAMO C[C@H](c1ccc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)o1)N1CCCCC1 ZINC000299782434 571198579 /nfs/dbraw/zinc/19/85/79/571198579.db2.gz NAZXLZPNUZEOBL-GOSISDBHSA-N 1 1 373.541 3.917 50 0 FHAAMO C[C@H](c1ccc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)o1)N1CCCCC1 ZINC000299782434 571198581 /nfs/dbraw/zinc/19/85/81/571198581.db2.gz NAZXLZPNUZEOBL-GOSISDBHSA-N 1 1 373.541 3.917 50 0 FHAAMO Cc1[nH+]cn([C@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)c1C ZINC000092856861 571199073 /nfs/dbraw/zinc/19/90/73/571199073.db2.gz UHMAKAPDSVUNAF-CYBMUJFWSA-N 1 1 368.462 3.527 50 0 FHAAMO O=C(NCC1([NH+]2CCOCC2)CCCC1)c1cccc(-c2ccsc2)c1 ZINC000299784995 571199201 /nfs/dbraw/zinc/19/92/01/571199201.db2.gz PTIGCFGSIGDZBJ-UHFFFAOYSA-N 1 1 370.518 3.790 50 0 FHAAMO CC[N@H+]1CCC[C@@]2(CCCN(C(=O)c3cccc(CCC(C)(C)O)c3)C2)C1 ZINC000072475842 571199191 /nfs/dbraw/zinc/19/91/91/571199191.db2.gz HIZXEOWNRPSMNU-HSZRJFAPSA-N 1 1 372.553 3.728 50 0 FHAAMO Cc1n[nH]c(C)c1-c1cccc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1 ZINC000299786532 571199440 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Cc1ccc(-c2cc(C(=O)N(C)C[C@H]3Cc4ccccc4C[N@H+]3C)[nH]n2)cc1 ZINC000077375554 571209477 /nfs/dbraw/zinc/20/94/77/571209477.db2.gz ZNZIYGDBSMJPPA-HXUWFJFHSA-N 1 1 374.488 3.514 50 0 FHAAMO Cc1[nH+]ccn1CC[C@H]1CCCCN1C(=O)Nc1ccc2[nH]c(=O)oc2c1 ZINC000426370190 571215954 /nfs/dbraw/zinc/21/59/54/571215954.db2.gz AVLXFYFONFQQRC-OAHLLOKOSA-N 1 1 369.425 3.515 50 0 FHAAMO Cc1ccc(CN(Cc2ccncc2)C(=O)NC[C@@H]2CCC[N@H+](C)C2)s1 ZINC000426379730 571216915 /nfs/dbraw/zinc/21/69/15/571216915.db2.gz MZPAFYCAXRLDDC-SFHVURJKSA-N 1 1 372.538 3.505 50 0 FHAAMO Cc1cc(C)nc(N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccc(F)c(F)c2)C3)n1 ZINC000426414811 571222252 /nfs/dbraw/zinc/22/22/52/571222252.db2.gz VCETYIQNJIRKQC-NRFANRHFSA-N 1 1 372.463 3.864 50 0 FHAAMO Cc1cc(C)nc(N2CC[C@]3(C2)CCC[N@@H+](Cc2ccc(F)c(F)c2)C3)n1 ZINC000426414816 571222378 /nfs/dbraw/zinc/22/23/78/571222378.db2.gz VCETYIQNJIRKQC-OAQYLSRUSA-N 1 1 372.463 3.864 50 0 FHAAMO CC(C)=CCC/C(C)=C/C[N@@H+]1CCCn2nc(CNC(=O)N(C)C)cc2C1 ZINC000082092635 571227869 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FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(-c2cc(F)c(OC)c(F)c2)cc1 ZINC000426711959 571236237 /nfs/dbraw/zinc/23/62/37/571236237.db2.gz BOTFEWQYOVTJMR-QGZVFWFLSA-N 1 1 374.431 3.855 50 0 FHAAMO CCCN1CCC[C@]2(CC[N@@H+](Cc3cc(-c4ccc(C)cc4)no3)C2)C1=O ZINC000091326734 571238981 /nfs/dbraw/zinc/23/89/81/571238981.db2.gz OHBRDWMTWBEYPQ-JOCHJYFZSA-N 1 1 367.493 3.875 50 0 FHAAMO O=C(CCC(F)(F)F)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccc(F)cc1)C2 ZINC000091417003 571239462 /nfs/dbraw/zinc/23/94/62/571239462.db2.gz IPMGOTFMSQUPFT-GOEBONIOSA-N 1 1 358.379 3.591 50 0 FHAAMO CCn1cc[nH+]c1[C@@H]1CCCN(Cc2c(F)c(F)c(OC)c(F)c2F)C1 ZINC000091459864 571239890 /nfs/dbraw/zinc/23/98/90/571239890.db2.gz NVNSRAGDPCGTBD-LLVKDONJSA-N 1 1 371.378 3.848 50 0 FHAAMO COc1ccc([C@@H]2C[N@@H+](Cc3cc4ccccc4n3C)C[C@H]2N(C)C)cc1 ZINC000091643336 571241572 /nfs/dbraw/zinc/24/15/72/571241572.db2.gz WDVCBMHZHDVTKI-JTHBVZDNSA-N 1 1 363.505 3.717 50 0 FHAAMO COc1ccc([C@@H]2CN(Cc3cc4ccccc4n3C)C[C@H]2[NH+](C)C)cc1 ZINC000091643336 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CC[N@H+]1C[C@H](NC(=O)c2ccc(-c3cc(C)ccc3Cl)cc2)[C@@H](OC)C1 ZINC000584894136 571315058 /nfs/dbraw/zinc/31/50/58/571315058.db2.gz QEVXVDGGBPZMDA-PMACEKPBSA-N 1 1 372.896 3.764 50 0 FHAAMO Oc1cccc(C[N@@H+](Cc2cnc3ccccc3n2)[C@H]2CC[C@H](O)CC2)c1 ZINC000585094508 571320456 /nfs/dbraw/zinc/32/04/56/571320456.db2.gz VFXWMMPACAXZLD-WGSAOQKQSA-N 1 1 363.461 3.641 50 0 FHAAMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(OC(F)F)cc2F)C1 ZINC000585101481 571320557 /nfs/dbraw/zinc/32/05/57/571320557.db2.gz XJFQRTZZJRPMFJ-NSHDSACASA-N 1 1 359.392 3.669 50 0 FHAAMO Nc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)nc2ccccc12 ZINC000328729689 571326340 /nfs/dbraw/zinc/32/63/40/571326340.db2.gz FQRSENFRRPPYCJ-CQSZACIVSA-N 1 1 350.388 3.597 50 0 FHAAMO Nc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)nc2ccccc12 ZINC000328729689 571326341 /nfs/dbraw/zinc/32/63/41/571326341.db2.gz FQRSENFRRPPYCJ-CQSZACIVSA-N 1 1 350.388 3.597 50 0 FHAAMO CCOC(=O)C1CCC([NH+]2CCN(C3CCC(C(C)C)CC3)CC2)CC1 ZINC000093811069 571327196 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C[C@H](Cc1ccc2c(c1)OCO2)C[N@@H+](C)Cc1cc(-c2cccnc2)no1 ZINC000216363433 524707878 /nfs/dbraw/zinc/70/78/78/524707878.db2.gz GXSOPZLWARHXQH-OAHLLOKOSA-N 1 1 365.433 3.776 50 0 FHAAMO COc1cccc(CNCC[NH+](C)C)c1OCc1ccc(F)cc1Cl ZINC000020876272 526015913 /nfs/dbraw/zinc/01/59/13/526015913.db2.gz HCMVRFFDSAYKAY-UHFFFAOYSA-N 1 1 366.864 3.718 50 0 FHAAMO C[C@@H](c1ccc(-c2cn(Cc3nc4ccc(F)cc4[nH]3)nn2)cc1)[NH+](C)C ZINC000091625109 526033436 /nfs/dbraw/zinc/03/34/36/526033436.db2.gz LGPQTUDHFMNHIP-ZDUSSCGKSA-N 1 1 364.428 3.631 50 0 FHAAMO c1ccc(C[C@H]2C[N@H+](Cc3ccc(Oc4ncccn4)cc3)CCO2)cc1 ZINC000020600400 526476600 /nfs/dbraw/zinc/47/66/00/526476600.db2.gz OWOJBKMISZQTMO-NRFANRHFSA-N 1 1 361.445 3.712 50 0 FHAAMO c1ccc(C[C@H]2C[N@@H+](Cc3ccc(Oc4ncccn4)cc3)CCO2)cc1 ZINC000020600400 526476608 /nfs/dbraw/zinc/47/66/08/526476608.db2.gz OWOJBKMISZQTMO-NRFANRHFSA-N 1 1 361.445 3.712 50 0 FHAAMO O=C(NCc1cccnc1)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1 ZINC000019800329 526769060 /nfs/dbraw/zinc/76/90/60/526769060.db2.gz KRBQANBJGRNXNC-UHFFFAOYSA-N 1 1 357.457 3.570 50 0 FHAAMO O=C(c1conc1-c1ccccc1)N1CCC[N@H+](Cc2cccs2)CC1 ZINC000082137501 526899001 /nfs/dbraw/zinc/89/90/01/526899001.db2.gz CUFFTULSRFFXJS-UHFFFAOYSA-N 1 1 367.474 3.751 50 0 FHAAMO O=C(c1conc1-c1ccccc1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000082137501 526899009 /nfs/dbraw/zinc/89/90/09/526899009.db2.gz CUFFTULSRFFXJS-UHFFFAOYSA-N 1 1 367.474 3.751 50 0 FHAAMO Cc1[nH+]ccn1CC[C@H]1CCCCN1C(=O)c1cccc(OC(F)F)c1 ZINC000082107696 527434303 /nfs/dbraw/zinc/43/43/03/527434303.db2.gz FLQAOCLIPGWOOS-MRXNPFEDSA-N 1 1 363.408 3.878 50 0 FHAAMO CC(C)Sc1nc2ccccc2n1C[NH+]1CCN(c2ccccn2)CC1 ZINC000003358294 535122425 /nfs/dbraw/zinc/12/24/25/535122425.db2.gz SWKMIYSXBPFLFD-UHFFFAOYSA-N 1 1 367.522 3.712 50 0 FHAAMO FC(F)(F)Oc1ccccc1CN1CCC[N@@H+](Cc2cccnc2)CC1 ZINC000215275816 568061405 /nfs/dbraw/zinc/06/14/05/568061405.db2.gz IOPRBCGGJUOELI-UHFFFAOYSA-N 1 1 365.399 3.688 50 0 FHAAMO Cc1nc(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)c(C)s1 ZINC000215311819 568063288 /nfs/dbraw/zinc/06/32/88/568063288.db2.gz PKZVSWLPFYTHPT-INIZCTEOSA-N 1 1 363.914 3.980 50 0 FHAAMO Fc1ccccc1OC1CC[NH+](Cc2cnc(-c3ccccn3)nc2)CC1 ZINC000215378451 568067039 /nfs/dbraw/zinc/06/70/39/568067039.db2.gz SAARTJCGZCGCKE-UHFFFAOYSA-N 1 1 364.424 3.721 50 0 FHAAMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc3cccc(Cl)c3n2)CC1 ZINC000215562795 568077011 /nfs/dbraw/zinc/07/70/11/568077011.db2.gz CYRDFXPNTBZFSE-IBGZPJMESA-N 1 1 370.884 3.567 50 0 FHAAMO CCOc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](c4nnc[nH]4)C3)o2)cc1 ZINC000215720383 568085396 /nfs/dbraw/zinc/08/53/96/568085396.db2.gz ISAPUCZUWVRROV-MRXNPFEDSA-N 1 1 352.438 3.843 50 0 FHAAMO c1cc(C[N@@H+]2CCC[C@H](OCc3ccccn3)C2)sc1C[NH+]1CCCC1 ZINC000215730882 568085935 /nfs/dbraw/zinc/08/59/35/568085935.db2.gz GBDXDRASSJVTJU-IBGZPJMESA-N 1 1 371.550 3.920 50 0 FHAAMO Cn1c2ccccc2nc1-c1ccc(C[N@H+]2CC[C@@](O)(c3ccccc3)C2)o1 ZINC000215827714 568091007 /nfs/dbraw/zinc/09/10/07/568091007.db2.gz UVCKWZBCORKDHA-QHCPKHFHSA-N 1 1 373.456 3.927 50 0 FHAAMO Cn1cnnc1Sc1ccc(C[N@@H+](C)Cc2cccc3ncccc23)o1 ZINC000216047406 568102516 /nfs/dbraw/zinc/10/25/16/568102516.db2.gz ITIQWQSWHXKKOL-UHFFFAOYSA-N 1 1 365.462 3.740 50 0 FHAAMO COc1cc2c(cc1C[N@@H+](C)Cc1ccc(OC)c3ncccc13)OCO2 ZINC000216429411 568123084 /nfs/dbraw/zinc/12/30/84/568123084.db2.gz OUJKUOPBAOHETB-UHFFFAOYSA-N 1 1 366.417 3.613 50 0 FHAAMO CCN(CC)C(=O)C1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000000819218 568296929 /nfs/dbraw/zinc/29/69/29/568296929.db2.gz AZCNEZVCWWGVOU-UHFFFAOYSA-N 1 1 353.304 3.530 50 0 FHAAMO CCc1nc(C)sc1C[N@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccc1)C2 ZINC000091769552 570438281 /nfs/dbraw/zinc/43/82/81/570438281.db2.gz QYDIWNMNGBRJJI-SJLPKXTDSA-N 1 1 369.534 3.751 50 0 FHAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2ccccc2Br)C1 ZINC000000752349 570454392 /nfs/dbraw/zinc/45/43/92/570454392.db2.gz NMHJUHZUNPQFNV-HNNXBMFYSA-N 1 1 353.304 3.530 50 0 FHAAMO COc1ccc([C@H]2CC(c3cccs3)=NN2C(=O)C[NH+]2CCCC2)cc1 ZINC000000883474 570462831 /nfs/dbraw/zinc/46/28/31/570462831.db2.gz FUZVWVMNIKUTJW-GOSISDBHSA-N 1 1 369.490 3.530 50 0 FHAAMO O=C([C@@H]1CCC[N@H+](Cc2ccccc2Br)C1)N1CCCCC1 ZINC000001287670 570496890 /nfs/dbraw/zinc/49/68/90/570496890.db2.gz SHZMPDKQARDFJQ-MRXNPFEDSA-N 1 1 365.315 3.674 50 0 FHAAMO COc1cccc(C[N@H+]2CCC[C@@H](C(=O)N(C)Cc3ccccc3)C2)c1 ZINC000002734647 570529042 /nfs/dbraw/zinc/52/90/42/570529042.db2.gz AWDZNNJDCUIACW-HXUWFJFHSA-N 1 1 352.478 3.566 50 0 FHAAMO CC(=O)N(CC(C)C)C[C@@H]1C[N@@H+](Cc2cccn2C)C[C@H]1c1ccccc1 ZINC000248143352 570598602 /nfs/dbraw/zinc/59/86/02/570598602.db2.gz QYVUAOZEEFLPGF-GMAHTHKFSA-N 1 1 367.537 3.745 50 0 FHAAMO CO[C@]12CC[N@H+](Cc3coc(C(C)C)n3)[C@H]1C[C@H](Oc1ccccn1)CC2 ZINC000426490190 570607656 /nfs/dbraw/zinc/60/76/56/570607656.db2.gz ICVOLNIGKDXHNS-LVCYWYKZSA-N 1 1 371.481 3.784 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3coc(C(C)C)n3)[C@H]1C[C@H](Oc1ccccn1)CC2 ZINC000426490190 570607658 /nfs/dbraw/zinc/60/76/58/570607658.db2.gz ICVOLNIGKDXHNS-LVCYWYKZSA-N 1 1 371.481 3.784 50 0 FHAAMO O=C(c1cc2sccc2[nH]1)N1CC[C@]2(C1)CCC[N@@H+](CC1CCC1)C2 ZINC000426490427 570608125 /nfs/dbraw/zinc/60/81/25/570608125.db2.gz XOJMUTNFBAAKCZ-HXUWFJFHSA-N 1 1 357.523 3.958 50 0 FHAAMO O=c1[nH]c2ccccc2n1C1CC[NH+](Cc2cccc(OC(F)F)c2)CC1 ZINC000050959163 570626676 /nfs/dbraw/zinc/62/66/76/570626676.db2.gz VFTNHOLPGMVNPT-UHFFFAOYSA-N 1 1 373.403 3.768 50 0 FHAAMO COc1cc(CN2CCC[C@@H]([N@@H+](C)CCc3ccccc3)C2)ccc1O ZINC000022920028 570703025 /nfs/dbraw/zinc/70/30/25/570703025.db2.gz INLJMEBAZMIZQM-HXUWFJFHSA-N 1 1 354.494 3.540 50 0 FHAAMO O=C1N(C2CCCC2)C[C@@H]2C[C@@H](c3nc4c(s3)CCCC4)[N@@H+]3CCC[C@@]123 ZINC000011815469 570707544 /nfs/dbraw/zinc/70/75/44/570707544.db2.gz FNXXMQYDVCGNMB-LFRPXUGBSA-N 1 1 371.550 3.702 50 0 FHAAMO O=C1N(C2CCCC2)C[C@@H]2C[C@@H](c3nc4c(s3)CCCC4)[N@H+]3CCC[C@@]123 ZINC000011815469 570707546 /nfs/dbraw/zinc/70/75/46/570707546.db2.gz FNXXMQYDVCGNMB-LFRPXUGBSA-N 1 1 371.550 3.702 50 0 FHAAMO O=C(CC[C@H]1CCC[N@H+](Cc2ccc(OC(F)(F)F)cc2)C1)NC1CC1 ZINC000011815336 570707685 /nfs/dbraw/zinc/70/76/85/570707685.db2.gz BJVZUCFMLHKQEX-CQSZACIVSA-N 1 1 370.415 3.856 50 0 FHAAMO CCOc1cc(C[N@H+]2Cc3cc(OC)ccc3O[C@H](CC)C2)ccc1O ZINC000012005277 570713989 /nfs/dbraw/zinc/71/39/89/570713989.db2.gz GTXDYLLLWHLJGG-QGZVFWFLSA-N 1 1 357.450 3.973 50 0 FHAAMO CCOc1cc(C[N@@H+]2Cc3cc(OC)ccc3O[C@H](CC)C2)ccc1O ZINC000012005277 570713990 /nfs/dbraw/zinc/71/39/90/570713990.db2.gz GTXDYLLLWHLJGG-QGZVFWFLSA-N 1 1 357.450 3.973 50 0 FHAAMO COc1ccc(C[N@@H+]2CCC[C@H](C(=O)c3cc(F)ccc3OC)C2)cc1O ZINC000012074212 570716568 /nfs/dbraw/zinc/71/65/68/570716568.db2.gz BWELJOVEKZRXAT-HNNXBMFYSA-N 1 1 373.424 3.643 50 0 FHAAMO COc1ccc(C[N@H+]2CCC[C@H](C(=O)c3cc(F)ccc3OC)C2)cc1O ZINC000012074212 570716570 /nfs/dbraw/zinc/71/65/70/570716570.db2.gz BWELJOVEKZRXAT-HNNXBMFYSA-N 1 1 373.424 3.643 50 0 FHAAMO COc1ccc(C[N@H+](Cc2ccc(F)cc2)C[C@H]2CCCO2)cc1CO ZINC000012187050 570724819 /nfs/dbraw/zinc/72/48/19/570724819.db2.gz IERLJVFQJAEUPH-HXUWFJFHSA-N 1 1 359.441 3.508 50 0 FHAAMO COc1ccc(C(=O)N2CCC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1F ZINC000012713077 570757971 /nfs/dbraw/zinc/75/79/71/570757971.db2.gz IZRVLKZXZWPIRH-GOSISDBHSA-N 1 1 356.441 3.571 50 0 FHAAMO OC[C@@]1(Cc2cccc(Cl)c2)CCC[N@H+](C2CSCCSC2)C1 ZINC000012715120 570757995 /nfs/dbraw/zinc/75/79/95/570757995.db2.gz QQAKFDGHUFXYDK-GOSISDBHSA-N 1 1 371.999 3.806 50 0 FHAAMO CN(C)C(=O)[C@H]1CCC[N@H+]1Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000012815534 570764719 /nfs/dbraw/zinc/76/47/19/570764719.db2.gz FVADNLKMBSCAFL-OAQYLSRUSA-N 1 1 374.488 3.592 50 0 FHAAMO COc1ccc(Cl)cc1NC(=O)C[N@H+](C)CCOc1cccc(C)c1 ZINC000013040321 570773057 /nfs/dbraw/zinc/77/30/57/570773057.db2.gz VBOPNXNGCMINFX-UHFFFAOYSA-N 1 1 362.857 3.606 50 0 FHAAMO COc1ccc(Cl)cc1NC(=O)C[N@@H+](C)CCOc1cccc(C)c1 ZINC000013040321 570773061 /nfs/dbraw/zinc/77/30/61/570773061.db2.gz VBOPNXNGCMINFX-UHFFFAOYSA-N 1 1 362.857 3.606 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(Cl)cc2)cc1OC ZINC000013096125 570773431 /nfs/dbraw/zinc/77/34/31/570773431.db2.gz GARHJOKQDUQQAD-CYBMUJFWSA-N 1 1 362.857 3.816 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(Cl)cc2)cc1OC ZINC000013096125 570773435 /nfs/dbraw/zinc/77/34/35/570773435.db2.gz GARHJOKQDUQQAD-CYBMUJFWSA-N 1 1 362.857 3.816 50 0 FHAAMO CCOC(=O)c1ccsc1NC(=O)C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000011285641 570805287 /nfs/dbraw/zinc/80/52/87/570805287.db2.gz LONXABDTGDGCRW-KRWDZBQOSA-N 1 1 372.490 3.873 50 0 FHAAMO CCOC(=O)c1ccsc1NC(=O)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000011285641 570805289 /nfs/dbraw/zinc/80/52/89/570805289.db2.gz LONXABDTGDGCRW-KRWDZBQOSA-N 1 1 372.490 3.873 50 0 FHAAMO COc1ccc(CC(=O)N(C[C@H]2CCC[N@H+]3CCCC[C@@H]23)C(C)C)cc1 ZINC000583647554 570812105 /nfs/dbraw/zinc/81/21/05/570812105.db2.gz GGRXMHLVJVQUJE-CTNGQTDRSA-N 1 1 358.526 3.739 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029559 570830078 /nfs/dbraw/zinc/83/00/78/570830078.db2.gz RHWGQBOICKGDTL-ZDUSSCGKSA-N 1 1 360.841 3.836 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029559 570830079 /nfs/dbraw/zinc/83/00/79/570830079.db2.gz RHWGQBOICKGDTL-ZDUSSCGKSA-N 1 1 360.841 3.836 50 0 FHAAMO c1coc(CN2CCC([N@@H+]3CCO[C@@H](CCCc4ccccc4)C3)CC2)c1 ZINC000015065850 570831009 /nfs/dbraw/zinc/83/10/09/570831009.db2.gz JBMDUUUPIUGHDG-QHCPKHFHSA-N 1 1 368.521 3.968 50 0 FHAAMO c1coc(C[NH+]2CCC(N3CCO[C@@H](CCCc4ccccc4)C3)CC2)c1 ZINC000015065850 570831011 /nfs/dbraw/zinc/83/10/11/570831011.db2.gz JBMDUUUPIUGHDG-QHCPKHFHSA-N 1 1 368.521 3.968 50 0 FHAAMO COc1ccc([C@@H]2CCCCC[N@@H+]2CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000102492173 570832490 /nfs/dbraw/zinc/83/24/90/570832490.db2.gz AFKNQPGFUQEQFS-UFYCRDLUSA-N 1 1 368.477 3.521 50 0 FHAAMO COc1ccc([C@@H]2CCCCC[N@H+]2CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000102492173 570832494 /nfs/dbraw/zinc/83/24/94/570832494.db2.gz AFKNQPGFUQEQFS-UFYCRDLUSA-N 1 1 368.477 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Fc1cccc(-c2noc3c2C[N@H+](Cc2ccc4c(c2)CCO4)CC3)c1 ZINC000020324551 941881173 /nfs/dbraw/zinc/88/11/73/941881173.db2.gz LRISQGVLBZSWMY-UHFFFAOYSA-N 1 1 350.393 3.974 50 0 FHAAMO Fc1cccc(-c2noc3c2C[N@@H+](Cc2ccc4c(c2)CCO4)CC3)c1 ZINC000020324551 941881179 /nfs/dbraw/zinc/88/11/79/941881179.db2.gz LRISQGVLBZSWMY-UHFFFAOYSA-N 1 1 350.393 3.974 50 0 FHAAMO Fc1cnccc1C[N@H+]1CCC[C@@H](CCc2nc(-c3cccnc3)no2)C1 ZINC000257174889 942454250 /nfs/dbraw/zinc/45/42/50/942454250.db2.gz LRNDTLPPWJMEQN-HNNXBMFYSA-N 1 1 367.428 3.511 50 0 FHAAMO c1cc(CC[N@@H+]2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)cc2c1OCC2 ZINC000329392010 943176764 /nfs/dbraw/zinc/17/67/64/943176764.db2.gz VPXFIINNWPIBGW-IEBWSBKVSA-N 1 1 369.465 3.626 50 0 FHAAMO c1cc(CC[N@H+]2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)cc2c1OCC2 ZINC000329392010 943176765 /nfs/dbraw/zinc/17/67/65/943176765.db2.gz VPXFIINNWPIBGW-IEBWSBKVSA-N 1 1 369.465 3.626 50 0 FHAAMO O=C(N[C@H]1CC[N@@H+](Cc2ccsc2)C1)c1ccc(-n2cccc2)cc1 ZINC000675007982 943590612 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360.505 3.739 50 0 FHAAMO Cc1nc(CN2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccc2)C3)c2ccccn12 ZINC000095384659 209042022 /nfs/dbraw/zinc/04/20/22/209042022.db2.gz FGEFRPYEIRYNAX-LEWJYISDSA-N 1 1 360.505 3.739 50 0 FHAAMO C[NH+](C)[C@H](C(=O)NCCc1ccccc1C(F)(F)F)c1ccc(F)cc1 ZINC000095387522 209043499 /nfs/dbraw/zinc/04/34/99/209043499.db2.gz XFOGSJOQAQTHHC-KRWDZBQOSA-N 1 1 368.374 3.806 50 0 FHAAMO Cc1ccsc1C[N@H+]1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 ZINC000095392507 209047363 /nfs/dbraw/zinc/04/73/63/209047363.db2.gz ZAQILOYJTOKENL-CEWLAPEOSA-N 1 1 354.519 3.824 50 0 FHAAMO COc1cc(C[NH2+][C@H](c2nnc3ccccn32)C(C)C)ccc1SC ZINC000095393029 209047517 /nfs/dbraw/zinc/04/75/17/209047517.db2.gz VDQXTIUBTMKTGT-SFHVURJKSA-N 1 1 356.495 3.947 50 0 FHAAMO CC(C)c1cc(C(=O)N2CCC3(C[C@H](c4ccccc4)C[N@H+]3C)CC2)on1 ZINC000095499383 209061523 /nfs/dbraw/zinc/06/15/23/209061523.db2.gz BRLUTZRSDAIQRN-SFHVURJKSA-N 1 1 367.493 3.892 50 0 FHAAMO CC[C@@H]1CN(C(=O)Nc2ccc(-c3ccccc3)cc2)CC[N@H+]1C[C@@H](C)O 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c1cn(Cc2ccncc2)c([C@@H]2CCCN(c3cnc4ccccc4n3)C2)[nH+]1 ZINC000091536356 132201972 /nfs/dbraw/zinc/20/19/72/132201972.db2.gz DDGWJOIEOZSUTL-GOSISDBHSA-N 1 1 370.460 3.654 50 0 FHAAMO Clc1cccnc1N1CCC[C@@H](c2[nH+]ccn2Cc2ccccn2)C1 ZINC000095519428 132213813 /nfs/dbraw/zinc/21/38/13/132213813.db2.gz PQGHIWFYCZXSBP-OAHLLOKOSA-N 1 1 353.857 3.759 50 0 FHAAMO C[C@@H](c1ccc(-c2cc(N3CCCCC3)ncn2)cc1)[NH+]1CCOCC1 ZINC000097527213 132229558 /nfs/dbraw/zinc/22/95/58/132229558.db2.gz KSMLCVBGLSKOHI-KRWDZBQOSA-N 1 1 352.482 3.527 50 0 FHAAMO COc1cccc(N2CC[NH+](C3CCN(Cc4cccs4)CC3)CC2)c1 ZINC000252488299 132292417 /nfs/dbraw/zinc/29/24/17/132292417.db2.gz IORYJSCGRHIWAZ-UHFFFAOYSA-N 1 1 371.550 3.543 50 0 FHAAMO Cc1cc(C)c2c(C[NH+]3CCN(c4ccc(F)cc4)CC3)cc(=O)oc2c1 ZINC000054105884 132376068 /nfs/dbraw/zinc/37/60/68/132376068.db2.gz AUFRUPMVABLLJB-UHFFFAOYSA-N 1 1 366.436 3.871 50 0 FHAAMO c1ccc(COc2cccc(C[NH+]3CCN(c4ccccn4)CC3)c2)cc1 ZINC000001229294 132381326 /nfs/dbraw/zinc/38/13/26/132381326.db2.gz 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FC(F)(F)c1cccc(N2CCN([C@H]3CCC[N@H+](C4CCC4)C3)CC2)c1 ZINC000019228661 136152181 /nfs/dbraw/zinc/15/21/81/136152181.db2.gz HUGVFEVVZWKKPX-IBGZPJMESA-N 1 1 367.459 3.844 50 0 FHAAMO Cc1nnc(C[N@@H+](C)C2CCN(c3cccc(-c4cscn4)c3)CC2)o1 ZINC000023380258 136152805 /nfs/dbraw/zinc/15/28/05/136152805.db2.gz TVCUXAJKEKUKED-UHFFFAOYSA-N 1 1 369.494 3.602 50 0 FHAAMO Cc1nnc(C[N@H+](C)C2CCN(c3cccc(-c4cscn4)c3)CC2)o1 ZINC000023380258 136152806 /nfs/dbraw/zinc/15/28/06/136152806.db2.gz TVCUXAJKEKUKED-UHFFFAOYSA-N 1 1 369.494 3.602 50 0 FHAAMO C[N@H+]1CCCC[C@H]1CNC(=O)Nc1cccc(OCc2ccccc2)c1 ZINC000095522199 209074281 /nfs/dbraw/zinc/07/42/81/209074281.db2.gz OFFAJCVXAAQGCA-IBGZPJMESA-N 1 1 353.466 3.871 50 0 FHAAMO CCc1[nH+]ccn1CCCNC(=O)c1c(C)c(C)nc2ccc(C)cc21 ZINC000095522071 209074781 /nfs/dbraw/zinc/07/47/81/209074781.db2.gz MPBUDQYHCSLVIS-UHFFFAOYSA-N 1 1 350.466 3.739 50 0 FHAAMO Cc1cc(C)nc(CNC(=O)Nc2cccc(C[N@@H+]3CCCC[C@@H]3C)c2)n1 ZINC000095525652 209075262 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CC1(C)[C@@H]2C[C@H]1C(C[N@@H+]1CCc3nnc(Cc4ccccc4)n3CC1)=CC2 ZINC000014997028 570828463 /nfs/dbraw/zinc/82/84/63/570828463.db2.gz JZKQCLRXTADOFO-PMACEKPBSA-N 1 1 362.521 3.719 50 0 FHAAMO O=C(Nc1ccccc1O)C1CC[NH+](Cc2nc3ccccc3s2)CC1 ZINC000015045426 570830512 /nfs/dbraw/zinc/83/05/12/570830512.db2.gz KJULPUIVMUOEEN-UHFFFAOYSA-N 1 1 367.474 3.853 50 0 FHAAMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2nc(-c3ccc(Cl)cc3)oc2C)C1 ZINC000015073345 570831427 /nfs/dbraw/zinc/83/14/27/570831427.db2.gz CUCVXFWNUKPKPX-OAHLLOKOSA-N 1 1 361.873 3.652 50 0 FHAAMO O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)c1cccc2ccccc21 ZINC000015075926 570831896 /nfs/dbraw/zinc/83/18/96/570831896.db2.gz XFTQDYKLTOGEAF-IBGZPJMESA-N 1 1 359.473 3.877 50 0 FHAAMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccc(C)c2)ccc1OCC(N)=O ZINC000015836826 570845275 /nfs/dbraw/zinc/84/52/75/570845275.db2.gz DQOLEYCTLQZNFT-IBGZPJMESA-N 1 1 368.477 3.595 50 0 FHAAMO Cc1ccc([C@H](CNC(=O)c2ccc(Br)o2)[NH+]2CCCC2)o1 ZINC000015860264 570846681 /nfs/dbraw/zinc/84/66/81/570846681.db2.gz SNHIRPQOZBUXFZ-LBPRGKRZSA-N 1 1 367.243 3.510 50 0 FHAAMO CC[N@@H+]1CCC[C@@H]1CN[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000103952039 570854610 /nfs/dbraw/zinc/85/46/10/570854610.db2.gz XFYNEJAINDSACU-IEBWSBKVSA-N 1 1 367.493 3.880 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CN[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000103952039 570854612 /nfs/dbraw/zinc/85/46/12/570854612.db2.gz XFYNEJAINDSACU-IEBWSBKVSA-N 1 1 367.493 3.880 50 0 FHAAMO C[N@@H+](CC(=O)Nc1ccc2c(c1)OCCCO2)[C@@H]1CCCc2ccccc21 ZINC000016342728 570854877 /nfs/dbraw/zinc/85/48/77/570854877.db2.gz ZXEAYQDTBIIKTN-LJQANCHMSA-N 1 1 366.461 3.796 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[N@@H+](C)CC12CC3CC(CC(C3)C1)C2 ZINC000016439249 570856316 /nfs/dbraw/zinc/85/63/16/570856316.db2.gz QXIXMWGHCAVDHD-NEFAXPCMSA-N 1 1 358.530 3.512 50 0 FHAAMO C[C@H](O)C[N@H+](Cc1ccccc1)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000104985047 570865779 /nfs/dbraw/zinc/86/57/79/570865779.db2.gz CCRYVKOEOBSQCC-HNAYVOBHSA-N 1 1 358.869 3.716 50 0 FHAAMO CCCOc1ccc(C(=O)N2CC[NH+](Cc3ccc(C)cc3)CC2)cc1 ZINC000017073079 570866117 /nfs/dbraw/zinc/86/61/17/570866117.db2.gz FYIBTVFMSULTNA-UHFFFAOYSA-N 1 1 352.478 3.742 50 0 FHAAMO COc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(-c3cccnc3)no2)cc1 ZINC000065286274 570873584 /nfs/dbraw/zinc/87/35/84/570873584.db2.gz SNIXHQYVEIEANG-SFHVURJKSA-N 1 1 350.422 3.867 50 0 FHAAMO COc1ccc(C[N@H+]2CCCC[C@H]2c2nc(-c3cccnc3)no2)cc1 ZINC000065286274 570873587 /nfs/dbraw/zinc/87/35/87/570873587.db2.gz SNIXHQYVEIEANG-SFHVURJKSA-N 1 1 350.422 3.867 50 0 FHAAMO CC(C)[C@@H]1C[N@H+]([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)CCS1 ZINC000106920729 570894224 /nfs/dbraw/zinc/89/42/24/570894224.db2.gz KKEYQULHXLGGRT-VBQJREDUSA-N 1 1 354.947 3.979 50 0 FHAAMO CN(Cc1ccco1)C(=O)c1ccc([C@H]2CCC[N@H+]2C2CCOCC2)s1 ZINC000019595513 570895776 /nfs/dbraw/zinc/89/57/76/570895776.db2.gz FUBMMMZIRBGMBQ-QGZVFWFLSA-N 1 1 374.506 3.929 50 0 FHAAMO CCC[N@H+]1CCc2c(sc3[nH]c(=S)n(-c4ccccc4)c(=O)c23)C1 ZINC000019690822 570898381 /nfs/dbraw/zinc/89/83/81/570898381.db2.gz PTDXTSJDRKXOKU-UHFFFAOYSA-N 1 1 357.504 3.878 50 0 FHAAMO O=C(c1ccncc1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019720759 570901228 /nfs/dbraw/zinc/90/12/28/570901228.db2.gz QHPHCTYNFIWUNI-UHFFFAOYSA-N 1 1 357.457 3.629 50 0 FHAAMO OCCN1CC[NH+]([C@H]2CC[C@@H](c3ccc(F)cc3)c3ccc(F)cc32)CC1 ZINC000019801927 570903287 /nfs/dbraw/zinc/90/32/87/570903287.db2.gz RTZUVUZIGHAAAJ-UGKGYDQZSA-N 1 1 372.459 3.542 50 0 FHAAMO OCC[NH+]1CCN([C@H]2CC[C@@H](c3ccc(F)cc3)c3ccc(F)cc32)CC1 ZINC000019801927 570903289 /nfs/dbraw/zinc/90/32/89/570903289.db2.gz RTZUVUZIGHAAAJ-UGKGYDQZSA-N 1 1 372.459 3.542 50 0 FHAAMO C[C@@H]1CCC[C@@H]([NH+]2CCC(N3CCN(Cc4ccccc4)CC3)CC2)C1 ZINC000019888815 570905270 /nfs/dbraw/zinc/90/52/70/570905270.db2.gz KZAYPWPXFXBOLG-NFBKMPQASA-N 1 1 355.570 3.847 50 0 FHAAMO Cc1ccc(C)c(-c2cn3c4ccccc4n(CC[NH+]4CCOCC4)c3n2)c1 ZINC000019973612 570908086 /nfs/dbraw/zinc/90/80/86/570908086.db2.gz SFQNTAADBOAGQH-UHFFFAOYSA-N 1 1 374.488 3.905 50 0 FHAAMO Clc1ccc(Oc2cccc(C[N@@H+]3CCc4nncn4CC3)c2)cc1 ZINC000020598934 570920451 /nfs/dbraw/zinc/92/04/51/570920451.db2.gz MFAATXUHCALPFQ-UHFFFAOYSA-N 1 1 354.841 3.782 50 0 FHAAMO CCCCc1nn2c(nc(C[N@@H+](CC)Cc3ccc(C)cc3)cc2=O)s1 ZINC000046032318 570920404 /nfs/dbraw/zinc/92/04/04/570920404.db2.gz HAFLOQOVGDGTTO-UHFFFAOYSA-N 1 1 370.522 3.824 50 0 FHAAMO Fc1ccc2nc(C3CC[NH+]([C@H]4COc5ccccc5C4)CC3)[nH]c2c1 ZINC000020996876 570927110 /nfs/dbraw/zinc/92/71/10/570927110.db2.gz QVXRBQUBADZCEW-QGZVFWFLSA-N 1 1 351.425 3.885 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2cccc(Cl)c2Cl)CC1 ZINC000022028240 570937606 /nfs/dbraw/zinc/93/76/06/570937606.db2.gz QLRLCZZWZIJJAG-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO C[NH+]1CCN(Cc2ccc(C(=O)c3cccc(Cl)c3Cl)cc2)CC1 ZINC000022027945 570937675 /nfs/dbraw/zinc/93/76/75/570937675.db2.gz QUAXCIFUIDLRGO-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO CC[C@@H]1CCCCN1C(=O)C[N@@H+]1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000048332854 570946972 /nfs/dbraw/zinc/94/69/72/570946972.db2.gz LDQPQUBLCKHCJX-VQIMIIECSA-N 1 1 360.498 3.632 50 0 FHAAMO CC[C@@H]1CCCCN1C(=O)C[N@H+]1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000048332854 570946975 /nfs/dbraw/zinc/94/69/75/570946975.db2.gz LDQPQUBLCKHCJX-VQIMIIECSA-N 1 1 360.498 3.632 50 0 FHAAMO OCC[C@H]1CN(Cc2nc(-c3ccccc3)cs2)CC[N@H+]1C1CCCC1 ZINC000022932785 570953177 /nfs/dbraw/zinc/95/31/77/570953177.db2.gz MIWXAAFGUJKRLL-IBGZPJMESA-N 1 1 371.550 3.621 50 0 FHAAMO O=C(NCCNc1cccnc1)c1ccc([C@@H]2CCC[N@H+]2C2CCC2)s1 ZINC000023398061 570963180 /nfs/dbraw/zinc/96/31/80/570963180.db2.gz AOORYBWMNKZYDR-KRWDZBQOSA-N 1 1 370.522 3.674 50 0 FHAAMO Cc1n[nH]c(C)c1NC(=O)C[NH2+][C@@H](c1cccs1)c1ccc(C)cc1 ZINC000025049233 570989639 /nfs/dbraw/zinc/98/96/39/570989639.db2.gz VPFBZNXOXCUDIS-LJQANCHMSA-N 1 1 354.479 3.714 50 0 FHAAMO O=C(NC[C@@H]1CCCO1)C1CC[NH+](Cc2ccc(Cl)cc2Cl)CC1 ZINC000027612993 571016056 /nfs/dbraw/zinc/01/60/56/571016056.db2.gz PSZCNHSKNSRYFD-INIZCTEOSA-N 1 1 371.308 3.501 50 0 FHAAMO COc1ccccc1[C@H](CNC(=O)c1oc2ccc(F)cc2c1C)[NH+](C)C ZINC000028232080 571028367 /nfs/dbraw/zinc/02/83/67/571028367.db2.gz ITETXHYKMPOYMC-KRWDZBQOSA-N 1 1 370.424 3.922 50 0 FHAAMO CC[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1C ZINC000225407336 571033648 /nfs/dbraw/zinc/03/36/48/571033648.db2.gz NAEYBSNWYFKLSF-OLZOCXBDSA-N 1 1 352.862 3.560 50 0 FHAAMO CC[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1C ZINC000225407336 571033650 /nfs/dbraw/zinc/03/36/50/571033650.db2.gz NAEYBSNWYFKLSF-OLZOCXBDSA-N 1 1 352.862 3.560 50 0 FHAAMO CCCOC(=O)c1ccc(NC(=O)C[N@@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC000029484396 571040302 /nfs/dbraw/zinc/04/03/02/571040302.db2.gz AMDVXFUZDIJTNN-FQEVSTJZSA-N 1 1 366.461 3.811 50 0 FHAAMO Cc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)cc1-n1cccc1 ZINC000030030582 571045619 /nfs/dbraw/zinc/04/56/19/571045619.db2.gz VENZQKGFPVRNBT-JOCHJYFZSA-N 1 1 359.473 3.915 50 0 FHAAMO Cc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)cc1-n1cccc1 ZINC000030030582 571045622 /nfs/dbraw/zinc/04/56/22/571045622.db2.gz VENZQKGFPVRNBT-JOCHJYFZSA-N 1 1 359.473 3.915 50 0 FHAAMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2csc(C(F)(F)F)n2)C1 ZINC000225581800 571047124 /nfs/dbraw/zinc/04/71/24/571047124.db2.gz QDNBQLPKKXMXLB-NSHDSACASA-N 1 1 363.449 3.792 50 0 FHAAMO C[N@H+]1CCC[C@H](NC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000083877783 571055780 /nfs/dbraw/zinc/05/57/80/571055780.db2.gz VPWFJEPOCHKNTP-NSHDSACASA-N 1 1 369.309 3.940 50 0 FHAAMO COc1c2c(cc3c1[C@H](c1c[nH]c4cc(F)ccc41)[N@H+](C)CC3)OCO2 ZINC000008879916 571064210 /nfs/dbraw/zinc/06/42/10/571064210.db2.gz HRVDDWSWDXRXPC-SFHVURJKSA-N 1 1 354.381 3.622 50 0 FHAAMO COc1c2c(cc3c1[C@H](c1c[nH]c4cc(F)ccc41)[N@@H+](C)CC3)OCO2 ZINC000008879916 571064212 /nfs/dbraw/zinc/06/42/12/571064212.db2.gz HRVDDWSWDXRXPC-SFHVURJKSA-N 1 1 354.381 3.622 50 0 FHAAMO C[NH+]1CCN(CCCCOc2ccc(Cl)cc2Br)CC1 ZINC000039425371 571064273 /nfs/dbraw/zinc/06/42/73/571064273.db2.gz WPANQFYUJWJZIC-UHFFFAOYSA-N 1 1 361.711 3.509 50 0 FHAAMO CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)C1 ZINC000072308817 571066651 /nfs/dbraw/zinc/06/66/51/571066651.db2.gz ZTWSFFSBFYQQQV-LSDHHAIUSA-N 1 1 371.447 3.696 50 0 FHAAMO O=S(=O)(NC[C@H](c1ccsc1)[NH+]1CCCC1)c1cccc(Cl)c1 ZINC000008899575 571069860 /nfs/dbraw/zinc/06/98/60/571069860.db2.gz KUFRRCBVUXOPEL-MRXNPFEDSA-N 1 1 370.927 3.517 50 0 FHAAMO COc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12 ZINC000022023245 571071116 /nfs/dbraw/zinc/07/11/16/571071116.db2.gz GSPMPKVFSOQYBZ-AEFFLSMTSA-N 1 1 360.457 3.629 50 0 FHAAMO COc1ccc(CN2CC[N@H+]3CCC[C@H]3[C@@H]2C2CCCCC2)cc1OC ZINC000244817064 571074966 /nfs/dbraw/zinc/07/49/66/571074966.db2.gz STTKBBNUQHXQAG-UGKGYDQZSA-N 1 1 358.526 3.933 50 0 FHAAMO CC[C@H](CO)Nc1nc(C[NH+]2CCC(C)CC2)nc2sc3c(c21)CCC3 ZINC000012755148 571077710 /nfs/dbraw/zinc/07/77/10/571077710.db2.gz GDQZLFKICKYXSV-CQSZACIVSA-N 1 1 374.554 3.595 50 0 FHAAMO CC[C@@H](C)C(=O)NCC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000040158138 571088582 /nfs/dbraw/zinc/08/85/82/571088582.db2.gz LJISGTCJRJJPCB-MRXNPFEDSA-N 1 1 359.514 3.552 50 0 FHAAMO COc1ccc(COC[C@@H](O)C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)cc1 ZINC000040160720 571089866 /nfs/dbraw/zinc/08/98/66/571089866.db2.gz WDTSVCNVMNPGFD-GCJKJVERSA-N 1 1 369.505 3.873 50 0 FHAAMO C[C@@H]([NH2+][C@H](C)c1ccccc1Br)C(=O)NCc1ccccc1 ZINC000040161194 571089874 /nfs/dbraw/zinc/08/98/74/571089874.db2.gz VYDVINSLTKCAEF-ZIAGYGMSSA-N 1 1 361.283 3.805 50 0 FHAAMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)[C@@H](C)C1 ZINC000229890585 571095617 /nfs/dbraw/zinc/09/56/17/571095617.db2.gz VAULPUZGMTZBRF-YWZLYKJASA-N 1 1 369.513 3.683 50 0 FHAAMO CC[N@@H+](Cc1ccccc1)[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccccc1 ZINC000245380731 571097776 /nfs/dbraw/zinc/09/77/76/571097776.db2.gz IZROUTVHUSDGCV-RTWAWAEBSA-N 1 1 372.534 3.798 50 0 FHAAMO C[N@@H+](C[C@H](O)COc1ccc(C(=O)c2ccccc2)cc1)C1CCCC1 ZINC000012783140 571099440 /nfs/dbraw/zinc/09/94/40/571099440.db2.gz MERKDHPZGMIWHP-FQEVSTJZSA-N 1 1 353.462 3.532 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(-n2ccc3ccccc32)s1 ZINC000015732312 571112152 /nfs/dbraw/zinc/11/21/52/571112152.db2.gz KVRGAKSOTZGEFE-MRXNPFEDSA-N 1 1 353.491 3.906 50 0 FHAAMO C[N@H+](CCC(=O)Nc1ccc(F)cc1F)CCn1ccc2ccccc21 ZINC000243956733 571113122 /nfs/dbraw/zinc/11/31/22/571113122.db2.gz CCYGLXYSIPJAQP-UHFFFAOYSA-N 1 1 357.404 3.880 50 0 FHAAMO COc1cccc(-c2ncc(CNC(=O)C[C@@H](C)n3cc[nH+]c3C)s2)c1 ZINC000244742247 571115791 /nfs/dbraw/zinc/11/57/91/571115791.db2.gz OEKCSBZJFAYBIY-CYBMUJFWSA-N 1 1 370.478 3.591 50 0 FHAAMO NC(=O)COc1cccc(C[N@@H+](Cc2cccnc2)C2CCCCCC2)c1 ZINC000055100487 571116522 /nfs/dbraw/zinc/11/65/22/571116522.db2.gz RSGHEJNSTAJYMH-UHFFFAOYSA-N 1 1 367.493 3.671 50 0 FHAAMO COc1cc(C[N@H+](Cc2cc(-c3ccncc3)no2)C2CC2)ccc1O ZINC000244796153 571117436 /nfs/dbraw/zinc/11/74/36/571117436.db2.gz RUARLXRROGHDHA-UHFFFAOYSA-N 1 1 351.406 3.615 50 0 FHAAMO COc1cc(C[N@@H+](Cc2cc(-c3ccncc3)no2)C2CC2)ccc1O ZINC000244796153 571117437 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Cc1ccc(C(=O)Nc2ccc(NC(=O)[C@@H](C)n3cc[nH+]c3C)cc2)o1 ZINC000055369324 571119933 /nfs/dbraw/zinc/11/99/33/571119933.db2.gz DTVOAMVFRFLBJZ-CYBMUJFWSA-N 1 1 352.394 3.545 50 0 FHAAMO O=C1NCCCC[C@@H]1[NH2+]Cc1ccc(Sc2ccc(Cl)cc2)o1 ZINC000055385890 571120238 /nfs/dbraw/zinc/12/02/38/571120238.db2.gz YGICFKDWKJGANH-HNNXBMFYSA-N 1 1 350.871 3.843 50 0 FHAAMO C[N@H+]1CC[C@H](NC(=O)NCc2nc(C(C)(C)C)cs2)[C@H]1c1ccccc1 ZINC000179152908 571124850 /nfs/dbraw/zinc/12/48/50/571124850.db2.gz VXIBVZVHNSXEGO-MAUKXSAKSA-N 1 1 372.538 3.685 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H]1c1ccc[nH]1)N1CCC(Cc2ccccc2)CC1 ZINC000058084986 571125077 /nfs/dbraw/zinc/12/50/77/571125077.db2.gz ZNDDBKHLNWEOTE-NRFANRHFSA-N 1 1 351.494 3.633 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H]1c1ccc[nH]1)N1CCC(Cc2ccccc2)CC1 ZINC000058084986 571125078 /nfs/dbraw/zinc/12/50/78/571125078.db2.gz ZNDDBKHLNWEOTE-NRFANRHFSA-N 1 1 351.494 3.633 50 0 FHAAMO CC(C)CC[N@H+]1CCN(Cc2cccc(C(F)(F)F)c2)C[C@H]1CCO ZINC000104344815 571126223 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CC1(C)C[N@H+](C2CCN(C(=O)c3ccccn3)CC2)C[C@@H]1c1ccccc1 ZINC000426379724 571216920 /nfs/dbraw/zinc/21/69/20/571216920.db2.gz MLFFVKOVYWQIGN-HXUWFJFHSA-N 1 1 363.505 3.812 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3ccc(F)cc3)[C@H]1C[C@@H](Oc1ccccn1)CC2 ZINC000426444611 571225900 /nfs/dbraw/zinc/22/59/00/571225900.db2.gz OGPJMZHBJCAHTC-IRFCIJBXSA-N 1 1 356.441 3.812 50 0 FHAAMO Fc1cc(F)cc(C[N@H+]2CC[C@H]3CN(c4nc5ccccc5o4)C[C@H]32)c1 ZINC000082087623 571227877 /nfs/dbraw/zinc/22/78/77/571227877.db2.gz OYVNOYGNDVLRMF-KBXCAEBGSA-N 1 1 355.388 3.817 50 0 FHAAMO Cc1cc(C(=O)N(C)C[C@H]2Cc3ccccc3C[N@H+]2C)c2cccc(C)c2n1 ZINC000082108863 571228321 /nfs/dbraw/zinc/22/83/21/571228321.db2.gz AXXMJYKSHCJENJ-HXUWFJFHSA-N 1 1 373.500 3.980 50 0 FHAAMO Cc1cccc2cc(C(=O)N(C)C[C@@H]3Cc4ccccc4C[N@H+]3C)n(C)c21 ZINC000082160694 571229576 /nfs/dbraw/zinc/22/95/76/571229576.db2.gz DHPNWKTYJNGTFM-FQEVSTJZSA-N 1 1 361.489 3.615 50 0 FHAAMO O=C(c1cc(F)cc(F)c1)c1ccccc1C[NH+]1CCC2(CC1)OCCO2 ZINC000085651615 571233833 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ZINC000058308656 571131045 /nfs/dbraw/zinc/13/10/45/571131045.db2.gz CKIGWSBGBIPDQY-MRXNPFEDSA-N 1 1 353.466 3.916 50 0 FHAAMO Cc1ccccc1[C@@]1(O)CC[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000252485266 571132192 /nfs/dbraw/zinc/13/21/92/571132192.db2.gz GPVRTBNXHUOOCB-HXUWFJFHSA-N 1 1 358.869 3.571 50 0 FHAAMO O=C(N[C@H]1CCOc2ccccc21)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000058423472 571132906 /nfs/dbraw/zinc/13/29/06/571132906.db2.gz LHSJRDOYLDHFDF-PXNSSMCTSA-N 1 1 368.452 3.678 50 0 FHAAMO O=C(N[C@@H]1CCOc2ccccc21)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000058423469 571132917 /nfs/dbraw/zinc/13/29/17/571132917.db2.gz LHSJRDOYLDHFDF-FXAWDEMLSA-N 1 1 368.452 3.678 50 0 FHAAMO CNC(=O)c1ccc(C[N@@H+](C[C@@H](O)c2ccccc2)C2CCCCC2)o1 ZINC000252492028 571133042 /nfs/dbraw/zinc/13/30/42/571133042.db2.gz MBDBOUBBVGVTAM-LJQANCHMSA-N 1 1 356.466 3.508 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H]1Cc1ccccc1Cl)N1CCc2ccccc2C1 ZINC000060038509 571136008 /nfs/dbraw/zinc/13/60/08/571136008.db2.gz CLTBQUDMLRFHCD-FQEVSTJZSA-N 1 1 368.908 3.932 50 0 FHAAMO Cc1ccc([C@H](CNC(=O)COc2cc(C)c(Cl)c(C)c2)[NH+](C)C)o1 ZINC000015860132 571138108 /nfs/dbraw/zinc/13/81/08/571138108.db2.gz XIQPZMBCMTWVRS-INIZCTEOSA-N 1 1 364.873 3.656 50 0 FHAAMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N(C)C(=O)c1cc(C2CC2)on1 ZINC000076649864 571139425 /nfs/dbraw/zinc/13/94/25/571139425.db2.gz VSMADGCCOUIGJA-BEFAXECRSA-N 1 1 353.466 3.535 50 0 FHAAMO CCC[N@@H+](Cc1cccc(OC2(C(=O)[O-])CC[NH2+]CC2)c1)[C@@H](C)C(C)C ZINC000063869070 571140222 /nfs/dbraw/zinc/14/02/22/571140222.db2.gz SZDSZBXASPPAOE-KRWDZBQOSA-N 1 1 362.514 3.529 50 0 FHAAMO COc1ccc(NC(=O)c2cccc(C[N@H+]3CCC[C@H]3C)c2)cc1OC ZINC000065380427 571142497 /nfs/dbraw/zinc/14/24/97/571142497.db2.gz LRRGRFFNVGQJLU-OAHLLOKOSA-N 1 1 354.450 3.940 50 0 FHAAMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccnc(-c4cccc(O)c4)c3)C2)n1 ZINC000065381943 571142525 /nfs/dbraw/zinc/14/25/25/571142525.db2.gz GZLDANFKPVOXOT-GOSISDBHSA-N 1 1 361.445 3.853 50 0 FHAAMO CCCC[N@@H+](C)C[C@H](C)OC(=O)C(O)(c1ccccc1)c1ccccc1 ZINC000067319149 571146623 /nfs/dbraw/zinc/14/66/23/571146623.db2.gz HDWDSQSFHHWROG-SFHVURJKSA-N 1 1 355.478 3.586 50 0 FHAAMO Cc1cc(C)n([C@@H]2CC[N@H+](Cc3nc(-c4ccc(Cl)cc4)no3)C2)n1 ZINC000067605299 571147477 /nfs/dbraw/zinc/14/74/77/571147477.db2.gz IJTZALQJJGKNAZ-MRXNPFEDSA-N 1 1 357.845 3.650 50 0 FHAAMO Cc1cc(C)n([C@@H]2CC[N@@H+](Cc3nc(-c4ccc(Cl)cc4)no3)C2)n1 ZINC000067605299 571147481 /nfs/dbraw/zinc/14/74/81/571147481.db2.gz IJTZALQJJGKNAZ-MRXNPFEDSA-N 1 1 357.845 3.650 50 0 FHAAMO CC(C)c1cc(C2CC[NH+](Cc3cnc(-c4ccccn4)nc3)CC2)n[nH]1 ZINC000067678279 571148230 /nfs/dbraw/zinc/14/82/30/571148230.db2.gz ZUQXECWGSHNKDW-UHFFFAOYSA-N 1 1 362.481 3.765 50 0 FHAAMO Cc1nn(C(C)C)c(C)c1C[N@H+]1CC[C@@](C)(O)[C@@H](Cc2ccccc2)C1 ZINC000067690552 571148564 /nfs/dbraw/zinc/14/85/64/571148564.db2.gz BCHRYDVVKNYQJG-RBBKRZOGSA-N 1 1 355.526 3.896 50 0 FHAAMO C[C@@H]1CCC[N@@H+](Cc2cccc(C(=O)Nc3cc(C4CC4)nn3C)c2)C1 ZINC000067725466 571148891 /nfs/dbraw/zinc/14/88/91/571148891.db2.gz 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Cc1ccc(CN2CCCN(C)C3(CC[NH+](C)CC3)C2)c(Cl)c1Cl ZINC000067934636 571152136 /nfs/dbraw/zinc/15/21/36/571152136.db2.gz HYAZWWVEGDGODM-UHFFFAOYSA-N 1 1 370.368 3.904 50 0 FHAAMO COc1ccc2cc([C@@H]3C[N@H+](CCC(=O)NC(C)(C)C)CCO3)ccc2c1 ZINC000071479634 571162396 /nfs/dbraw/zinc/16/23/96/571162396.db2.gz CEGQCXIWPPYPKW-FQEVSTJZSA-N 1 1 370.493 3.527 50 0 FHAAMO COc1ccc2cc([C@@H]3C[N@@H+](CCC(=O)NC(C)(C)C)CCO3)ccc2c1 ZINC000071479634 571162398 /nfs/dbraw/zinc/16/23/98/571162398.db2.gz CEGQCXIWPPYPKW-FQEVSTJZSA-N 1 1 370.493 3.527 50 0 FHAAMO Cc1cccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n1 ZINC000071707733 571163511 /nfs/dbraw/zinc/16/35/11/571163511.db2.gz CUTWYGZQKILSSZ-NRFANRHFSA-N 1 1 369.484 3.788 50 0 FHAAMO CCc1[nH]c2c(cc(C)cc2CNC(=O)CCn2cc[nH+]c2CC)c1C ZINC000071746896 571164351 /nfs/dbraw/zinc/16/43/51/571164351.db2.gz BYRAZNJTVFEFHH-UHFFFAOYSA-N 1 1 352.482 3.813 50 0 FHAAMO Cc1cncc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1 ZINC000071750508 571164578 /nfs/dbraw/zinc/16/45/78/571164578.db2.gz JKDJMLRRGQDYLX-NRFANRHFSA-N 1 1 369.484 3.902 50 0 FHAAMO CC(C)[C@@H]1CN(Cc2cc(-c3ccccn3)no2)CCC[N@H+]1CC1CC1 ZINC000071755340 571165099 /nfs/dbraw/zinc/16/50/99/571165099.db2.gz USWHMWNSWNPAQC-NRFANRHFSA-N 1 1 354.498 3.679 50 0 FHAAMO O=C(CCC[N@@H+]1CC[C@@H](OC(=O)Nc2ccccc2)C1)c1ccccc1 ZINC000071769291 571166265 /nfs/dbraw/zinc/16/62/65/571166265.db2.gz QFHRZOFCJAYEQU-LJQANCHMSA-N 1 1 352.434 3.973 50 0 FHAAMO Cc1cccc2nc(C3CC[NH+](Cc4ccc(OCCO)cc4)CC3)[nH]c21 ZINC000072121828 571170271 /nfs/dbraw/zinc/17/02/71/571170271.db2.gz VFLXCGPVTVJLHR-UHFFFAOYSA-N 1 1 365.477 3.622 50 0 FHAAMO C[C@@H]1CCC[N@H+]1Cc1cc2n(n1)CCCN(Cc1ccc3[nH]ccc3c1)C2 ZINC000072131964 571171004 /nfs/dbraw/zinc/17/10/04/571171004.db2.gz UDNVRNVASRNTDN-QGZVFWFLSA-N 1 1 363.509 3.755 50 0 FHAAMO CSc1cccc(NC(=O)N2CCCC[C@H]2CC[NH+]2CCOCC2)c1 ZINC000072144037 571172285 /nfs/dbraw/zinc/17/22/85/571172285.db2.gz WAFLKHIQSHXMIX-KRWDZBQOSA-N 1 1 363.527 3.517 50 0 FHAAMO COc1ccc(NC(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)cc1 ZINC000072161678 571175835 /nfs/dbraw/zinc/17/58/35/571175835.db2.gz ZMXFSNLSRRILEX-QGZVFWFLSA-N 1 1 357.429 3.620 50 0 FHAAMO COc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)cc1 ZINC000072161678 571175838 /nfs/dbraw/zinc/17/58/38/571175838.db2.gz ZMXFSNLSRRILEX-QGZVFWFLSA-N 1 1 357.429 3.620 50 0 FHAAMO COc1c[nH]c(CN2CCCC[C@H]2c2ccc(C[NH+](C)C)cc2)cc1=O ZINC000072166644 571176636 /nfs/dbraw/zinc/17/66/36/571176636.db2.gz BJHZUQGFMMPROB-IBGZPJMESA-N 1 1 355.482 3.585 50 0 FHAAMO CSc1nccc(N2CC[C@]3(C2)CCC[N@@H+](Cc2cccc(C)c2)C3)n1 ZINC000072173944 571177651 /nfs/dbraw/zinc/17/76/51/571177651.db2.gz DWHFNOGNZKEOAD-OAQYLSRUSA-N 1 1 368.550 3.999 50 0 FHAAMO Cc1ccccc1N1CCC[N@@H+](Cc2cnc(N3CCCC3)s2)CC1 ZINC000072172377 571177740 /nfs/dbraw/zinc/17/77/40/571177740.db2.gz LBXDKFFKWYCVMT-UHFFFAOYSA-N 1 1 356.539 3.764 50 0 FHAAMO C[N@H+](CC(=O)Nc1cccc(F)c1)Cc1ccc(OC(F)(F)F)cc1 ZINC000013009365 571188370 /nfs/dbraw/zinc/18/83/70/571188370.db2.gz FMZCLGYXQYEMIS-UHFFFAOYSA-N 1 1 356.319 3.795 50 0 FHAAMO C[N@@H+](CC(=O)Nc1cccc(F)c1)Cc1ccc(OC(F)(F)F)cc1 ZINC000013009365 571188371 /nfs/dbraw/zinc/18/83/71/571188371.db2.gz FMZCLGYXQYEMIS-UHFFFAOYSA-N 1 1 356.319 3.795 50 0 FHAAMO C[C@@H](CCc1ccccc1)NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000013023472 571189867 /nfs/dbraw/zinc/18/98/67/571189867.db2.gz XQVPHKYEWSZJAI-IBGZPJMESA-N 1 1 351.494 3.535 50 0 FHAAMO C/C(=C\c1ccccc1)C[N@@H+]1CCN(Cc2ccc(C)o2)[C@H](CCO)C1 ZINC000036385615 571192518 /nfs/dbraw/zinc/19/25/18/571192518.db2.gz FYDSCXRFJASYFS-IYYMRFBLSA-N 1 1 354.494 3.560 50 0 FHAAMO C/C(=C\c1ccccc1)C[N@H+]1CCN(Cc2ccc(C)o2)[C@H](CCO)C1 ZINC000036385615 571192521 /nfs/dbraw/zinc/19/25/21/571192521.db2.gz FYDSCXRFJASYFS-IYYMRFBLSA-N 1 1 354.494 3.560 50 0 FHAAMO O=C([C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12)N1CCOc2ccccc2C1 ZINC000299758756 571192763 /nfs/dbraw/zinc/19/27/63/571192763.db2.gz MXQRCSYKGAZEIK-HBMCJLEFSA-N 1 1 362.473 3.633 50 0 FHAAMO CCc1[nH+]ccn1CCCNc1cc(-c2ccc(F)cc2)nc2ccnn21 ZINC000072423459 571193780 /nfs/dbraw/zinc/19/37/80/571193780.db2.gz LVRHULOLMKOQKN-UHFFFAOYSA-N 1 1 364.428 3.797 50 0 FHAAMO Cc1ccc(-n2cc(C[N@H+](C)C[C@@H](C)O)c(-c3ccc(F)cc3)n2)cc1 ZINC000072426149 571194483 /nfs/dbraw/zinc/19/44/83/571194483.db2.gz VSLXYCCYKPTMTJ-MRXNPFEDSA-N 1 1 353.441 3.799 50 0 FHAAMO Cc1ccc(-n2cc(C[N@H+](C)C[C@H](C)O)c(-c3ccc(F)cc3)n2)cc1 ZINC000072426150 571194521 /nfs/dbraw/zinc/19/45/21/571194521.db2.gz VSLXYCCYKPTMTJ-INIZCTEOSA-N 1 1 353.441 3.799 50 0 FHAAMO C[N@@H+](Cc1cccc(CN2CCOCC2)c1)Cc1cccc2cnccc21 ZINC000072432943 571195940 /nfs/dbraw/zinc/19/59/40/571195940.db2.gz QFBNBJKCDCCQBE-UHFFFAOYSA-N 1 1 361.489 3.699 50 0 FHAAMO c1cc([C@@H]2CCCO2)sc1CN1CC[NH+](CCOc2ccccc2)CC1 ZINC000072463479 571197853 /nfs/dbraw/zinc/19/78/53/571197853.db2.gz ZVFVBHKEWWCKHG-FQEVSTJZSA-N 1 1 372.534 3.796 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3cnc(-c4ccccc4C)s3)[C@H]1C[C@H](O)CC2 ZINC000299781249 571197874 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O=C(C[C@H]1CCc2ccccc21)N1CCC[N@H+](Cc2ccccc2F)CC1 ZINC000299794015 571201638 /nfs/dbraw/zinc/20/16/38/571201638.db2.gz IKQATBYGHQDWJQ-LJQANCHMSA-N 1 1 366.480 3.980 50 0 FHAAMO c1cnn(CCC2CC[NH+](C[C@@H]3CCCN(Cc4ccccc4)C3)CC2)c1 ZINC000299799297 571203051 /nfs/dbraw/zinc/20/30/51/571203051.db2.gz RAWYIEJWBMZPSM-QHCPKHFHSA-N 1 1 366.553 3.897 50 0 FHAAMO CCc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]nc2-c2cccc(OC)c2)on1 ZINC000075448560 571203139 /nfs/dbraw/zinc/20/31/39/571203139.db2.gz LLKWCSYKKAQIBS-SFHVURJKSA-N 1 1 352.438 3.973 50 0 FHAAMO CCc1cc([C@H]2CCC[N@H+]2Cc2c[nH]nc2-c2cccc(OC)c2)on1 ZINC000075448582 571203160 /nfs/dbraw/zinc/20/31/60/571203160.db2.gz LLKWCSYKKAQIBS-GOSISDBHSA-N 1 1 352.438 3.973 50 0 FHAAMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C2CCC2)CC1 ZINC000064448112 571206819 /nfs/dbraw/zinc/20/68/19/571206819.db2.gz RDUHKQBWTBJMQP-UHFFFAOYSA-N 1 1 354.416 3.928 50 0 FHAAMO C[NH+](C)Cc1ccc([C@H]2CCCCN2C(=O)c2cc(C3CC3)[nH]n2)cc1 ZINC000077338540 571207925 /nfs/dbraw/zinc/20/79/25/571207925.db2.gz DHBIDPUXKBAKSJ-HXUWFJFHSA-N 1 1 352.482 3.716 50 0 FHAAMO Cn1ccnc1C(=O)[C@@H]1CCC[N@H+](Cc2ccc3cccc(Cl)c3n2)C1 ZINC000077374976 571209184 /nfs/dbraw/zinc/20/91/84/571209184.db2.gz JYDBSEPNQFTKQR-OAHLLOKOSA-N 1 1 368.868 3.717 50 0 FHAAMO Cn1ccnc1C(=O)[C@@H]1CCC[N@@H+](Cc2ccc3cccc(Cl)c3n2)C1 ZINC000077374976 571209185 /nfs/dbraw/zinc/20/91/85/571209185.db2.gz JYDBSEPNQFTKQR-OAHLLOKOSA-N 1 1 368.868 3.717 50 0 FHAAMO Cc1c(C[N@H+]2CCCC[C@@H]2CCN2CCOCC2)[nH]c2ccc(F)cc12 ZINC000077436768 571211552 /nfs/dbraw/zinc/21/15/52/571211552.db2.gz KFWPSMLGOJKHFY-GOSISDBHSA-N 1 1 359.489 3.692 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 ZINC000077488839 571213371 /nfs/dbraw/zinc/21/33/71/571213371.db2.gz FOACBJRWAUIKHS-GOSISDBHSA-N 1 1 351.454 3.520 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000077488839 571213373 /nfs/dbraw/zinc/21/33/73/571213373.db2.gz FOACBJRWAUIKHS-GOSISDBHSA-N 1 1 351.454 3.520 50 0 FHAAMO Cc1nccn1CC[C@H]1CCCC[N@H+]1Cc1cc(-c2ccccn2)no1 ZINC000077489127 571213766 /nfs/dbraw/zinc/21/37/66/571213766.db2.gz YQTTVUZSVSIMTJ-QGZVFWFLSA-N 1 1 351.454 3.686 50 0 FHAAMO COc1cc(C[N@H+]2CC[C@]3(OC)CC[C@H](OCC4CC4)C[C@H]23)ccc1C ZINC000426407687 571221118 /nfs/dbraw/zinc/22/11/18/571221118.db2.gz RPBLIDBHDQZGSC-ILWGZMRPSA-N 1 1 359.510 3.942 50 0 FHAAMO Cc1cc(F)ccc1-c1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)[N@@H+](C)C3)cc1 ZINC000426410742 571221546 /nfs/dbraw/zinc/22/15/46/571221546.db2.gz RZUKWBJDLPHHHP-JXFKEZNVSA-N 1 1 352.453 3.967 50 0 FHAAMO O=C(NCC[C@@H]1CCCC[N@H+]1Cc1ccccc1)N1CCC(F)(F)CC1 ZINC000426443466 571225936 /nfs/dbraw/zinc/22/59/36/571225936.db2.gz VIAIIUSIWCZXLZ-SFHVURJKSA-N 1 1 365.468 3.872 50 0 FHAAMO C[C@@H](NC(=O)C1CC1)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000023181112 571226493 /nfs/dbraw/zinc/22/64/93/571226493.db2.gz ICPZCIGYUOLMBY-OXQOHEQNSA-N 1 1 369.534 3.526 50 0 FHAAMO Cn1c(C(=O)N2CCC[N@H+](C3CCCC3)CC2)ccc1-c1ccccc1 ZINC000082087036 571227667 /nfs/dbraw/zinc/22/76/67/571227667.db2.gz LUXIZJOYFKVSRF-UHFFFAOYSA-N 1 1 351.494 3.783 50 0 FHAAMO O=C(N[C@H]1CCC[N@H+](Cc2cnc[nH]2)CC1)c1cc2c(s1)CCCCC2 ZINC000082083083 571227677 /nfs/dbraw/zinc/22/76/77/571227677.db2.gz GJQNIPHUHADVDH-INIZCTEOSA-N 1 1 372.538 3.525 50 0 FHAAMO O=C(N[C@H]1CCC[N@@H+](Cc2cnc[nH]2)CC1)c1cc2c(s1)CCCCC2 ZINC000082083083 571227678 /nfs/dbraw/zinc/22/76/78/571227678.db2.gz GJQNIPHUHADVDH-INIZCTEOSA-N 1 1 372.538 3.525 50 0 FHAAMO O=C(N[C@H]1CCC[N@H+](Cc2c[nH]cn2)CC1)c1cc2c(s1)CCCCC2 ZINC000082083083 571227679 /nfs/dbraw/zinc/22/76/79/571227679.db2.gz GJQNIPHUHADVDH-INIZCTEOSA-N 1 1 372.538 3.525 50 0 FHAAMO O=C(N[C@H]1CCC[N@@H+](Cc2c[nH]cn2)CC1)c1cc2c(s1)CCCCC2 ZINC000082083083 571227680 /nfs/dbraw/zinc/22/76/80/571227680.db2.gz GJQNIPHUHADVDH-INIZCTEOSA-N 1 1 372.538 3.525 50 0 FHAAMO CCCCC(=O)N1CCN(c2cc(Nc3ccc(C)cc3)[nH+]c(C)n2)CC1 ZINC000033318297 571233157 /nfs/dbraw/zinc/23/31/57/571233157.db2.gz DTZAEJVQUVZBSU-UHFFFAOYSA-N 1 1 367.497 3.676 50 0 FHAAMO COc1cc(C[N@H+]2CC[C@]3(OC)CC[C@@H](OCC4CC4)C[C@H]23)ccc1F ZINC000426707196 571235861 /nfs/dbraw/zinc/23/58/61/571235861.db2.gz LFSHFMOXXUDBBK-JRGCBEDISA-N 1 1 363.473 3.773 50 0 FHAAMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(-c3cc(F)ccc3C(C)=O)cc2)C1 ZINC000426712875 571236258 /nfs/dbraw/zinc/23/62/58/571236258.db2.gz XOWVHBZPOFWCEJ-MRXNPFEDSA-N 1 1 368.452 3.767 50 0 FHAAMO CSc1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CN(Cc1cccnc1)C2 ZINC000091452687 571239846 /nfs/dbraw/zinc/23/98/46/571239846.db2.gz DEUBZACZABCXGE-AZUAARDMSA-N 1 1 353.535 3.900 50 0 FHAAMO CNc1nc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@@H+](C)C3)cs1 ZINC000091643670 571241496 /nfs/dbraw/zinc/24/14/96/571241496.db2.gz IPKHVDZTOSRSHL-SFHVURJKSA-N 1 1 370.566 3.886 50 0 FHAAMO CCCc1cc(N2CC[C@]3(C2)CCCN(C2CCCCC2)C3=O)nc(C)[nH+]1 ZINC000091693804 571242540 /nfs/dbraw/zinc/24/25/40/571242540.db2.gz RXTPZGFMDSVSBW-QFIPXVFZSA-N 1 1 370.541 3.889 50 0 FHAAMO O=C(c1cccn1C1CC1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccc(F)cc1)C2 ZINC000091725323 571243020 /nfs/dbraw/zinc/24/30/20/571243020.db2.gz MUFOZSPLZXKLSI-FXAWDEMLSA-N 1 1 367.468 3.699 50 0 FHAAMO CC[C@H](C)[N@H+](Cc1ccc(F)cc1F)C[C@@H](O)COCc1ccco1 ZINC000169678033 571247036 /nfs/dbraw/zinc/24/70/36/571247036.db2.gz IOOGXHSFONREPU-WMLDXEAASA-N 1 1 353.409 3.736 50 0 FHAAMO COc1ccc(C[N@@H+](C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1 ZINC000006940528 571255250 /nfs/dbraw/zinc/25/52/50/571255250.db2.gz GMYMEZZHOLIHEL-SIKLNZKXSA-N 1 1 355.478 3.582 50 0 FHAAMO Cc1ccccc1NC(=O)N1CC[NH+](Cc2cn(C)c3ccccc23)CC1 ZINC000065330052 571261710 /nfs/dbraw/zinc/26/17/10/571261710.db2.gz PGEAXHKLJZWTDT-UHFFFAOYSA-N 1 1 362.477 3.836 50 0 FHAAMO CCn1c2ccccc2nc1[C@@H](C)[NH2+]Cc1ccc2c(c1)sc(=O)n2C ZINC000170091627 571262313 /nfs/dbraw/zinc/26/23/13/571262313.db2.gz XPHBTQPSEIXGPC-CYBMUJFWSA-N 1 1 366.490 3.820 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)Nc1ccc2oc(C3CC3)nc2c1)c1ccco1 ZINC000065474769 571263743 /nfs/dbraw/zinc/26/37/43/571263743.db2.gz CWOSCRWXCZCUHS-HNNXBMFYSA-N 1 1 354.410 3.723 50 0 FHAAMO Cc1cc(C(=O)N[C@H](C[N@@H+](C)Cc2ccccc2)C(C)C)nn1C(C)(C)C ZINC000170597506 571266644 /nfs/dbraw/zinc/26/66/44/571266644.db2.gz SNOFWHNLTKYAAN-HXUWFJFHSA-N 1 1 370.541 3.833 50 0 FHAAMO C[N@@H+](CCc1ccc(F)cc1)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000170623424 571269154 /nfs/dbraw/zinc/26/91/54/571269154.db2.gz KXGVCLIVLPWCJO-KRWDZBQOSA-N 1 1 350.478 3.947 50 0 FHAAMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000252492663 571280992 /nfs/dbraw/zinc/28/09/92/571280992.db2.gz MRUPDQDCEIQYJF-QFIPXVFZSA-N 1 1 370.493 3.583 50 0 FHAAMO CCOc1ccccc1NC(=O)C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000007788123 571289020 /nfs/dbraw/zinc/28/90/20/571289020.db2.gz DHJGSEYPXSWMHQ-UHFFFAOYSA-N 1 1 352.478 3.979 50 0 FHAAMO COc1ccc(COC[C@H](O)C[N@@H+](Cc2ccccc2)[C@@H](C)C2CC2)cc1 ZINC000195541361 571289616 /nfs/dbraw/zinc/28/96/16/571289616.db2.gz WDTSVCNVMNPGFD-PGRDOPGGSA-N 1 1 369.505 3.873 50 0 FHAAMO COc1ccc(OC)c(CN2CC[N@H+]3CCC[C@H]3[C@H]2C2CCCCC2)c1 ZINC000022859948 571308328 /nfs/dbraw/zinc/30/83/28/571308328.db2.gz WWUIJHJNWLBGLM-RBBKRZOGSA-N 1 1 358.526 3.933 50 0 FHAAMO O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000067615026 571309124 /nfs/dbraw/zinc/30/91/24/571309124.db2.gz KHJLUFDYYNHRMH-RBUKOAKNSA-N 1 1 355.507 3.522 50 0 FHAAMO CN(C[C@@H]1CCC[N@H+]2CCCC[C@H]12)C(=O)CCn1ccc2ccccc21 ZINC000253413001 571312467 /nfs/dbraw/zinc/31/24/67/571312467.db2.gz SSKWKXBFZCRUBK-PZJWPPBQSA-N 1 1 353.510 3.754 50 0 FHAAMO Cc1ccc(C2(NC(=O)N(C)[C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000584895382 571315369 /nfs/dbraw/zinc/31/53/69/571315369.db2.gz UGZKOIDSISIVGT-OAQYLSRUSA-N 1 1 363.505 3.900 50 0 FHAAMO CCc1ccc2[nH+]cc(C(=O)c3ccccc3)c(N3CCN(C)CC3)c2c1 ZINC000021158454 571333294 /nfs/dbraw/zinc/33/32/94/571333294.db2.gz BAUYYMWTFKLFGP-UHFFFAOYSA-N 1 1 359.473 3.780 50 0 FHAAMO CCc1ccc2ncc(C(=O)c3ccccc3)c(N3CC[NH+](C)CC3)c2c1 ZINC000021158454 571333295 /nfs/dbraw/zinc/33/32/95/571333295.db2.gz BAUYYMWTFKLFGP-UHFFFAOYSA-N 1 1 359.473 3.780 50 0 FHAAMO CNC(=O)c1ccc(C[NH2+][C@@H]2CCCc3cn(C4CCCC4)nc32)cc1 ZINC000096002764 571333747 /nfs/dbraw/zinc/33/37/47/571333747.db2.gz NFTNJXSQGLOMMV-LJQANCHMSA-N 1 1 352.482 3.525 50 0 FHAAMO Cc1nc(C[N@@H+]2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)oc1C ZINC000096000093 571333754 /nfs/dbraw/zinc/33/37/54/571333754.db2.gz FSWSNZNJYNSNPU-MRXNPFEDSA-N 1 1 371.485 3.523 50 0 FHAAMO Cc1nc(C[N@H+]2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)oc1C ZINC000096000093 571333755 /nfs/dbraw/zinc/33/37/55/571333755.db2.gz FSWSNZNJYNSNPU-MRXNPFEDSA-N 1 1 371.485 3.523 50 0 FHAAMO Cc1ccc(CNC(=O)N2CCC(C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)cc1 ZINC000021718261 571335907 /nfs/dbraw/zinc/33/59/07/571335907.db2.gz UXLCDEYCHJPGKZ-KDURUIRLSA-N 1 1 357.542 3.895 50 0 FHAAMO CC[NH+]1CCN([C@H](c2cccs2)[C@H](C)NC(=O)c2cccc(C)c2)CC1 ZINC000022460087 571336857 /nfs/dbraw/zinc/33/68/57/571336857.db2.gz BNNOXCNTTHVEHA-PXNSSMCTSA-N 1 1 371.550 3.554 50 0 FHAAMO CC(C)C[C@@H](CNC(=O)c1ccc(-c2ccccc2)cc1)[NH+]1CCOCC1 ZINC000022611748 571337026 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/nfs/dbraw/zinc/04/25/74/211042574.db2.gz LZVSSDAFJLVGJS-INIZCTEOSA-N 1 1 365.433 3.635 50 0 FHAAMO O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000013003227 211018505 /nfs/dbraw/zinc/01/85/05/211018505.db2.gz UBYBEHYDZSYWIY-GOSISDBHSA-N 1 1 362.395 3.639 50 0 FHAAMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1cc(=O)oc2cc(O)ccc12 ZINC000012996464 211017925 /nfs/dbraw/zinc/01/79/25/211017925.db2.gz LZVHRAMKNXREKL-UHFFFAOYSA-N 1 1 359.809 3.663 50 0 FHAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)NCc2ccccc2Cl)cc1 ZINC000012894806 211003802 /nfs/dbraw/zinc/00/38/02/211003802.db2.gz JIMFUMFCHJPVPX-LJQANCHMSA-N 1 1 358.869 3.802 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)NCc2ccccc2Cl)cc1 ZINC000012894806 211003805 /nfs/dbraw/zinc/00/38/05/211003805.db2.gz JIMFUMFCHJPVPX-LJQANCHMSA-N 1 1 358.869 3.802 50 0 FHAAMO C[N@@H+]1CCN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@@H]1c1ccccc1 ZINC000019789852 220296960 /nfs/dbraw/zinc/29/69/60/220296960.db2.gz MOUOUQRHZNXDQP-GOSISDBHSA-N 1 1 368.868 3.879 50 0 FHAAMO C[N@H+]1CCN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@@H]1c1ccccc1 ZINC000019789852 220296964 /nfs/dbraw/zinc/29/69/64/220296964.db2.gz MOUOUQRHZNXDQP-GOSISDBHSA-N 1 1 368.868 3.879 50 0 FHAAMO Cc1cccn2c(=O)cc(C[NH2+][C@H](c3cccs3)c3ccccc3)nc12 ZINC000009741202 210337260 /nfs/dbraw/zinc/33/72/60/210337260.db2.gz ZCWZBUDJSQJWNE-FQEVSTJZSA-N 1 1 361.470 3.944 50 0 FHAAMO O=C(C[NH+]1CCCCC1)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000001016709 210302360 /nfs/dbraw/zinc/30/23/60/210302360.db2.gz WBABMEMZBVHFSC-OAHLLOKOSA-N 1 1 359.520 3.973 50 0 FHAAMO O=C1CN2C(=[NH+]c3ccc(Br)cc3[C@H]2c2ccccc2)CN1 ZINC000001013373 210301641 /nfs/dbraw/zinc/30/16/41/210301641.db2.gz JHPQJNGILTVIRT-QGZVFWFLSA-N 1 1 356.223 3.854 50 0 FHAAMO COc1ccc([C@@H]2CC(c3cccs3)=NN2C(=O)C[NH+]2CCCC2)cc1 ZINC000000883476 210285963 /nfs/dbraw/zinc/28/59/63/210285963.db2.gz FUZVWVMNIKUTJW-SFHVURJKSA-N 1 1 369.490 3.530 50 0 FHAAMO Clc1ccccc1CNc1nc2ccccc2n1CC[NH+]1CCOCC1 ZINC000000809674 210274380 /nfs/dbraw/zinc/27/43/80/210274380.db2.gz 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3.994 50 0 FHAAMO c1[nH+]c2ccccn2c1CCn1cnc(-c2ccccc2)c1[C@@H]1CCOC1 ZINC000065500476 221226593 /nfs/dbraw/zinc/22/65/93/221226593.db2.gz XGRFGTJOGABOSW-GOSISDBHSA-N 1 1 358.445 3.944 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc3c(s2)CCCCC3)cn1 ZINC000065727853 221235823 /nfs/dbraw/zinc/23/58/23/221235823.db2.gz XBRLMUMRSDDIAP-UHFFFAOYSA-N 1 1 366.490 3.836 50 0 FHAAMO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1nc(-c2ccccc2)no1 ZINC000067502345 221257924 /nfs/dbraw/zinc/25/79/24/221257924.db2.gz CWIUJDIYVQEAEO-LJQANCHMSA-N 1 1 365.433 3.995 50 0 FHAAMO C[N@H+]1CCCC[C@H]1CCNC(=O)c1ccc(-c2cccc3ncccc32)nc1 ZINC000067587594 221260816 /nfs/dbraw/zinc/26/08/16/221260816.db2.gz NCHVGJXNMDXZNY-SFHVURJKSA-N 1 1 374.488 3.901 50 0 FHAAMO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067713969 221275094 /nfs/dbraw/zinc/27/50/94/221275094.db2.gz NOOKEPSBVNTZSM-UHFFFAOYSA-N 1 1 374.492 3.788 50 0 FHAAMO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067713969 221275096 /nfs/dbraw/zinc/27/50/96/221275096.db2.gz NOOKEPSBVNTZSM-UHFFFAOYSA-N 1 1 374.492 3.788 50 0 FHAAMO COC(=O)CCC[N@@H+]1CCOc2c(O)cc(-c3ccccc3C)cc2C1 ZINC000067727060 221277885 /nfs/dbraw/zinc/27/78/85/221277885.db2.gz WQQYNDLWYKMSNG-UHFFFAOYSA-N 1 1 355.434 3.515 50 0 FHAAMO COC(=O)CCC[N@H+]1CCOc2c(O)cc(-c3ccccc3C)cc2C1 ZINC000067727060 221277887 /nfs/dbraw/zinc/27/78/87/221277887.db2.gz WQQYNDLWYKMSNG-UHFFFAOYSA-N 1 1 355.434 3.515 50 0 FHAAMO Cc1cccc2[nH]c([C@H]3CCC[N@H+](Cc4nc(-c5ccco5)no4)C3)nc21 ZINC000067672929 221267503 /nfs/dbraw/zinc/26/75/03/221267503.db2.gz IUEXSUNISZJDTD-AWEZNQCLSA-N 1 1 363.421 3.894 50 0 FHAAMO Cc1cccc2[nH]c([C@H]3CCC[N@@H+](Cc4nc(-c5ccco5)no4)C3)nc21 ZINC000067672929 221267506 /nfs/dbraw/zinc/26/75/06/221267506.db2.gz IUEXSUNISZJDTD-AWEZNQCLSA-N 1 1 363.421 3.894 50 0 FHAAMO Cc1ccccc1-c1cc(O)c2c(c1)CN(CC1CC[NH+](C)CC1)CCO2 ZINC000067804713 221289161 /nfs/dbraw/zinc/28/91/61/221289161.db2.gz CTJYFHDOFSYCKY-UHFFFAOYSA-N 1 1 366.505 3.904 50 0 FHAAMO CC(C)c1[nH+]ccn1Cc1cc(C(=O)N2CC[C@H]2c2ccc(F)cc2)[nH]n1 ZINC000067743305 221280989 /nfs/dbraw/zinc/28/09/89/221280989.db2.gz LDYCAOKUVBUXPX-SFHVURJKSA-N 1 1 367.428 3.504 50 0 FHAAMO COc1cc(-c2ccc(C)s2)cc2c1OCC[N@H+](CCn1cccn1)C2 ZINC000067851987 221295659 /nfs/dbraw/zinc/29/56/59/221295659.db2.gz HWVBIWQALXVVFI-UHFFFAOYSA-N 1 1 369.490 3.823 50 0 FHAAMO COc1cc(-c2ccc(C)s2)cc2c1OCC[N@@H+](CCn1cccn1)C2 ZINC000067851987 221295663 /nfs/dbraw/zinc/29/56/63/221295663.db2.gz HWVBIWQALXVVFI-UHFFFAOYSA-N 1 1 369.490 3.823 50 0 FHAAMO Cc1ccc2[nH]c(C(=O)[O-])c(C[N@H+](C)C3CC(C)(C)[NH2+]C(C)(C)C3)c2c1 ZINC000067894629 221302936 /nfs/dbraw/zinc/30/29/36/221302936.db2.gz XTHWCQJZQDJWQO-UHFFFAOYSA-N 1 1 357.498 3.916 50 0 FHAAMO OCCCC[N@@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067954691 221308384 /nfs/dbraw/zinc/30/83/84/221308384.db2.gz WEOPVGUGXQIDKY-UHFFFAOYSA-N 1 1 370.474 3.636 50 0 FHAAMO OCCCC[N@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067954691 221308385 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50 0 FHAAMO O=C(CCCc1cccs1)N[C@@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000012111970 570718548 /nfs/dbraw/zinc/71/85/48/570718548.db2.gz ZSAHNWDLVBCKGK-LJQANCHMSA-N 1 1 356.535 3.894 50 0 FHAAMO O=C(CCCc1cccs1)N[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000012111971 570718674 /nfs/dbraw/zinc/71/86/74/570718674.db2.gz ZSAHNWDLVBCKGK-IBGZPJMESA-N 1 1 356.535 3.894 50 0 FHAAMO O=C(Nc1ccc(-c2cc[nH]n2)cc1)[C@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC000012300186 570733276 /nfs/dbraw/zinc/73/32/76/570733276.db2.gz AJRJCTRTESCJDZ-KRWDZBQOSA-N 1 1 366.490 3.989 50 0 FHAAMO Cc1cccc(C)c1Oc1ncccc1CNC(=O)[C@H]1CCCC[N@@H+]1C ZINC000012304990 570734262 /nfs/dbraw/zinc/73/42/62/570734262.db2.gz XRZHHMUUAJBMBG-GOSISDBHSA-N 1 1 353.466 3.591 50 0 FHAAMO CC(C)Cc1cc(C[N@H+]2CCC[C@@](CO)(CCc3ccccc3)C2)[nH]n1 ZINC000012302355 570734327 /nfs/dbraw/zinc/73/43/27/570734327.db2.gz IDBHCLIRQMMABU-JOCHJYFZSA-N 1 1 355.526 3.816 50 0 FHAAMO O=C(CCn1cnc2ccccc21)N[C@@H]1CCC[N@H+](C2CCCCCC2)C1 ZINC000012306292 570734896 /nfs/dbraw/zinc/73/48/96/570734896.db2.gz QZQWOXWKGUUPPE-GOSISDBHSA-N 1 1 368.525 3.730 50 0 FHAAMO Cc1cccn2cc(C(=O)N[C@H]3CCC[N@H+](C4CCCCCC4)C3)nc12 ZINC000012306534 570734983 /nfs/dbraw/zinc/73/49/83/570734983.db2.gz AANHQTNNMWVVSP-KRWDZBQOSA-N 1 1 354.498 3.560 50 0 FHAAMO CCn1ccnc1CN(C)C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC000012317578 570736301 /nfs/dbraw/zinc/73/63/01/570736301.db2.gz HODIZAQZJBNWDG-LJQANCHMSA-N 1 1 374.960 3.943 50 0 FHAAMO O=C(N[C@H]1CCC[N@@H+](CCc2ccccc2)C1)c1c(F)ccc(F)c1F ZINC000012385301 570740950 /nfs/dbraw/zinc/74/09/50/570740950.db2.gz XBPYUWCGWDLBGY-HNNXBMFYSA-N 1 1 362.395 3.541 50 0 FHAAMO CCn1ccnc1C[NH+]1CCC(CCC(=O)Nc2cccc(OC)c2)CC1 ZINC000012434008 570744814 /nfs/dbraw/zinc/74/48/14/570744814.db2.gz BOLJMPUHGMGIPV-UHFFFAOYSA-N 1 1 370.497 3.543 50 0 FHAAMO CCCCN(C)C(=O)[C@@H]1CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1 ZINC000012464160 570748018 /nfs/dbraw/zinc/74/80/18/570748018.db2.gz LSLGLUIUJYFKEY-OAQYLSRUSA-N 1 1 371.569 3.622 50 0 FHAAMO O=C(CCC(F)(F)F)N1CC[C@@]2(C1)CCC[N@@H+](CCc1ccccc1)C2 ZINC000012587376 570751931 /nfs/dbraw/zinc/75/19/31/570751931.db2.gz KKJLYTCVTRZQNZ-IBGZPJMESA-N 1 1 368.443 3.886 50 0 FHAAMO COc1ccc(C[N@H+]2CCC[C@](CO)(Cc3cccc(OC)c3)C2)cc1 ZINC000012591609 570752497 /nfs/dbraw/zinc/75/24/97/570752497.db2.gz JBJFBHVSZNDSCF-QFIPXVFZSA-N 1 1 355.478 3.521 50 0 FHAAMO COc1cccc(C(=O)[C@@H]2CCC[N@H+](Cc3cc(OC)ccc3OC)C2)c1 ZINC000012704255 570756779 /nfs/dbraw/zinc/75/67/79/570756779.db2.gz MTAUFLPPZMGAAG-QGZVFWFLSA-N 1 1 369.461 3.807 50 0 FHAAMO CC(=O)NCC[C@@H]1CCCC[N@@H+]1Cc1cn(C)nc1-c1cccc(Cl)c1 ZINC000012718814 570758357 /nfs/dbraw/zinc/75/83/57/570758357.db2.gz PTBMQHBDXFGMPX-IBGZPJMESA-N 1 1 374.916 3.621 50 0 FHAAMO COc1cccc(C(=O)[C@H]2CCC[N@H+](Cc3ccc(OC)c(O)c3)C2)c1 ZINC000012757392 570760075 /nfs/dbraw/zinc/76/00/75/570760075.db2.gz SZLNMGZIWFEMNU-KRWDZBQOSA-N 1 1 355.434 3.504 50 0 FHAAMO COc1cccc(C(=O)[C@H]2CCC[N@@H+](Cc3ccc(OC)c(O)c3)C2)c1 ZINC000012757392 570760077 /nfs/dbraw/zinc/76/00/77/570760077.db2.gz SZLNMGZIWFEMNU-KRWDZBQOSA-N 1 1 355.434 3.504 50 0 FHAAMO C[C@@H](c1ccc(F)cc1)[N@H+](C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C ZINC000012788716 570761381 /nfs/dbraw/zinc/76/13/81/570761381.db2.gz DGIKYGAJVRAVDP-CABCVRRESA-N 1 1 369.440 3.582 50 0 FHAAMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C ZINC000012788716 570761385 /nfs/dbraw/zinc/76/13/85/570761385.db2.gz DGIKYGAJVRAVDP-CABCVRRESA-N 1 1 369.440 3.582 50 0 FHAAMO C[N@@H+]1CCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)[C@@H](c2ccccc2)C1 ZINC000032759992 570793348 /nfs/dbraw/zinc/79/33/48/570793348.db2.gz UOSWMIFHJMSSHG-LJQANCHMSA-N 1 1 353.853 3.950 50 0 FHAAMO C[N@H+]1CCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)[C@@H](c2ccccc2)C1 ZINC000032759992 570793351 /nfs/dbraw/zinc/79/33/51/570793351.db2.gz UOSWMIFHJMSSHG-LJQANCHMSA-N 1 1 353.853 3.950 50 0 FHAAMO Clc1ccc2c(c1)ncnc2NC[C@@H](c1ccccc1)[NH+]1CCOCC1 ZINC000032770037 570797133 /nfs/dbraw/zinc/79/71/33/570797133.db2.gz PSBDLKXNWAGFJX-IBGZPJMESA-N 1 1 368.868 3.769 50 0 FHAAMO Cc1csc(CCCNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccccc2)n1 ZINC000174498560 570807926 /nfs/dbraw/zinc/80/79/26/570807926.db2.gz PDPONGFZQYZQNO-SFHVURJKSA-N 1 1 357.523 3.555 50 0 FHAAMO COc1cc([C@@H]2Nc3sc4c(c3C(=O)N2)CC[N@@H+](C(C)C)C4)ccc1O ZINC000004554000 570833555 /nfs/dbraw/zinc/83/35/55/570833555.db2.gz ICDMGXTXVZYCDH-KRWDZBQOSA-N 1 1 373.478 3.658 50 0 FHAAMO CCC[C@H](O)C[N@H+](Cc1ccc(F)cc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104984249 570865528 /nfs/dbraw/zinc/86/55/28/570865528.db2.gz XZLQKQCDIHCOQB-LEWJYISDSA-N 1 1 370.468 3.982 50 0 FHAAMO COc1cccc(CC(=O)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)c1 ZINC000032930751 570871221 /nfs/dbraw/zinc/87/12/21/570871221.db2.gz WFQROTVKNXKNQH-GOSISDBHSA-N 1 1 366.505 3.929 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1ccc(F)cc1Br ZINC000046989442 570878069 /nfs/dbraw/zinc/87/80/69/570878069.db2.gz CDLAJRHOYVSJIQ-CYBMUJFWSA-N 1 1 371.294 3.973 50 0 FHAAMO CCCCc1nc(CN2CC[NH+](Cc3ccc4c(c3)CCO4)CC2)cs1 ZINC000048265587 570939779 /nfs/dbraw/zinc/93/97/79/570939779.db2.gz PLCVTPHKXUEPLI-UHFFFAOYSA-N 1 1 371.550 3.738 50 0 FHAAMO C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+](C)CCCn1cncn1 ZINC000048374840 570954481 /nfs/dbraw/zinc/95/44/81/570954481.db2.gz BXXSBQVAIMNUNC-QGZVFWFLSA-N 1 1 363.465 3.614 50 0 FHAAMO Clc1ccccc1-c1nnc(CN2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000023249161 570961045 /nfs/dbraw/zinc/96/10/45/570961045.db2.gz MFUHRCRCWRMMAD-UHFFFAOYSA-N 1 1 368.868 3.708 50 0 FHAAMO C[N@H+](CCOc1ccccc1Cl)CC(=O)N[C@@H]1CCCc2ccccc21 ZINC000049581224 570964746 /nfs/dbraw/zinc/96/47/46/570964746.db2.gz NOZOYKSQENWFNN-LJQANCHMSA-N 1 1 372.896 3.844 50 0 FHAAMO C[N@@H+](CCOc1ccccc1Cl)CC(=O)N[C@@H]1CCCc2ccccc21 ZINC000049581224 570964750 /nfs/dbraw/zinc/96/47/50/570964750.db2.gz NOZOYKSQENWFNN-LJQANCHMSA-N 1 1 372.896 3.844 50 0 FHAAMO COc1ccc(OC)c(C[NH2+]Cc2c(C)nn(Cc3ccccc3)c2C)c1 ZINC000025069793 570990554 /nfs/dbraw/zinc/99/05/54/570990554.db2.gz RLFNQCGWMGSPQM-UHFFFAOYSA-N 1 1 365.477 3.855 50 0 FHAAMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc3c4c(cccc42)CC3)C[C@@H](C)O1 ZINC000025408760 570995469 /nfs/dbraw/zinc/99/54/69/570995469.db2.gz ZVAAMMZUONRVCF-HZPDHXFCSA-N 1 1 366.505 3.556 50 0 FHAAMO Fc1ccc(C[N@H+]2CCC[C@@H](c3nc4c5ccccc5ncn4n3)C2)cc1 ZINC000039239688 570998935 /nfs/dbraw/zinc/99/89/35/570998935.db2.gz YIVPJHFQROUSRW-MRXNPFEDSA-N 1 1 361.424 3.796 50 0 FHAAMO COc1cc(NC(=O)NCCC[N@H+]2CCCC[C@H]2C)c(OC)cc1Cl ZINC000040023970 571010687 /nfs/dbraw/zinc/01/06/87/571010687.db2.gz MQCYSTIGVABESI-CYBMUJFWSA-N 1 1 369.893 3.743 50 0 FHAAMO Cc1cc2oc(C(=O)NC[C@H](c3cccs3)[NH+](C)C)cc(=O)c2cc1C ZINC000028289108 571029662 /nfs/dbraw/zinc/02/96/62/571029662.db2.gz CPSGFOQSHFBQBC-OAHLLOKOSA-N 1 1 370.474 3.504 50 0 FHAAMO CCOc1cc(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)ccc1OC ZINC000072273506 571031268 /nfs/dbraw/zinc/03/12/68/571031268.db2.gz IDAOSINJHFJTNL-IBGZPJMESA-N 1 1 374.525 3.868 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccccc1OC(F)F)c1ccccc1Cl ZINC000029050523 571036327 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374.484 3.531 50 0 FHAAMO CC(C)C[N@H+]1CCO[C@H](CSc2ncnc3c4ccccc4oc32)C1 ZINC000023844361 211397287 /nfs/dbraw/zinc/39/72/87/211397287.db2.gz LAZYFSZXNNIGQK-AWEZNQCLSA-N 1 1 357.479 3.825 50 0 FHAAMO O=C(C1CC[NH+](Cc2nc3ccccc3s2)CC1)N1CCCCCC1 ZINC000023718081 211395488 /nfs/dbraw/zinc/39/54/88/211395488.db2.gz JXKFYBWSTKYHMN-UHFFFAOYSA-N 1 1 357.523 3.911 50 0 FHAAMO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000023668270 211392898 /nfs/dbraw/zinc/39/28/98/211392898.db2.gz JLPKQZXURMRELX-NSHDSACASA-N 1 1 363.795 3.819 50 0 FHAAMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000023668270 211392902 /nfs/dbraw/zinc/39/29/02/211392902.db2.gz JLPKQZXURMRELX-NSHDSACASA-N 1 1 363.795 3.819 50 0 FHAAMO C[N@@H+](CCC[C@H]1CCCO1)Cc1ccccc1-c1nc(C2CC2)cc(=O)[nH]1 ZINC000023581577 211391140 /nfs/dbraw/zinc/39/11/40/211391140.db2.gz QQHGTSVBIGTFNP-SFHVURJKSA-N 1 1 367.493 3.705 50 0 FHAAMO C[NH+]1CCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc32)CC1 ZINC000023379461 211386280 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C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)c3cc(Cl)c[nH]3)n2)C1 ZINC000022295568 211346857 /nfs/dbraw/zinc/34/68/57/211346857.db2.gz NYPQMMHWPUOVOQ-PHIMTYICSA-N 1 1 352.891 3.855 50 0 FHAAMO CN(C)C1(C[NH2+]CC(=O)Nc2ccc(Cl)cc2Cl)CCCCC1 ZINC000022038366 211335212 /nfs/dbraw/zinc/33/52/12/211335212.db2.gz ZJLWJYXYTXXSMI-UHFFFAOYSA-N 1 1 358.313 3.786 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2ccc(Cl)cc2Cl)CC1 ZINC000022028243 211334738 /nfs/dbraw/zinc/33/47/38/211334738.db2.gz VPBZBXGNCIOLKH-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2cccc(C(F)(F)F)c2)CC1 ZINC000022028226 211334436 /nfs/dbraw/zinc/33/44/36/211334436.db2.gz LMRIBRRHMMMLGD-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(-c2cccnc2)nc2ccccc21 ZINC000021934570 211333029 /nfs/dbraw/zinc/33/30/29/211333029.db2.gz HKWNLDKFLVWWNG-KRWDZBQOSA-N 1 1 374.488 3.901 50 0 FHAAMO COc1ccc2cc(C(=O)[C@@H]3CCC[N@H+](C4CCN(C)CC4)C3)ccc2c1 ZINC000020542497 211284839 /nfs/dbraw/zinc/28/48/39/211284839.db2.gz JZQWKURKZYIBFG-HXUWFJFHSA-N 1 1 366.505 3.837 50 0 FHAAMO CN(Cc1nc2ccccc2n1C)[C@@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000019720360 211251362 /nfs/dbraw/zinc/25/13/62/211251362.db2.gz OXWUEMRCYJYELF-HXUWFJFHSA-N 1 1 362.521 3.712 50 0 FHAAMO COc1ccc(OC)c([C@H]2CC[N@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000019720449 211250806 /nfs/dbraw/zinc/25/08/06/211250806.db2.gz AUGZHLHFBXXDGY-ZDUSSCGKSA-N 1 1 371.462 3.805 50 0 FHAAMO COc1ccc(OC)c([C@H]2CC[N@@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000019720449 211250810 /nfs/dbraw/zinc/25/08/10/211250810.db2.gz AUGZHLHFBXXDGY-ZDUSSCGKSA-N 1 1 371.462 3.805 50 0 FHAAMO CC(C)=CC(=O)NCC[N@H+]1Cc2ccccc2O[C@H](c2ccccc2F)C1 ZINC000019741515 211250566 /nfs/dbraw/zinc/25/05/66/211250566.db2.gz PSKMJDLYEXHMJG-NRFANRHFSA-N 1 1 368.452 3.844 50 0 FHAAMO CC(C)=CC(=O)NCC[N@@H+]1Cc2ccccc2O[C@H](c2ccccc2F)C1 ZINC000019741515 211250570 /nfs/dbraw/zinc/25/05/70/211250570.db2.gz PSKMJDLYEXHMJG-NRFANRHFSA-N 1 1 368.452 3.844 50 0 FHAAMO COc1ccccc1C(=O)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000019790313 211255691 /nfs/dbraw/zinc/25/56/91/211255691.db2.gz LYXUUKAGSSBYQD-UHFFFAOYSA-N 1 1 360.457 3.806 50 0 FHAAMO CCOC(=O)[C@]1(CCOc2ccccc2)CCC[N@H+](Cc2nccs2)C1 ZINC000019741770 211254107 /nfs/dbraw/zinc/25/41/07/211254107.db2.gz ZLBDOACJRKSQCD-FQEVSTJZSA-N 1 1 374.506 3.758 50 0 FHAAMO CCOC(=O)[C@]1(CCOc2ccccc2)CCC[N@@H+](Cc2nccs2)C1 ZINC000019741770 211254112 /nfs/dbraw/zinc/25/41/12/211254112.db2.gz ZLBDOACJRKSQCD-FQEVSTJZSA-N 1 1 374.506 3.758 50 0 FHAAMO CN(Cc1ccco1)C(=O)c1ccc([C@@H]2CCC[N@H+]2C2CCOCC2)s1 ZINC000019595512 211241066 /nfs/dbraw/zinc/24/10/66/211241066.db2.gz FUBMMMZIRBGMBQ-KRWDZBQOSA-N 1 1 374.506 3.929 50 0 FHAAMO C[N@@H+](Cc1c[nH]nc1-c1ccc2c(c1)OCO2)Cc1cccc2cnccc21 ZINC000019338830 211215872 /nfs/dbraw/zinc/21/58/72/211215872.db2.gz YOAUANHKRUBNJX-UHFFFAOYSA-N 1 1 372.428 3.986 50 0 FHAAMO Cc1ccc([C@@H](CNC(=O)c2ccc(Br)o2)[NH+]2CCCC2)o1 ZINC000015860263 211148111 /nfs/dbraw/zinc/14/81/11/211148111.db2.gz SNHIRPQOZBUXFZ-GFCCVEGCSA-N 1 1 367.243 3.510 50 0 FHAAMO CCOC(=O)c1c(C)oc2nc(C)nc(NCCC[N@H+]3CCCC[C@H]3C)c21 ZINC000015727458 211139266 /nfs/dbraw/zinc/13/92/66/211139266.db2.gz CZKMMOBJTCKNRP-CYBMUJFWSA-N 1 1 374.485 3.693 50 0 FHAAMO O=C(CC[C@H]1CCC[N@H+](Cc2ccc(CO)o2)C1)Nc1ccccc1F ZINC000015075582 211119288 /nfs/dbraw/zinc/11/92/88/211119288.db2.gz KBTWQXIBHAMNKB-OAHLLOKOSA-N 1 1 360.429 3.542 50 0 FHAAMO COc1cc(C[N@H+]2CCC[C@@H](Nc3cccc(F)c3)C2)cc(OC)c1O ZINC000015074844 211119154 /nfs/dbraw/zinc/11/91/54/211119154.db2.gz QUKKPORRYITWGA-QGZVFWFLSA-N 1 1 360.429 3.625 50 0 FHAAMO C[NH+](C)Cc1ccc(C(=O)N2CCC[C@@H](CCc3cccc(F)c3)C2)o1 ZINC000015073828 211118575 /nfs/dbraw/zinc/11/85/75/211118575.db2.gz FWHNQXCWNFKBEU-KRWDZBQOSA-N 1 1 358.457 3.965 50 0 FHAAMO O=C(N[C@H]1CCC[N@@H+](CCc2ccccc2)C1)c1ccc(F)c(Cl)c1 ZINC000014971815 211109504 /nfs/dbraw/zinc/10/95/04/211109504.db2.gz IPENMGKZVIHIBW-KRWDZBQOSA-N 1 1 360.860 3.916 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Cc1csc(-c2ccccc2)n1 ZINC000014226239 211087738 /nfs/dbraw/zinc/08/77/38/211087738.db2.gz ZMUXQFHYJODAIZ-INIZCTEOSA-N 1 1 357.523 3.733 50 0 FHAAMO CCC[C@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1 ZINC000014230273 211087390 /nfs/dbraw/zinc/08/73/90/211087390.db2.gz UACSEOSCAUJUBO-QFIPXVFZSA-N 1 1 366.505 3.719 50 0 FHAAMO O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)c1csc(-c2ccccc2)n1 ZINC000014231571 211087412 /nfs/dbraw/zinc/08/74/12/211087412.db2.gz CAEFQJYBRNFNCD-QGZVFWFLSA-N 1 1 367.474 3.970 50 0 FHAAMO C[C@@H]1Oc2c(cccc2C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[C@@H]1C ZINC000014183364 211081593 /nfs/dbraw/zinc/08/15/93/211081593.db2.gz DOEWPCLDVJVGFT-SOLBZPMBSA-N 1 1 350.462 3.575 50 0 FHAAMO COCc1ccc(C[N@H+]2CCC[C@@H](CCC(=O)NCc3ccc(C)o3)C2)o1 ZINC000013594272 211042885 /nfs/dbraw/zinc/04/28/85/211042885.db2.gz GOJTWSLPNKAQJZ-KRWDZBQOSA-N 1 1 374.481 3.636 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2)cc1OC ZINC000013096124 211022948 /nfs/dbraw/zinc/02/29/48/211022948.db2.gz GARHJOKQDUQQAD-ZDUSSCGKSA-N 1 1 362.857 3.816 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2)cc1OC ZINC000013096124 211022952 /nfs/dbraw/zinc/02/29/52/211022952.db2.gz GARHJOKQDUQQAD-ZDUSSCGKSA-N 1 1 362.857 3.816 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012926938 211009160 /nfs/dbraw/zinc/00/91/60/211009160.db2.gz CATAXSCOTJTMED-AWEZNQCLSA-N 1 1 374.868 3.879 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012926938 211009164 /nfs/dbraw/zinc/00/91/64/211009164.db2.gz CATAXSCOTJTMED-AWEZNQCLSA-N 1 1 374.868 3.879 50 0 FHAAMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2CC(=O)N[C@@H](C)c2ccccc2)c1 ZINC000012910703 211006606 /nfs/dbraw/zinc/00/66/06/211006606.db2.gz ALPMVARFXLZYFH-JXFKEZNVSA-N 1 1 368.477 3.718 50 0 FHAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccccc2)c1 ZINC000012910703 211006609 /nfs/dbraw/zinc/00/66/09/211006609.db2.gz ALPMVARFXLZYFH-JXFKEZNVSA-N 1 1 368.477 3.718 50 0 FHAAMO CC[N@@H+]1CCc2c(sc(NC(=O)c3ccc(C)c(C)c3)c2C(=O)OC)C1 ZINC000004223519 210516809 /nfs/dbraw/zinc/51/68/09/210516809.db2.gz RTEDRSFTSGMNCG-UHFFFAOYSA-N 1 1 372.490 3.782 50 0 FHAAMO CC[N@H+]1CCc2c(sc(NC(=O)c3ccc(C)c(C)c3)c2C(=O)OC)C1 ZINC000004223519 210516811 /nfs/dbraw/zinc/51/68/11/210516811.db2.gz RTEDRSFTSGMNCG-UHFFFAOYSA-N 1 1 372.490 3.782 50 0 FHAAMO CC[NH+]1CCN([C@@H](c2cccs2)[C@H](C)NC(=O)c2ccc(C)cc2)CC1 ZINC000022460104 220386669 /nfs/dbraw/zinc/38/66/69/220386669.db2.gz FYSSMAPBTFFJTD-FXAWDEMLSA-N 1 1 371.550 3.554 50 0 FHAAMO COc1ccc(C[N@@H+]2CCCC[C@H]2CNC(=O)OC(C)(C)C)cc1F ZINC000065237669 221184309 /nfs/dbraw/zinc/18/43/09/221184309.db2.gz IVKXITUGSLMUFL-HNNXBMFYSA-N 1 1 352.450 3.714 50 0 FHAAMO COc1ccc(C[N@H+]2CCCC[C@H]2CNC(=O)OC(C)(C)C)cc1F ZINC000065237669 221184311 /nfs/dbraw/zinc/18/43/11/221184311.db2.gz IVKXITUGSLMUFL-HNNXBMFYSA-N 1 1 352.450 3.714 50 0 FHAAMO Cn1c2ccccc2nc1-c1cc2n(n1)CCC[N@H+](Cc1ccc(O)cc1)C2 ZINC000065372966 221205475 /nfs/dbraw/zinc/20/54/75/221205475.db2.gz IUBGDLNXDJITRC-UHFFFAOYSA-N 1 1 373.460 3.548 50 0 FHAAMO Cn1c2ccccc2nc1-c1cc2n(n1)CCC[N@@H+](Cc1ccc(O)cc1)C2 ZINC000065372966 221205477 /nfs/dbraw/zinc/20/54/77/221205477.db2.gz IUBGDLNXDJITRC-UHFFFAOYSA-N 1 1 373.460 3.548 50 0 FHAAMO C[NH+](C)Cc1cncc(Oc2cc(F)c(CN3CCCC3)c(Cl)c2)n1 ZINC000067459719 221255800 /nfs/dbraw/zinc/25/58/00/221255800.db2.gz RCVJFKPAZWJAHJ-UHFFFAOYSA-N 1 1 364.852 3.719 50 0 FHAAMO c1ccc(Cc2noc(C[NH+]3CCC(c4nc5ccccc5[nH]4)CC3)n2)cc1 ZINC000067650125 221266386 /nfs/dbraw/zinc/26/63/86/221266386.db2.gz HXRBRORZYYYWTD-UHFFFAOYSA-N 1 1 373.460 3.916 50 0 FHAAMO Cc1[nH+]ccn1[C@H](C)C(=O)NCc1cccnc1Oc1ccc(F)c(F)c1 ZINC000067695531 221273097 /nfs/dbraw/zinc/27/30/97/221273097.db2.gz ADWVDVWCQHRACK-GFCCVEGCSA-N 1 1 372.375 3.534 50 0 FHAAMO CC1(C)C[C@@H](C[N@H+]2CCOc3c(O)cc(-c4cccnc4)cc3C2)CCO1 ZINC000067805881 221288151 /nfs/dbraw/zinc/28/81/51/221288151.db2.gz QNPHCYDXQSALLT-INIZCTEOSA-N 1 1 368.477 3.854 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@@H](OC)C3)c(C)o2)c(OC)c1C ZINC000067804963 221288866 /nfs/dbraw/zinc/28/88/66/221288866.db2.gz ALNKVQKSYVMQDI-OAHLLOKOSA-N 1 1 360.454 3.586 50 0 FHAAMO COc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](OC)C3)c(C)o2)c(OC)c1C ZINC000067804963 221288869 /nfs/dbraw/zinc/28/88/69/221288869.db2.gz ALNKVQKSYVMQDI-OAHLLOKOSA-N 1 1 360.454 3.586 50 0 FHAAMO CC[N@H+](Cc1cccc(C(=O)Nc2c(C)noc2C)c1)C[C@@H]1CCCO1 ZINC000067757477 221281552 /nfs/dbraw/zinc/28/15/52/221281552.db2.gz FDMAVCCVYRBVRZ-SFHVURJKSA-N 1 1 357.454 3.545 50 0 FHAAMO Cc1cc(C)n([C@@H]2CC[N@@H+](Cc3c(-c4ccccc4)nc4ncccn34)C2)n1 ZINC000067771798 221282670 /nfs/dbraw/zinc/28/26/70/221282670.db2.gz POQKUBZWLBFZCI-LJQANCHMSA-N 1 1 372.476 3.657 50 0 FHAAMO O=C(Nc1nc2ccccc2s1)c1cccc(C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000067834176 221292225 /nfs/dbraw/zinc/29/22/25/221292225.db2.gz CLMMDJWWLUGHOV-MRXNPFEDSA-N 1 1 367.474 3.505 50 0 FHAAMO CSc1ccc2cc(C[N@H+]3CCC[C@H]3c3ccccn3)c(=O)[nH]c2c1 ZINC000067880031 221299761 /nfs/dbraw/zinc/29/97/61/221299761.db2.gz GKZNHJVNQCNWSY-IBGZPJMESA-N 1 1 351.475 3.982 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCN(C)Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067885747 221300706 /nfs/dbraw/zinc/30/07/06/221300706.db2.gz LHXXLOGOZUNZDL-GOSISDBHSA-N 1 1 363.509 3.703 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2c[nH]nc2-c2ccccc2)CCC[N@H+]1CC1CC1 ZINC000071419075 221348200 /nfs/dbraw/zinc/34/82/00/221348200.db2.gz QYYRGUPDQUICIX-FQEVSTJZSA-N 1 1 366.509 3.659 50 0 FHAAMO C[C@H]1CCC[N@@H+]1Cc1c(C(=O)N2CCCCCCC2)nc2sccn12 ZINC000071575344 221352456 /nfs/dbraw/zinc/35/24/56/221352456.db2.gz IXNOOSNPEZTTRS-HNNXBMFYSA-N 1 1 360.527 3.786 50 0 FHAAMO C[C@H]1CCC[N@H+]1Cc1c(C(=O)N2CCCCCCC2)nc2sccn12 ZINC000071575344 221352459 /nfs/dbraw/zinc/35/24/59/221352459.db2.gz IXNOOSNPEZTTRS-HNNXBMFYSA-N 1 1 360.527 3.786 50 0 FHAAMO CCCn1ncc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)c1C ZINC000071589465 221352706 /nfs/dbraw/zinc/35/27/06/221352706.db2.gz LXSSRRMWTXFNKF-NRFANRHFSA-N 1 1 368.525 3.615 50 0 FHAAMO Cc1nccn1CC[N@H+]1CCCN(Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071745345 221357749 /nfs/dbraw/zinc/35/77/49/221357749.db2.gz WKLOKGGELGBBDD-NRFANRHFSA-N 1 1 358.505 3.563 50 0 FHAAMO Cc1ccoc1C(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000071757172 221367068 /nfs/dbraw/zinc/36/70/68/221367068.db2.gz DLFVEKHIDZJIRR-KFKAGJAMSA-N 1 1 372.415 3.569 50 0 FHAAMO CNC(=O)CC[N@H+]1CCC[C@@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 ZINC000071762678 221369951 /nfs/dbraw/zinc/36/99/51/221369951.db2.gz VVOVTDDSWYUVOG-GOSISDBHSA-N 1 1 366.461 3.510 50 0 FHAAMO COc1ccc(C(=O)N2CCC[N@@H+](CC3CC3)[C@H](C(C)C)C2)c(F)c1F ZINC000071764079 221371774 /nfs/dbraw/zinc/37/17/74/221371774.db2.gz FKJWPKURYLIXTQ-INIZCTEOSA-N 1 1 366.452 3.556 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@H](C(C)(C)O)C3)c(C)o2)c(F)c1 ZINC000071771225 221373495 /nfs/dbraw/zinc/37/34/95/221373495.db2.gz UAGACFJEKNZTMJ-AWEZNQCLSA-N 1 1 362.445 3.781 50 0 FHAAMO Cc1cccc(CN2CCC[C@@H]2[C@H]2CCC[N@@H+]2Cc2cccc(C)n2)n1 ZINC000071772090 221374180 /nfs/dbraw/zinc/37/41/80/221374180.db2.gz SXBLLUAXFAKRPB-FGZHOGPDSA-N 1 1 350.510 3.722 50 0 FHAAMO c1cn(Cc2cccnc2)c(C2CCN(c3ccc4c([nH+]3)CCCC4)CC2)n1 ZINC000092076968 132206154 /nfs/dbraw/zinc/20/61/54/132206154.db2.gz YKCPZIKGTPKCHT-UHFFFAOYSA-N 1 1 373.504 3.984 50 0 FHAAMO CCCCSc1nc(N2CCC[C@H](OCc3cccnc3)C2)cc(N)[nH+]1 ZINC000095363534 132208107 /nfs/dbraw/zinc/20/81/07/132208107.db2.gz BBBKAWHALFPXFC-INIZCTEOSA-N 1 1 373.526 3.532 50 0 FHAAMO CCCCSc1nc(N)cc(N2CCC[C@H](OCc3cccnc3)C2)[nH+]1 ZINC000095363534 132208108 /nfs/dbraw/zinc/20/81/08/132208108.db2.gz BBBKAWHALFPXFC-INIZCTEOSA-N 1 1 373.526 3.532 50 0 FHAAMO OCc1cc2ccccc2nc1N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000095374141 132208907 /nfs/dbraw/zinc/20/89/07/132208907.db2.gz WTWKWCDUQFVSOY-UHFFFAOYSA-N 1 1 373.500 3.754 50 0 FHAAMO COCCn1cc[nH+]c1[C@H]1CCCN(c2ncc(Cl)cc2Cl)C1 ZINC000095508823 132212959 /nfs/dbraw/zinc/21/29/59/132212959.db2.gz FCRAIEGVYRGMJT-LBPRGKRZSA-N 1 1 355.269 3.615 50 0 FHAAMO COCCn1cc[nH+]c1[C@@H]1CCCN(c2ncc(Cl)cc2Cl)C1 ZINC000095508822 132213012 /nfs/dbraw/zinc/21/30/12/132213012.db2.gz FCRAIEGVYRGMJT-GFCCVEGCSA-N 1 1 355.269 3.615 50 0 FHAAMO Cc1cc(N2CCC([N@H+]3CCOC4(CCCC4)C3)CC2)nc(C(C)C)n1 ZINC000095511061 132213209 /nfs/dbraw/zinc/21/32/09/132213209.db2.gz AHQBWDUXTSGILE-UHFFFAOYSA-N 1 1 358.530 3.522 50 0 FHAAMO Cc1cc(C)c2oc(=O)cc(C[NH+]3CCN(c4ccc(F)cc4)CC3)c2c1 ZINC000054105880 132376045 /nfs/dbraw/zinc/37/60/45/132376045.db2.gz NCBJCJNJESLISZ-UHFFFAOYSA-N 1 1 366.436 3.871 50 0 FHAAMO Cc1ccc2oc(=O)cc(C[NH+]3CCN(c4ccccc4F)CC3)c2c1 ZINC000054106045 132376057 /nfs/dbraw/zinc/37/60/57/132376057.db2.gz PGEABWSLDAFAIU-UHFFFAOYSA-N 1 1 352.409 3.563 50 0 FHAAMO COc1cc(C[NH+]2CCN(c3cccc(C)c3)CC2)ccc1OC(F)F ZINC000040017921 132944983 /nfs/dbraw/zinc/94/49/83/132944983.db2.gz XTUMJYGHNBINJS-UHFFFAOYSA-N 1 1 362.420 3.927 50 0 FHAAMO C[C@@H](C(=O)N(C)Cc1ccccc1)[NH+]1CCN(c2ccc(Cl)cc2)CC1 ZINC000034684685 136118017 /nfs/dbraw/zinc/11/80/17/136118017.db2.gz JAJALWNCHYGMNH-KRWDZBQOSA-N 1 1 371.912 3.509 50 0 FHAAMO 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355.511 3.603 50 0 FHAAMO Cc1cccc2nc(CC[N@@H+](C)Cc3cnc(N4CCCC4)s3)[nH]c21 ZINC000097772677 222211179 /nfs/dbraw/zinc/21/11/79/222211179.db2.gz WHGRVAGROLPCIA-UHFFFAOYSA-N 1 1 355.511 3.603 50 0 FHAAMO Cc1cccc2nc(CC[N@H+](C)Cc3cnc(N4CCCC4)s3)[nH]c21 ZINC000097772677 222211181 /nfs/dbraw/zinc/21/11/81/222211181.db2.gz WHGRVAGROLPCIA-UHFFFAOYSA-N 1 1 355.511 3.603 50 0 FHAAMO COc1cccc(C[N@H+]2CCC[C@H](O)CC2)c1OCc1cccc(F)c1 ZINC000097551242 222191631 /nfs/dbraw/zinc/19/16/31/222191631.db2.gz YCZDBNUVEXMQNW-IBGZPJMESA-N 1 1 359.441 3.760 50 0 FHAAMO CC(C)N1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1CCO ZINC000104301869 222356352 /nfs/dbraw/zinc/35/63/52/222356352.db2.gz IFRFVOYIUCUUKO-GOSISDBHSA-N 1 1 352.478 3.863 50 0 FHAAMO CC(C)[N@@H+]1CCN(Cc2cccc3c4ccccc4oc32)C[C@H]1CCO ZINC000104301869 222356358 /nfs/dbraw/zinc/35/63/58/222356358.db2.gz IFRFVOYIUCUUKO-GOSISDBHSA-N 1 1 352.478 3.863 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2cccc3c4ccccc4oc32)C[C@H]1CCO ZINC000104301869 222356361 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CSc1cccc(CN(C)C(=O)NCC2(Cn3cc[nH+]c3C)CC2)c1 ZINC000534632407 571206686 /nfs/dbraw/zinc/20/66/86/571206686.db2.gz YTXQPUOEFGESGF-UHFFFAOYSA-N 1 1 358.511 3.535 50 0 FHAAMO Cc1c[nH+]ccc1N1CCCN(Cc2cnc(-c3cccs3)nc2)CC1 ZINC000077299458 571206805 /nfs/dbraw/zinc/20/68/05/571206805.db2.gz IXUIHJYQLMUMKS-UHFFFAOYSA-N 1 1 365.506 3.621 50 0 FHAAMO c1nc(C2CCCCC2)ncc1C[N@@H+]1CCCC[C@H]1CCN1CCOCC1 ZINC000077340515 571208082 /nfs/dbraw/zinc/20/80/82/571208082.db2.gz UWJOKDXYMXYBRU-NRFANRHFSA-N 1 1 372.557 3.601 50 0 FHAAMO CSc1ccccc1C[N@@H+]1C[C@@H](c2ccc(C)cc2)[C@H](NC(C)=O)C1 ZINC000077440742 571211898 /nfs/dbraw/zinc/21/18/98/571211898.db2.gz SFODCVNEVOEFIX-VQTJNVASSA-N 1 1 354.519 3.821 50 0 FHAAMO O=C(c1ccc2ncccc2c1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000077470694 571212924 /nfs/dbraw/zinc/21/29/24/571212924.db2.gz RORZVWDCJSLMKR-UHFFFAOYSA-N 1 1 363.436 3.722 50 0 FHAAMO O=C(c1ccc2ncccc2c1)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000077470694 571212928 /nfs/dbraw/zinc/21/29/28/571212928.db2.gz 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C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]Cc1noc(C(C)(C)C)n1 ZINC000170597561 571266630 /nfs/dbraw/zinc/26/66/30/571266630.db2.gz MGTHBTKJCIBYJO-KGLIPLIRSA-N 1 1 366.506 3.635 50 0 FHAAMO COc1cccc(NC(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000037477361 571285787 /nfs/dbraw/zinc/28/57/87/571285787.db2.gz RVMYKIPAAHCWTF-ICSRJNTNSA-N 1 1 351.450 3.843 50 0 FHAAMO COc1ccc2cc(C[N@H+](C)CC(=O)NCc3ccccc3F)ccc2c1 ZINC000007806061 571289496 /nfs/dbraw/zinc/28/94/96/571289496.db2.gz XBOCFXWIVKLFAC-UHFFFAOYSA-N 1 1 366.436 3.736 50 0 FHAAMO COc1ccc2cc(C[N@@H+](C)CC(=O)NCc3ccccc3F)ccc2c1 ZINC000007806061 571289497 /nfs/dbraw/zinc/28/94/97/571289497.db2.gz XBOCFXWIVKLFAC-UHFFFAOYSA-N 1 1 366.436 3.736 50 0 FHAAMO CCc1cc2c(cc1[C@H]1Cc3ccc(OC)c(OC)c3C[N@@H+]1C)OCO2 ZINC000019908456 571308272 /nfs/dbraw/zinc/30/82/72/571308272.db2.gz LMBCNGKKYKSVKG-QGZVFWFLSA-N 1 1 355.434 3.724 50 0 FHAAMO CCc1cc2c(cc1[C@H]1Cc3ccc(OC)c(OC)c3C[N@H+]1C)OCO2 ZINC000019908456 571308274 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FHAAMO C[C@H]1C[C@@H](NC(=O)COc2ccc(Cl)cc2)CC[N@H+]1Cc1ccccc1 ZINC000095408972 571329404 /nfs/dbraw/zinc/32/94/04/571329404.db2.gz KCGKQJKCNOZBBR-LPHOPBHVSA-N 1 1 372.896 3.888 50 0 FHAAMO CC(C)CNC(=O)C[N@@H+](C)[C@H](C)c1ccc(-n2cnc3ccccc32)cc1 ZINC000095455998 571329998 /nfs/dbraw/zinc/32/99/98/571329998.db2.gz LSVJXTHFJQWFKA-QGZVFWFLSA-N 1 1 364.493 3.791 50 0 FHAAMO COc1cc(C)ccc1C[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000095454579 571330048 /nfs/dbraw/zinc/33/00/48/571330048.db2.gz LZCAHYULHGVFOL-NHCUHLMSSA-N 1 1 374.912 3.819 50 0 FHAAMO CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc(-n2cc[nH+]c2C)nc1 ZINC000095963929 571333111 /nfs/dbraw/zinc/33/31/11/571333111.db2.gz CDDQFFZSJMYFNK-SFHVURJKSA-N 1 1 350.422 3.680 50 0 FHAAMO CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1c[nH+]ccc1-n1cccn1 ZINC000095963645 571333122 /nfs/dbraw/zinc/33/31/22/571333122.db2.gz SYJQLTDDCRAQTA-MRXNPFEDSA-N 1 1 356.813 3.717 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cccc(Cn3cccn3)c2)cc1 ZINC000028306446 571339006 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C[C@H]1CCC[N@@H+](CCNC(=O)c2cc(Br)ccc2Cl)C1 ZINC000046877830 211843101 /nfs/dbraw/zinc/84/31/01/211843101.db2.gz JSBVADNWWUVIAU-NSHDSACASA-N 1 1 359.695 3.564 50 0 FHAAMO Cc1c2ccccc2[nH]c1CN1CC[N@H+](C2CCCCC2)[C@H](CCO)C1 ZINC000039500578 211709161 /nfs/dbraw/zinc/70/91/61/211709161.db2.gz UGSCIFHLOLQYGN-LJQANCHMSA-N 1 1 355.526 3.678 50 0 FHAAMO COc1ccccc1[C@H](CNC(=O)c1ccc(OCC(C)C)cc1)[NH+](C)C ZINC000023713833 211395116 /nfs/dbraw/zinc/39/51/16/211395116.db2.gz PDGGMDSXDPCJFT-FQEVSTJZSA-N 1 1 370.493 3.763 50 0 FHAAMO Clc1ccccc1-c1cn(C2CC[NH+](Cc3nccs3)CC2)nn1 ZINC000023507022 211391020 /nfs/dbraw/zinc/39/10/20/211391020.db2.gz ASLJMANHQHMIQY-UHFFFAOYSA-N 1 1 359.886 3.892 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)CCC(=O)c1ccc(Cl)cc1)c1cccs1 ZINC000023409008 211389789 /nfs/dbraw/zinc/38/97/89/211389789.db2.gz VHUJGCUBSMZZQB-HNNXBMFYSA-N 1 1 364.898 3.784 50 0 FHAAMO COc1cc(OC)c(C[N@@H+](C)CCc2ccccn2)cc1Br ZINC000023114736 211375561 /nfs/dbraw/zinc/37/55/61/211375561.db2.gz 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ZINC000022292957 211346549 /nfs/dbraw/zinc/34/65/49/211346549.db2.gz HNYRXLGOGIJRKX-ZIAGYGMSSA-N 1 1 361.486 3.941 50 0 FHAAMO O=C(N1CCC[N@@H+](Cc2ccccc2)CC1)C12CC3CC(CC(C3)C1)C2 ZINC000022610894 211357339 /nfs/dbraw/zinc/35/73/39/211357339.db2.gz GEFZNLXIWWQURF-UHFFFAOYSA-N 1 1 352.522 3.937 50 0 FHAAMO CC[N@@H+](Cc1ccncc1)[C@H]1CCCN(Cc2ccc(F)c(OC)c2)C1 ZINC000020999834 211302865 /nfs/dbraw/zinc/30/28/65/211302865.db2.gz QXTAXDQYICKEQS-IBGZPJMESA-N 1 1 357.473 3.716 50 0 FHAAMO Fc1ccc2nc(C3CC[NH+]([C@@H]4COc5ccccc5C4)CC3)[nH]c2c1 ZINC000020996874 211301035 /nfs/dbraw/zinc/30/10/35/211301035.db2.gz QVXRBQUBADZCEW-KRWDZBQOSA-N 1 1 351.425 3.885 50 0 FHAAMO Cc1ccc(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1F ZINC000020889885 211299412 /nfs/dbraw/zinc/29/94/12/211299412.db2.gz HTSFQMGWGDZHHM-GOSISDBHSA-N 1 1 355.457 3.820 50 0 FHAAMO CC(=O)c1cc(CN2CCC[C@H]([N@H+]3CCc4ccccc4C3)C2)cs1 ZINC000020786069 211295978 /nfs/dbraw/zinc/29/59/78/211295978.db2.gz ZYKXNPIOFSQGGD-FQEVSTJZSA-N 1 1 354.519 3.973 50 0 FHAAMO Cc1ccccc1CN1CC[N@H+](C2C3CC4CC(C3)CC2C4)C[C@@H]1CCO ZINC000020601764 211289649 /nfs/dbraw/zinc/28/96/49/211289649.db2.gz YNPXYOHUDMRUFW-AEPNLLPJSA-N 1 1 368.565 3.688 50 0 FHAAMO O=C(NCCC[NH+]1CCOCC1)c1sc2cc(Cl)ccc2c1Cl ZINC000020494030 211282821 /nfs/dbraw/zinc/28/28/21/211282821.db2.gz UESNROSHBRNIFW-UHFFFAOYSA-N 1 1 373.305 3.660 50 0 FHAAMO COc1ccc(C[NH2+][C@@H](C(=O)Nc2nccs2)c2ccccc2)cc1 ZINC000020405876 211279745 /nfs/dbraw/zinc/27/97/45/211279745.db2.gz VOWCGMWRMOGBKJ-QGZVFWFLSA-N 1 1 353.447 3.621 50 0 FHAAMO CC(C)CC[N@H+]1CCN(Cc2cccc(C(F)(F)F)c2)C[C@@H]1CCO ZINC000020207425 211271953 /nfs/dbraw/zinc/27/19/53/211271953.db2.gz GYJJSBIQDUTZSX-SFHVURJKSA-N 1 1 358.448 3.620 50 0 FHAAMO Cc1cc(C)n(-c2cccc(CN(C)C(=O)CC[N@@H+]3CCC[C@@H](C)C3)c2)n1 ZINC000019732299 211251915 /nfs/dbraw/zinc/25/19/15/211251915.db2.gz ZBCZBDMSSNDWIP-QGZVFWFLSA-N 1 1 368.525 3.570 50 0 FHAAMO CCCCC[N@H+]1CCC[C@H]1c1ccc(C(=O)N2CCc3n[nH]cc3C2)s1 ZINC000019744877 211253011 /nfs/dbraw/zinc/25/30/11/211253011.db2.gz LDDHSFGZDDJCEQ-KRWDZBQOSA-N 1 1 372.538 3.997 50 0 FHAAMO COc1ccc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)cc1OC ZINC000019358782 211218026 /nfs/dbraw/zinc/21/80/26/211218026.db2.gz FGJGILJHBCHLNT-RMKNXTFCSA-N 1 1 352.478 3.535 50 0 FHAAMO COc1ccc(-c2cccc(-c3ccn(CC[C@@H]4CCC[N@H+]4C)n3)c2)nn1 ZINC000019111866 211201751 /nfs/dbraw/zinc/20/17/51/211201751.db2.gz RFPJSABZOICOKQ-SFHVURJKSA-N 1 1 363.465 3.500 50 0 FHAAMO C[N@H+](Cc1ccccc1)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O ZINC000018142399 211192277 /nfs/dbraw/zinc/19/22/77/211192277.db2.gz ZEBRYQIFEQADMS-INIZCTEOSA-N 1 1 363.244 3.757 50 0 FHAAMO C[N@@H+](Cc1ccccc1)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O ZINC000018142399 211192281 /nfs/dbraw/zinc/19/22/81/211192281.db2.gz ZEBRYQIFEQADMS-INIZCTEOSA-N 1 1 363.244 3.757 50 0 FHAAMO C[C@@H]1C[C@@H]1c1ccc(/C=C/C(=O)N2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000016202657 211156696 /nfs/dbraw/zinc/15/66/96/211156696.db2.gz ZEOKUKKJXKXNLI-WLZBKEPESA-N 1 1 350.462 3.761 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)c3cccc(Br)c3)sc2C1 ZINC000015880159 211149659 /nfs/dbraw/zinc/14/96/59/211149659.db2.gz KWDTYDFAAJCRSF-UHFFFAOYSA-N 1 1 366.284 3.536 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)c3cccc(Br)c3)sc2C1 ZINC000015880159 211149662 /nfs/dbraw/zinc/14/96/62/211149662.db2.gz KWDTYDFAAJCRSF-UHFFFAOYSA-N 1 1 366.284 3.536 50 0 FHAAMO Cc1ccc(NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)c1 ZINC000015831700 211145673 /nfs/dbraw/zinc/14/56/73/211145673.db2.gz WRWJUMPCBHBNGD-FQEVSTJZSA-N 1 1 351.494 3.990 50 0 FHAAMO CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2CC[NH+]2CCOCC2)cc1 ZINC000015831556 211145026 /nfs/dbraw/zinc/14/50/26/211145026.db2.gz UVDCRANUWOKOLX-FQEVSTJZSA-N 1 1 358.526 3.701 50 0 FHAAMO COc1cccc(NC(=O)N2CCC(C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)c1 ZINC000015830984 211145070 /nfs/dbraw/zinc/14/50/70/211145070.db2.gz LRYRVFZWWJUOHC-CALCHBBNSA-N 1 1 359.514 3.917 50 0 FHAAMO CCOC(=O)c1c(C)oc2ncnc(NCCC[N@H+]3CCCC[C@H]3CC)c21 ZINC000015727191 211140092 /nfs/dbraw/zinc/14/00/92/211140092.db2.gz 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CC(=O)c1cccc(C[N@H+]2CCC[C@H](CNC(=O)c3cccs3)C2)c1 ZINC000014957495 211107189 /nfs/dbraw/zinc/10/71/89/211107189.db2.gz BZLRXSWZPHBYCA-QGZVFWFLSA-N 1 1 356.491 3.593 50 0 FHAAMO Cc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CC2CCCCC2)C3)cn1 ZINC000014952719 211106612 /nfs/dbraw/zinc/10/66/12/211106612.db2.gz IBLOVMYGCQZJGP-QFIPXVFZSA-N 1 1 355.526 3.898 50 0 FHAAMO COc1ccc(Cl)cc1C[N@@H+](C)C[C@H](O)COc1cc(C)ccc1C ZINC000014200931 211086199 /nfs/dbraw/zinc/08/61/99/211086199.db2.gz FMTSCQLKKKHAPZ-SFHVURJKSA-N 1 1 363.885 3.837 50 0 FHAAMO O=C(c1ccccc1)C1CC[NH+](Cc2cc(=O)oc3cc(O)ccc23)CC1 ZINC000014094055 211070919 /nfs/dbraw/zinc/07/09/19/211070919.db2.gz UJCZIVJDWDPSSS-UHFFFAOYSA-N 1 1 363.413 3.594 50 0 FHAAMO Cc1[nH+]c2cc3c(cc2n1CC(=O)Nc1ccc(C)c(C)c1)OCCCO3 ZINC000014000699 211067612 /nfs/dbraw/zinc/06/76/12/211067612.db2.gz PICRCLAUBLKFLC-UHFFFAOYSA-N 1 1 365.433 3.762 50 0 FHAAMO O=C(Nc1cccc(Cl)c1)N1CCC[N@@H+](CCc2ccncc2)CC1 ZINC000013718430 211051432 /nfs/dbraw/zinc/05/14/32/211051432.db2.gz DEJRKIOELRDJNX-UHFFFAOYSA-N 1 1 358.873 3.517 50 0 FHAAMO CCc1cc2c(C[N@@H+](C)CCOc3cccc(C)c3)cc(=O)oc2cc1O ZINC000012926760 211009007 /nfs/dbraw/zinc/00/90/07/211009007.db2.gz GDTKVKVMMQSHOI-UHFFFAOYSA-N 1 1 367.445 3.880 50 0 FHAAMO O=C1c2ccccc2C(=O)N1CC[N@@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000012900500 211005658 /nfs/dbraw/zinc/00/56/58/211005658.db2.gz QHRYHJFHAGEZKT-UHFFFAOYSA-N 1 1 371.440 3.553 50 0 FHAAMO COc1ccc(F)c(CN2CCC[C@@]3(CC[N@@H+](CCC(C)C)C3)C2=O)c1 ZINC000012073766 210913008 /nfs/dbraw/zinc/91/30/08/210913008.db2.gz DUESPEBGOZATQN-NRFANRHFSA-N 1 1 362.489 3.695 50 0 FHAAMO O=C(C[NH+]1CCCCC1)N1N=C(c2cccs2)C[C@H]1c1ccc(O)cc1 ZINC000010433980 210370971 /nfs/dbraw/zinc/37/09/71/210370971.db2.gz FNJQFXIMHYYQCK-SFHVURJKSA-N 1 1 369.490 3.617 50 0 FHAAMO Cc1ccc(-c2csc3ncnc(NCCC[NH+]4CCOCC4)c23)cc1 ZINC000019911528 220304884 /nfs/dbraw/zinc/30/48/84/220304884.db2.gz JXAAYYMWMICKMU-UHFFFAOYSA-N 1 1 368.506 3.801 50 0 FHAAMO Cc1oc2cc(OC(=O)[C@H]3CCC[NH2+]3)ccc2c(=O)c1Oc1ccccc1 ZINC000061989732 221138279 /nfs/dbraw/zinc/13/82/79/221138279.db2.gz PLCKZDLFRVRNSQ-QGZVFWFLSA-N 1 1 365.385 3.551 50 0 FHAAMO COc1cccc(C[N@H+]2CCCn3nc(-c4cccc(OC)c4)cc3C2)c1 ZINC000065270405 221191223 /nfs/dbraw/zinc/19/12/23/221191223.db2.gz SQTPRKGVYYWFSI-UHFFFAOYSA-N 1 1 363.461 3.973 50 0 FHAAMO COc1cccc(C[N@@H+]2CCCn3nc(-c4cccc(OC)c4)cc3C2)c1 ZINC000065270405 221191224 /nfs/dbraw/zinc/19/12/24/221191224.db2.gz SQTPRKGVYYWFSI-UHFFFAOYSA-N 1 1 363.461 3.973 50 0 FHAAMO C[N@H+](Cc1ccc(C(=O)Nc2ccc(Cl)cn2)cc1)C[C@@H]1CCCO1 ZINC000065376108 221206427 /nfs/dbraw/zinc/20/64/27/221206427.db2.gz WUSJXEPLTNIJJT-KRWDZBQOSA-N 1 1 359.857 3.598 50 0 FHAAMO CC/C=C\CCc1c(-c2ccccc2)ncn1CCN1CC[NH+](C)CC1 ZINC000065454971 221220325 /nfs/dbraw/zinc/22/03/25/221220325.db2.gz MJBGDLPFDUUKID-PLNGDYQASA-N 1 1 352.526 3.696 50 0 FHAAMO C[N@H+]1CC[C@@H](Cn2cnc(-c3ccccc3)c2-c2cccc3nonc32)C1 ZINC000065533229 221233090 /nfs/dbraw/zinc/23/30/90/221233090.db2.gz RRSGVJSTHKUJDZ-OAHLLOKOSA-N 1 1 359.433 3.705 50 0 FHAAMO O=C(CCCOc1cccc2ccccc21)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000065591687 221234788 /nfs/dbraw/zinc/23/47/88/221234788.db2.gz HJGUBHSFDGKZNR-IBGZPJMESA-N 1 1 352.478 3.696 50 0 FHAAMO Cc1cccnc1C[C@@H](C)[N@@H+](C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000067654106 221266747 /nfs/dbraw/zinc/26/67/47/221266747.db2.gz JVXXJGZSQSVURS-GOSISDBHSA-N 1 1 351.494 3.558 50 0 FHAAMO CC(C)CCC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1cnn(C)c1C1CC1)C2 ZINC000067489866 221257321 /nfs/dbraw/zinc/25/73/21/221257321.db2.gz MAXHSWPITJJILH-JOCHJYFZSA-N 1 1 372.557 3.548 50 0 FHAAMO Cc1ccc2nc(C[NH2+]C[C@@]3(c4ccc(F)cc4)CCOC3)[nH]c2c1C ZINC000067490514 221257749 /nfs/dbraw/zinc/25/77/49/221257749.db2.gz OBXCHRUEPCMRNU-NRFANRHFSA-N 1 1 353.441 3.767 50 0 FHAAMO Oc1cc(-c2cccnc2)cc2c1OCC[N@H+](C1Cc3ccccc3C1)C2 ZINC000067587436 221259792 /nfs/dbraw/zinc/25/97/92/221259792.db2.gz ZSBNHJDOWWILPW-UHFFFAOYSA-N 1 1 358.441 3.816 50 0 FHAAMO Cc1cccnc1C[C@H](C)[N@@H+](C)Cc1cc2ccc(Cl)cc2[nH]c1=O ZINC000067588863 221261133 /nfs/dbraw/zinc/26/11/33/221261133.db2.gz BPOHMYVMSZFRRJ-AWEZNQCLSA-N 1 1 355.869 3.948 50 0 FHAAMO CCC[C@H]1C=CC[N@H+]1Cc1ccc(C(=O)Nc2c(C)cc(=O)[nH]c2C)cc1 ZINC000067723235 221276372 /nfs/dbraw/zinc/27/63/72/221276372.db2.gz MJZYJAGUMCKQLF-IBGZPJMESA-N 1 1 365.477 3.785 50 0 FHAAMO Cc1ccc2nc(CCCNc3nc(CC[NH3+])nc4ccccc43)[nH]c2c1C ZINC000067725939 221278216 /nfs/dbraw/zinc/27/82/16/221278216.db2.gz SDWYUPVMGDGNKT-UHFFFAOYSA-N 1 1 374.492 3.669 50 0 FHAAMO Cc1ccc(-c2cc(O)c3c(c2)CN(CCn2cc[nH+]c2C)CCO3)s1 ZINC000067691363 221272336 /nfs/dbraw/zinc/27/23/36/221272336.db2.gz JNOJSRYFRXOPGA-UHFFFAOYSA-N 1 1 369.490 3.829 50 0 FHAAMO CN(Cc1cccc(F)c1)C(=O)C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000070016933 221330538 /nfs/dbraw/zinc/33/05/38/221330538.db2.gz HPLQZDJLGFGACK-OAQYLSRUSA-N 1 1 354.469 3.881 50 0 FHAAMO CC[C@H]1C[N@H+](Cc2cncn2CC(C)C)CCC(=O)N1Cc1ccccc1 ZINC000071524328 221350689 /nfs/dbraw/zinc/35/06/89/221350689.db2.gz LUMDHCCRVSSDMA-FQEVSTJZSA-N 1 1 368.525 3.552 50 0 FHAAMO CC[C@H]1C[N@@H+](Cc2cncn2CC(C)C)CCC(=O)N1Cc1ccccc1 ZINC000071524328 221350691 /nfs/dbraw/zinc/35/06/91/221350691.db2.gz LUMDHCCRVSSDMA-FQEVSTJZSA-N 1 1 368.525 3.552 50 0 FHAAMO Cc1cncc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1 ZINC000071750509 221361861 /nfs/dbraw/zinc/36/18/61/221361861.db2.gz JKDJMLRRGQDYLX-OAQYLSRUSA-N 1 1 369.484 3.902 50 0 FHAAMO CC[C@H]1C[N@@H+](Cc2c(C)nn(CC)c2C)CCC(=O)N1Cc1ccccc1 ZINC000071708002 221355318 /nfs/dbraw/zinc/35/53/18/221355318.db2.gz JTVZMBCDDPGEKQ-FQEVSTJZSA-N 1 1 368.525 3.533 50 0 FHAAMO COc1ccc(-c2nc(CN3CC([N@H+]4CCCC[C@H]4C)C3)c(C)o2)c(F)c1 ZINC000071762636 221370036 /nfs/dbraw/zinc/37/00/36/221370036.db2.gz YGSIUTSARSTCHU-CQSZACIVSA-N 1 1 373.472 3.856 50 0 FHAAMO CC(C)c1nc(Cn2cc[nH+]c2[C@H](C)Cc2ccc3c(c2)OCO3)no1 ZINC000071761961 221370092 /nfs/dbraw/zinc/37/00/92/221370092.db2.gz ISWIBIZKNVUWGT-CYBMUJFWSA-N 1 1 354.410 3.513 50 0 FHAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@H](CCc2ccc(F)c(F)c2)C1 ZINC000071763925 221371925 /nfs/dbraw/zinc/37/19/25/221371925.db2.gz VKLHDJGKEKOQHP-MRXNPFEDSA-N 1 1 361.436 3.595 50 0 FHAAMO Clc1cccnc1N1CCC(c2[nH+]ccn2Cc2ccccn2)CC1 ZINC000095508666 132212976 /nfs/dbraw/zinc/21/29/76/132212976.db2.gz IERXTOPTDAOUDU-UHFFFAOYSA-N 1 1 353.857 3.759 50 0 FHAAMO Cc1cc2c(ncnc2N2CCC([N@H+](C)Cc3nccs3)CC2)s1 ZINC000095522295 132214115 /nfs/dbraw/zinc/21/41/15/132214115.db2.gz FHWOKTVMXCAXKT-UHFFFAOYSA-N 1 1 359.524 3.557 50 0 FHAAMO Cc1cc2c(ncnc2N2CCC([N@@H+](C)Cc3nccs3)CC2)s1 ZINC000095522295 132214117 /nfs/dbraw/zinc/21/41/17/132214117.db2.gz FHWOKTVMXCAXKT-UHFFFAOYSA-N 1 1 359.524 3.557 50 0 FHAAMO CC[NH+]1CCN(c2ccc(NC(=O)c3cccc(F)c3)cc2Cl)CC1 ZINC000000809778 132378648 /nfs/dbraw/zinc/37/86/48/132378648.db2.gz IVTVJPLZMWAZDG-UHFFFAOYSA-N 1 1 361.848 3.873 50 0 FHAAMO CC[NH+]1CCN(c2ccc(NC(=O)/C=C/c3ccco3)cc2Cl)CC1 ZINC000001854284 132382583 /nfs/dbraw/zinc/38/25/83/132382583.db2.gz QSULJURGFIOCCG-SOFGYWHQSA-N 1 1 359.857 3.727 50 0 FHAAMO CC(C)c1cccc(N2CC[NH+](Cc3cccc4nsnc43)CC2)n1 ZINC000067654561 136137283 /nfs/dbraw/zinc/13/72/83/136137283.db2.gz HDFYJWJDRFEOCU-UHFFFAOYSA-N 1 1 353.495 3.532 50 0 FHAAMO C[C@H](CC(=O)N1c2ccccc2Sc2ccccc21)[NH+]1CCOCC1 ZINC000071770751 136140939 /nfs/dbraw/zinc/14/09/39/136140939.db2.gz YRCPOQKNPFNYBN-OAHLLOKOSA-N 1 1 354.475 3.927 50 0 FHAAMO c1ccc2c(c1)[nH]c1c2CCN(c2nc(C3CCCC3)nc3c2C[NH2+]C3)C1 ZINC000072157953 136143094 /nfs/dbraw/zinc/14/30/94/136143094.db2.gz QCGNDKBOKVEDHG-UHFFFAOYSA-N 1 1 359.477 3.781 50 0 FHAAMO Cc1nn(C(C)C)c(C)c1CN(C)C(=O)[C@H](c1ccccc1C)[NH+](C)C ZINC000095359439 221860297 /nfs/dbraw/zinc/86/02/97/221860297.db2.gz LMHRKPUHMUUQJZ-FQEVSTJZSA-N 1 1 356.514 3.651 50 0 FHAAMO O=C(NC[C@H](c1ccc(Cl)cc1)[NH+]1CCCC1)c1n[nH]c2c1CCCC2 ZINC000096152491 222054845 /nfs/dbraw/zinc/05/48/45/222054845.db2.gz JLBTZRRWWDEKHA-GOSISDBHSA-N 1 1 372.900 3.509 50 0 FHAAMO CC[N@H+](CC(=O)NCCc1nc2ccccc2s1)Cc1cccs1 ZINC000096955434 222146009 /nfs/dbraw/zinc/14/60/09/222146009.db2.gz AQLGSQRFVNWQIC-UHFFFAOYSA-N 1 1 359.520 3.539 50 0 FHAAMO CC[N@@H+](CC(=O)NCCc1nc2ccccc2s1)Cc1cccs1 ZINC000096955434 222146012 /nfs/dbraw/zinc/14/60/12/222146012.db2.gz AQLGSQRFVNWQIC-UHFFFAOYSA-N 1 1 359.520 3.539 50 0 FHAAMO Fc1ccc(C[N@H+]2CCC[C@H](Nc3nccc(-c4cccnc4)n3)C2)cc1 ZINC000097436774 222180472 /nfs/dbraw/zinc/18/04/72/222180472.db2.gz WODHNFFYZJFIDO-IBGZPJMESA-N 1 1 363.440 3.754 50 0 FHAAMO O=C(NC1(c2cccc(Cl)c2)CC1)[C@H](c1cccnc1)[NH+]1CCCC1 ZINC000097604057 222198312 /nfs/dbraw/zinc/19/83/12/222198312.db2.gz QPGVXXAAITZDHF-SFHVURJKSA-N 1 1 355.869 3.677 50 0 FHAAMO Clc1nc(N2CCCC2)sc1C[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000097604277 222199052 /nfs/dbraw/zinc/19/90/52/222199052.db2.gz AXHAXMIPDRWCAY-CYBMUJFWSA-N 1 1 363.918 3.566 50 0 FHAAMO Clc1nc(N2CCCC2)sc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000097604277 222199053 /nfs/dbraw/zinc/19/90/53/222199053.db2.gz AXHAXMIPDRWCAY-CYBMUJFWSA-N 1 1 363.918 3.566 50 0 FHAAMO COc1ccc2ccccc2c1CN1CC[N@@H+](CC(C)(C)C)[C@H](CCO)C1 ZINC000104397494 222358581 /nfs/dbraw/zinc/35/85/81/222358581.db2.gz IDQPVBKDAXWWIO-LJQANCHMSA-N 1 1 370.537 3.763 50 0 FHAAMO Fc1cccc([C@@H]2CCC[N@H+]2C[C@H]2CN(Cc3ccccc3)CCO2)c1 ZINC000106109725 222382052 /nfs/dbraw/zinc/38/20/52/222382052.db2.gz MGTNBLMEXLEPLM-YADHBBJMSA-N 1 1 354.469 3.864 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@H]2CCOc3ccccc32)C1 ZINC000106526652 222386519 /nfs/dbraw/zinc/38/65/19/222386519.db2.gz KVVFCTWEPDRTQE-SCTDSRPQSA-N 1 1 359.514 3.568 50 0 FHAAMO CC(C)(CNC(=O)c1cccc(OC(F)F)c1)[N@H+]1CCc2ccccc2C1 ZINC000025461047 263388323 /nfs/dbraw/zinc/38/83/23/263388323.db2.gz IZNYLTFWXRHPBQ-UHFFFAOYSA-N 1 1 374.431 3.855 50 0 FHAAMO O=C(CC[C@H]1CCC[N@@H+](Cc2ccnc3ccccc23)C1)N1CCCC1 ZINC000011754261 518198374 /nfs/dbraw/zinc/19/83/74/518198374.db2.gz YNOOKFVCDVGKQF-GOSISDBHSA-N 1 1 351.494 3.849 50 0 FHAAMO CC(C)CCc1noc(CN2CCC[N@H+](Cc3cccc(F)c3)CC2)n1 ZINC000020201641 519699606 /nfs/dbraw/zinc/69/96/06/519699606.db2.gz DMSABLUFLROPEQ-UHFFFAOYSA-N 1 1 360.477 3.505 50 0 FHAAMO CC(C)CCc1noc(CN2CCC[N@@H+](Cc3cccc(F)c3)CC2)n1 ZINC000020201641 519699609 /nfs/dbraw/zinc/69/96/09/519699609.db2.gz DMSABLUFLROPEQ-UHFFFAOYSA-N 1 1 360.477 3.505 50 0 FHAAMO CC(C)OCc1cccc(NC(=O)N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@H]3C2)c1 ZINC000252506460 519776136 /nfs/dbraw/zinc/77/61/36/519776136.db2.gz SZUJJDHBGDYPQN-IHPCNDPISA-N 1 1 357.498 3.560 50 0 FHAAMO CCC[N@H+]1CCCn2nc(CNC(=O)Nc3cccc(SC)c3)cc2C1 ZINC000082138451 519854645 /nfs/dbraw/zinc/85/46/45/519854645.db2.gz JCWPLRRZFBUIKR-UHFFFAOYSA-N 1 1 373.526 3.542 50 0 FHAAMO CCOC(=O)C1(CC2CC2)CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000019788288 520456973 /nfs/dbraw/zinc/45/69/73/520456973.db2.gz VWKUBMAYWUUZHL-NRFANRHFSA-N 1 1 370.537 3.706 50 0 FHAAMO CCOC(=O)C1(CC2CC2)CC[NH+]([C@H]2CCN(Cc3ccccc3)C2)CC1 ZINC000019788288 520456978 /nfs/dbraw/zinc/45/69/78/520456978.db2.gz VWKUBMAYWUUZHL-NRFANRHFSA-N 1 1 370.537 3.706 50 0 FHAAMO CCN(CC)[C@H](CNC(=O)C[NH2+]C(C)(C)CC(C)(C)C)c1ccco1 ZINC000089967794 520861271 /nfs/dbraw/zinc/86/12/71/520861271.db2.gz IGGPPMXUYFTDJA-MRXNPFEDSA-N 1 1 351.535 3.583 50 0 FHAAMO CCCCc1ccc(NC(=O)CN2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000019834174 521279078 /nfs/dbraw/zinc/27/90/78/521279078.db2.gz LGYASQGXWJGUJD-UHFFFAOYSA-N 1 1 365.521 3.786 50 0 FHAAMO CCCn1ncc(C[N@@H+](C)[C@@H]2CCCN(Cc3ccccc3F)C2)c1C ZINC000020385720 521671737 /nfs/dbraw/zinc/67/17/37/521671737.db2.gz AOAHEMNSJQFXKM-HXUWFJFHSA-N 1 1 358.505 3.837 50 0 FHAAMO CCCn1ncc(CN(C)[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)c1C ZINC000020385720 521671741 /nfs/dbraw/zinc/67/17/41/521671741.db2.gz AOAHEMNSJQFXKM-HXUWFJFHSA-N 1 1 358.505 3.837 50 0 FHAAMO CCCn1ncc(CN(C)[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)c1C ZINC000020385720 521671743 /nfs/dbraw/zinc/67/17/43/521671743.db2.gz AOAHEMNSJQFXKM-HXUWFJFHSA-N 1 1 358.505 3.837 50 0 FHAAMO CC[C@H](C)[C@@H]([NH3+])C(=O)Oc1ccc2c(c1)occ(-c1csc(C)n1)c2=O ZINC000020111166 521843028 /nfs/dbraw/zinc/84/30/28/521843028.db2.gz SQZMXPOAPPQOMP-DYZYQPBXSA-N 1 1 372.446 3.504 50 0 FHAAMO C[C@@H]1CCC[C@H](NC(=O)C[N@H+](C)CCOc2ccc(Cl)cc2)[C@H]1C ZINC000241701766 524395187 /nfs/dbraw/zinc/39/51/87/524395187.db2.gz QKYBOZNEHLMKFW-VKJFTORMSA-N 1 1 352.906 3.592 50 0 FHAAMO C[C@@H]1CCC[C@H](NC(=O)C[N@@H+](C)CCOc2ccc(Cl)cc2)[C@H]1C ZINC000241701766 524395198 /nfs/dbraw/zinc/39/51/98/524395198.db2.gz QKYBOZNEHLMKFW-VKJFTORMSA-N 1 1 352.906 3.592 50 0 FHAAMO C[C@@H]1CCC[C@H](OCC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000252666186 524411317 /nfs/dbraw/zinc/41/13/17/524411317.db2.gz ASHCZBLTJLUGOC-QCFAMHMHSA-N 1 1 358.526 3.751 50 0 FHAAMO COc1ccc(OC)c([C@H](C)NC(=O)C[N@H+]2CCC[C@H]2C2CCCCC2)c1 ZINC000242389493 524901060 /nfs/dbraw/zinc/90/10/60/524901060.db2.gz ZXQDMCKJNVRGKZ-JXFKEZNVSA-N 1 1 374.525 3.926 50 0 FHAAMO Cc1ccc([C@@H](C(=O)NCC2(COc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000091594342 525678037 /nfs/dbraw/zinc/67/80/37/525678037.db2.gz LPZFFPNJPFWIPM-FQEVSTJZSA-N 1 1 352.478 3.573 50 0 FHAAMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CCC(=O)NC(=O)NC1CCCC1 ZINC000040057186 526033817 /nfs/dbraw/zinc/03/38/17/526033817.db2.gz HLPLLRMPRMJTSC-AWEZNQCLSA-N 1 1 357.454 3.584 50 0 FHAAMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2S(=O)(=O)c1ccc(C)c(C)c1 ZINC000247722604 526213413 /nfs/dbraw/zinc/21/34/13/526213413.db2.gz BTENQHICBYPQQY-TZIWHRDSSA-N 1 1 370.518 3.608 50 0 FHAAMO Cc1nc(C)c(CN(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)nc1C ZINC000020537688 526716357 /nfs/dbraw/zinc/71/63/57/526716357.db2.gz ZYHLOLBARITBRS-NRFANRHFSA-N 1 1 352.526 3.541 50 0 FHAAMO O=C(COc1ccccc1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2cccs2)C1 ZINC000020538925 526982800 /nfs/dbraw/zinc/98/28/00/526982800.db2.gz FFCDMLKLMBBEGY-XLIONFOSSA-N 1 1 370.518 3.640 50 0 FHAAMO O=C(Cn1ccc2ccc(Cl)cc21)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000079189268 527379688 /nfs/dbraw/zinc/37/96/88/527379688.db2.gz VEYZTPPOQABOJQ-FUHWJXTLSA-N 1 1 359.901 3.675 50 0 FHAAMO OCC[C@H]1CN(Cc2c(F)cccc2Cl)CC[N@@H+]1Cc1cccs1 ZINC000020206747 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C[N@@H+](Cc1c(Cl)cncc1Cl)C[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000216385499 568121097 /nfs/dbraw/zinc/12/10/97/568121097.db2.gz GQDYJJWYVIGWOW-LBPRGKRZSA-N 1 1 356.297 3.611 50 0 FHAAMO C[N@H+](Cc1c(Cl)cncc1Cl)C[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000216385499 568121098 /nfs/dbraw/zinc/12/10/98/568121098.db2.gz GQDYJJWYVIGWOW-LBPRGKRZSA-N 1 1 356.297 3.611 50 0 FHAAMO CCc1nn(C)c(Cl)c1CN1CCC[N@@H+](CC2CC2)[C@@H](C(C)C)C1 ZINC000216419877 568122684 /nfs/dbraw/zinc/12/26/84/568122684.db2.gz LEEAWFXMCUXCMK-GOSISDBHSA-N 1 1 352.954 3.578 50 0 FHAAMO Cc1ccc(C[N@H+]2CC[C@]3(C2)CCCN(Cc2cccnc2)C3=O)cc1C ZINC000012314988 568135192 /nfs/dbraw/zinc/13/51/92/568135192.db2.gz GMIWVVYVGNMLBR-QHCPKHFHSA-N 1 1 363.505 3.713 50 0 FHAAMO Cc1ccc2c(c1)C[N@@H+](CCC(=O)N[C@@H](C)c1ccc(F)cc1)C[C@@H](C)O2 ZINC000012328971 568182154 /nfs/dbraw/zinc/18/21/54/568182154.db2.gz FARFBMZOBFYIQC-SJORKVTESA-N 1 1 370.468 3.985 50 0 FHAAMO CN(C)c1ccc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c2ccccc21 ZINC000220258325 568331490 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ZINC000011840923 570709249 /nfs/dbraw/zinc/70/92/49/570709249.db2.gz WCKQZDIOVZQCGK-FQEVSTJZSA-N 1 1 356.535 3.846 50 0 FHAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc(F)cc3)oc2C)C1 ZINC000011842421 570709261 /nfs/dbraw/zinc/70/92/61/570709261.db2.gz FMWUJTIXFQDZPM-KRWDZBQOSA-N 1 1 373.472 3.870 50 0 FHAAMO CCCn1cc(C[N@@H+]2CCC[C@H](C(=O)c3ccccc3OC)C2)c(C)n1 ZINC000011844047 570709770 /nfs/dbraw/zinc/70/97/70/570709770.db2.gz CQRIHAUTDZDGTE-KRWDZBQOSA-N 1 1 355.482 3.705 50 0 FHAAMO CCCn1cc(C[N@H+]2CCC[C@H](C(=O)c3ccccc3OC)C2)c(C)n1 ZINC000011844047 570709772 /nfs/dbraw/zinc/70/97/72/570709772.db2.gz CQRIHAUTDZDGTE-KRWDZBQOSA-N 1 1 355.482 3.705 50 0 FHAAMO CCN(Cc1[nH]cnc1C)C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000011935766 570712051 /nfs/dbraw/zinc/71/20/51/570712051.db2.gz XNQOHQOMPRDFNJ-FQEVSTJZSA-N 1 1 370.541 3.503 50 0 FHAAMO CC(=O)N1CCC([N@H+]2CCC[C@H](CCc3ccc(F)cc3F)C2)CC1 ZINC000012030846 570714466 /nfs/dbraw/zinc/71/44/66/570714466.db2.gz LMSOKYBLMSNHCO-MRXNPFEDSA-N 1 1 350.453 3.620 50 0 FHAAMO Cc1cc(C[N@H+]2CCC[C@@](CO)(Cc3ccc(F)cc3)C2)cc(C)c1O ZINC000012053896 570715629 /nfs/dbraw/zinc/71/56/29/570715629.db2.gz XTNAKOWNMVUYBC-JOCHJYFZSA-N 1 1 357.469 3.965 50 0 FHAAMO CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCC[N@@H+](Cc2cnn(C)c2)C1 ZINC000012072694 570716116 /nfs/dbraw/zinc/71/61/16/570716116.db2.gz SSVZEWGHZZFBLD-ICKBMGCOSA-N 1 1 367.493 3.669 50 0 FHAAMO COC(=O)c1ccc(NC(=O)N[C@H]2CCC[N@H+](C3CCCCCC3)C2)cc1 ZINC000012073944 570716413 /nfs/dbraw/zinc/71/64/13/570716413.db2.gz NNMBHXMHFLSFAM-SFHVURJKSA-N 1 1 373.497 3.782 50 0 FHAAMO COc1ccc(C[N@@H+]2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)cc1 ZINC000012111675 570718468 /nfs/dbraw/zinc/71/84/68/570718468.db2.gz KYTHIQYPXNCIKJ-UHFFFAOYSA-N 1 1 364.401 3.637 50 0 FHAAMO COc1ccc(C[N@H+]2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)cc1 ZINC000012111675 570718473 /nfs/dbraw/zinc/71/84/73/570718473.db2.gz KYTHIQYPXNCIKJ-UHFFFAOYSA-N 1 1 364.401 3.637 50 0 FHAAMO O[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000012241373 570730942 /nfs/dbraw/zinc/73/09/42/570730942.db2.gz JVQXXEVTTWHYDQ-HSZRJFAPSA-N 1 1 360.457 3.754 50 0 FHAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1)C(=O)c1ccco1 ZINC000012298267 570733264 /nfs/dbraw/zinc/73/32/64/570733264.db2.gz LDRCCMSWTJVBSB-QGZVFWFLSA-N 1 1 360.885 3.960 50 0 FHAAMO CN(C)c1ccc(C(=O)N[C@@H]2CCC[N@@H+](CCCc3ccccc3)C2)cc1 ZINC000012449260 570747175 /nfs/dbraw/zinc/74/71/75/570747175.db2.gz MGPLITYXIGQNCC-OAQYLSRUSA-N 1 1 365.521 3.580 50 0 FHAAMO Cc1oc(-c2ccc(F)cc2F)nc1C[N@H+](CCO)Cc1ccccc1 ZINC000012459520 570747525 /nfs/dbraw/zinc/74/75/25/570747525.db2.gz VEFIIBIJPBCWRV-UHFFFAOYSA-N 1 1 358.388 3.923 50 0 FHAAMO Cc1oc(-c2ccc(F)cc2F)nc1C[N@@H+](CCO)Cc1ccccc1 ZINC000012459520 570747528 /nfs/dbraw/zinc/74/75/28/570747528.db2.gz VEFIIBIJPBCWRV-UHFFFAOYSA-N 1 1 358.388 3.923 50 0 FHAAMO CSc1ncc(C[NH+]2CCC(CO)(CCCc3ccccc3)CC2)cn1 ZINC000012589163 570751828 /nfs/dbraw/zinc/75/18/28/570751828.db2.gz KGCOYGGTKSGQLG-UHFFFAOYSA-N 1 1 371.550 3.796 50 0 FHAAMO COc1cccc(C[C@@]2(CO)CCC[N@@H+](Cc3ccc(F)c(OC)c3)C2)c1 ZINC000012596581 570752853 /nfs/dbraw/zinc/75/28/53/570752853.db2.gz ASMYDWGUXRBNRG-QFIPXVFZSA-N 1 1 373.468 3.660 50 0 FHAAMO CC(=O)c1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000012701697 570756886 /nfs/dbraw/zinc/75/68/86/570756886.db2.gz CBOUHSBNVLIMDE-JOCHJYFZSA-N 1 1 364.489 3.668 50 0 FHAAMO CC(C)c1cc(C(=O)N(C)[C@H]2CCC[N@@H+](CCCc3ccccc3)C2)on1 ZINC000012748283 570759581 /nfs/dbraw/zinc/75/95/81/570759581.db2.gz VZLJDHMETBCSOO-IBGZPJMESA-N 1 1 369.509 3.967 50 0 FHAAMO Cc1cccn2c(=O)cc(C[N@H+]3CCc4sccc4[C@H]3C3CC3)nc12 ZINC000012787784 570761076 /nfs/dbraw/zinc/76/10/76/570761076.db2.gz GVCRPLUZBYXJSI-LJQANCHMSA-N 1 1 351.475 3.574 50 0 FHAAMO COc1ccc(CCC(=O)N2CCC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1 ZINC000012836155 570765167 /nfs/dbraw/zinc/76/51/67/570765167.db2.gz MWTIMUPQHSYUMP-NRFANRHFSA-N 1 1 366.505 3.751 50 0 FHAAMO CC(C)[C@@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1ccc2c(c1)OCCO2 ZINC000032759527 570793483 /nfs/dbraw/zinc/79/34/83/570793483.db2.gz APQHYYBPNPOUKE-HXUWFJFHSA-N 1 1 365.433 3.995 50 0 FHAAMO O=Cc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1Br ZINC000014628788 570821350 /nfs/dbraw/zinc/82/13/50/570821350.db2.gz GAUATSZMWJVZQX-UHFFFAOYSA-N 1 1 359.267 3.584 50 0 FHAAMO [NH3+][C@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)OCc1ccccc1 ZINC000005736958 570867943 /nfs/dbraw/zinc/86/79/43/570867943.db2.gz UCRXQUVKDMVBBM-JOCHJYFZSA-N 1 1 361.441 3.879 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000032931450 570872413 /nfs/dbraw/zinc/87/24/13/570872413.db2.gz HXDBRIUQSGBPSQ-HNNXBMFYSA-N 1 1 361.486 3.638 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(F)ccc1Br ZINC000046989775 570878021 /nfs/dbraw/zinc/87/80/21/570878021.db2.gz CFGZQYWWNQEZEE-ZDUSSCGKSA-N 1 1 371.294 3.973 50 0 FHAAMO O=C(CCCc1cccs1)N[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000012075967 570889040 /nfs/dbraw/zinc/88/90/40/570889040.db2.gz WNRZKTCUCLYUOJ-IBGZPJMESA-N 1 1 368.546 3.819 50 0 FHAAMO C[N@@H+]1CC[C@H](NC(=O)c2ccc(Cl)nc2)[C@H]1c1ccc(Cl)cc1 ZINC000107541938 570897136 /nfs/dbraw/zinc/89/71/36/570897136.db2.gz QKVLPWHMQZDMLW-GOEBONIOSA-N 1 1 350.249 3.564 50 0 FHAAMO C[N@H+]1CC[C@H](NC(=O)c2ccc(Cl)nc2)[C@H]1c1ccc(Cl)cc1 ZINC000107541938 570897139 /nfs/dbraw/zinc/89/71/39/570897139.db2.gz QKVLPWHMQZDMLW-GOEBONIOSA-N 1 1 350.249 3.564 50 0 FHAAMO C[C@@H](O)C1CC[NH+]([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 ZINC000111288136 570930871 /nfs/dbraw/zinc/93/08/71/570930871.db2.gz AOKHSQNQUVKHPL-FOIQADDNSA-N 1 1 356.441 3.598 50 0 FHAAMO C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)c3ccc(F)cc3F)cc2)C[C@H](C)O1 ZINC000048275203 570941692 /nfs/dbraw/zinc/94/16/92/570941692.db2.gz AOWCKKIEGUIEPC-GASCZTMLSA-N 1 1 374.431 3.504 50 0 FHAAMO C[C@@H](CCc1ccccc1)NC(=O)C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000025358729 570995019 /nfs/dbraw/zinc/99/50/19/570995019.db2.gz FMSDKKOEGFKTPK-SIKLNZKXSA-N 1 1 350.506 3.831 50 0 FHAAMO CCCOC(=O)c1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC000029484393 571040042 /nfs/dbraw/zinc/04/00/42/571040042.db2.gz AMDVXFUZDIJTNN-HXUWFJFHSA-N 1 1 366.461 3.811 50 0 FHAAMO CC(C)OC(=O)c1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC000029485785 571040862 /nfs/dbraw/zinc/04/08/62/571040862.db2.gz LZVCSOPGJCELQM-HXUWFJFHSA-N 1 1 366.461 3.810 50 0 FHAAMO COCc1c2ccccc2oc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000008343127 571041965 /nfs/dbraw/zinc/04/19/65/571041965.db2.gz ZIGMVPRVLUQYBK-KRWDZBQOSA-N 1 1 368.433 3.739 50 0 FHAAMO C[N@H+](Cc1ccc(Cl)cc1)Cc1cc(=O)n2c3c(sc2n1)CCCC3 ZINC000008393184 571044664 /nfs/dbraw/zinc/04/46/64/571044664.db2.gz ZFULIAAYDRKXMX-UHFFFAOYSA-N 1 1 373.909 3.920 50 0 FHAAMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(=O)n2c3c(sc2n1)CCCC3 ZINC000008393184 571044667 /nfs/dbraw/zinc/04/46/67/571044667.db2.gz ZFULIAAYDRKXMX-UHFFFAOYSA-N 1 1 373.909 3.920 50 0 FHAAMO O=C(OCCOCc1ccccc1)c1cnn(-c2cc[nH+]cc2)c1C(F)F ZINC000225620555 571050213 /nfs/dbraw/zinc/05/02/13/571050213.db2.gz FKTGDESRWQLYTR-UHFFFAOYSA-N 1 1 373.359 3.579 50 0 FHAAMO Cc1nc(C[NH+]2CCC(C(=O)Nc3ccc4c(c3)CCCO4)CC2)cs1 ZINC000171924561 571053701 /nfs/dbraw/zinc/05/37/01/571053701.db2.gz OTPXPLAHTUYOLG-UHFFFAOYSA-N 1 1 371.506 3.627 50 0 FHAAMO O=C(c1ccccc1O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000022956611 571055502 /nfs/dbraw/zinc/05/55/02/571055502.db2.gz HWZRHCIZSALPCW-UHFFFAOYSA-N 1 1 372.468 3.940 50 0 FHAAMO O=C(Cn1ccc2ccc(Cl)cc21)N1CC[NH+](Cc2ccccc2)CC1 ZINC000032501647 571058310 /nfs/dbraw/zinc/05/83/10/571058310.db2.gz NFTXADWCUQYYSA-UHFFFAOYSA-N 1 1 367.880 3.639 50 0 FHAAMO CC(=O)c1cccc(OCCOCC[N@H+]2CCCC[C@@H]2c2cccnc2)c1 ZINC000008764338 571060636 /nfs/dbraw/zinc/06/06/36/571060636.db2.gz KNOKMRKWVSKSJZ-JOCHJYFZSA-N 1 1 368.477 3.907 50 0 FHAAMO COc1cccc(OCCOCC[N@H+]2CCCC[C@@H]2c2cccnc2)c1 ZINC000008792456 571062092 /nfs/dbraw/zinc/06/20/92/571062092.db2.gz FQSIMOGMYYIYQY-OAQYLSRUSA-N 1 1 356.466 3.713 50 0 FHAAMO CN(C)C(=O)[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000039987536 571067344 /nfs/dbraw/zinc/06/73/44/571067344.db2.gz VISYMXFEPFLJQJ-QGZVFWFLSA-N 1 1 350.384 3.967 50 0 FHAAMO CN(C)C(=O)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000039987536 571067348 /nfs/dbraw/zinc/06/73/48/571067348.db2.gz VISYMXFEPFLJQJ-QGZVFWFLSA-N 1 1 350.384 3.967 50 0 FHAAMO COc1cc(CN2CC[N@H+]3CCC[C@@H]3[C@H]2C2CCCCC2)cc2c1OCO2 ZINC000247889077 571075000 /nfs/dbraw/zinc/07/50/00/571075000.db2.gz MAZLTZVQVGVUSI-WIYYLYMNSA-N 1 1 372.509 3.653 50 0 FHAAMO COc1ccc(CN2CC[N@H+]3CCC[C@@H]3[C@H]2C2CCCCC2)cc1OC ZINC000244817062 571075017 /nfs/dbraw/zinc/07/50/17/571075017.db2.gz STTKBBNUQHXQAG-DENIHFKCSA-N 1 1 358.526 3.933 50 0 FHAAMO COc1cc(CN2CC[N@H+]3CCC[C@H]3[C@@H]2C2CCCCC2)cc2c1OCO2 ZINC000247889074 571075026 /nfs/dbraw/zinc/07/50/26/571075026.db2.gz MAZLTZVQVGVUSI-RXVVDRJESA-N 1 1 372.509 3.653 50 0 FHAAMO CCn1cc(CN2CC[N@@H+](CCC(C)C)[C@H](CCO)C2)c2ccccc21 ZINC000036379394 571080235 /nfs/dbraw/zinc/08/02/35/571080235.db2.gz IBTADKFGONQBMP-HXUWFJFHSA-N 1 1 357.542 3.576 50 0 FHAAMO CCC[N@@H+](CC(=O)NC(=O)NCC)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000040151437 571086395 /nfs/dbraw/zinc/08/63/95/571086395.db2.gz KWAWJQZPNMVHEB-NSHDSACASA-N 1 1 360.285 3.612 50 0 FHAAMO C[C@@H]1CCC[C@@H](NC(=O)C[N@H+](C)CCOc2ccc(Cl)cc2)[C@@H]1C ZINC000012767360 571086514 /nfs/dbraw/zinc/08/65/14/571086514.db2.gz QKYBOZNEHLMKFW-IIDMSEBBSA-N 1 1 352.906 3.592 50 0 FHAAMO C[C@@H]1CCC[C@@H](NC(=O)C[N@@H+](C)CCOc2ccc(Cl)cc2)[C@@H]1C ZINC000012767360 571086516 /nfs/dbraw/zinc/08/65/16/571086516.db2.gz QKYBOZNEHLMKFW-IIDMSEBBSA-N 1 1 352.906 3.592 50 0 FHAAMO Cc1cc(C(=O)CCC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c(C)s1 ZINC000229629825 571094918 /nfs/dbraw/zinc/09/49/18/571094918.db2.gz JKMTWKBQYOIJFP-ZIAGYGMSSA-N 1 1 350.528 3.564 50 0 FHAAMO O=C(CC[N@H+]1CC[C@H](c2ccccc2)C1)Nc1ccnn1C1CCCC1 ZINC000069599796 571100289 /nfs/dbraw/zinc/10/02/89/571100289.db2.gz LUSZZECBRANNKG-SFHVURJKSA-N 1 1 352.482 3.816 50 0 FHAAMO COC(=O)C[C@@H]1CCC[N@@H+](Cc2ccccc2OCC(F)(F)F)CC1 ZINC000239722613 571108613 /nfs/dbraw/zinc/10/86/13/571108613.db2.gz CDTMVLZHPXXMBN-CQSZACIVSA-N 1 1 359.388 3.793 50 0 FHAAMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)C(=O)c1cc(C2CC2)on1 ZINC000242048071 571110594 /nfs/dbraw/zinc/11/05/94/571110594.db2.gz VSMADGCCOUIGJA-HNAYVOBHSA-N 1 1 353.466 3.535 50 0 FHAAMO Cc1ccc(C)c(NC(=O)CC[N@H+](C)CCc2nc3ccccc3[nH]2)c1 ZINC000244602006 571113723 /nfs/dbraw/zinc/11/37/23/571113723.db2.gz DVYPRSKUDQZOQQ-UHFFFAOYSA-N 1 1 350.466 3.683 50 0 FHAAMO COc1cccc(-c2ccc(NC(=O)N3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000244691598 571114170 /nfs/dbraw/zinc/11/41/70/571114170.db2.gz JFSYBPZVKTYMEP-LJQANCHMSA-N 1 1 351.450 3.674 50 0 FHAAMO Cc1cc(C(=O)Nc2ccc(NC(=O)[C@@H](C)C[N@H+](C)C(C)C)cc2)co1 ZINC000055054368 571115651 /nfs/dbraw/zinc/11/56/51/571115651.db2.gz SKGDNUSAMVGYHH-AWEZNQCLSA-N 1 1 357.454 3.755 50 0 FHAAMO O=C(c1cccc(C(F)(F)F)c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000055062734 571115711 /nfs/dbraw/zinc/11/57/11/571115711.db2.gz CXVFTKXPKYQTAG-UHFFFAOYSA-N 1 1 362.395 3.706 50 0 FHAAMO COc1ccccc1CNC(=O)CC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000244741895 571115826 /nfs/dbraw/zinc/11/58/26/571115826.db2.gz NYPBJLKOHXNDQM-FQEVSTJZSA-N 1 1 352.478 3.581 50 0 FHAAMO CCN(Cc1cccnc1)C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000055100489 571116647 /nfs/dbraw/zinc/11/66/47/571116647.db2.gz ZBPWXTYNSHDKAJ-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@@H+](Cc1cccnc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055100489 571116661 /nfs/dbraw/zinc/11/66/61/571116661.db2.gz ZBPWXTYNSHDKAJ-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@H+](Cc1cccnc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055100489 571116664 /nfs/dbraw/zinc/11/66/64/571116664.db2.gz ZBPWXTYNSHDKAJ-QFIPXVFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CCOc1ccccc1OCC[N@H+](C)Cc1coc2ccccc2c1=O ZINC000055153606 571116960 /nfs/dbraw/zinc/11/69/60/571116960.db2.gz BDSQJQGZWIGAIK-UHFFFAOYSA-N 1 1 353.418 3.703 50 0 FHAAMO CCOc1ccccc1OCC[N@@H+](C)Cc1coc2ccccc2c1=O ZINC000055153606 571116961 /nfs/dbraw/zinc/11/69/61/571116961.db2.gz 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Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+]1CC[C@@H](O)C1 ZINC000020653919 211292027 /nfs/dbraw/zinc/29/20/27/211292027.db2.gz ZKPJVAJUSUQIBB-QGZVFWFLSA-N 1 1 369.415 3.693 50 0 FHAAMO CCC[N@@H+]1CCc2c(sc3ncn4nc(-c5cccs5)nc4c23)C1 ZINC000020567279 211287420 /nfs/dbraw/zinc/28/74/20/211287420.db2.gz SJQLVLPBKWDTSI-UHFFFAOYSA-N 1 1 355.492 3.836 50 0 FHAAMO CCC[N@H+]1CCc2c(sc3ncn4nc(-c5cccs5)nc4c23)C1 ZINC000020567279 211287425 /nfs/dbraw/zinc/28/74/25/211287425.db2.gz SJQLVLPBKWDTSI-UHFFFAOYSA-N 1 1 355.492 3.836 50 0 FHAAMO O=C(CC12CC3CC(CC(C3)C1)C2)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020501019 211283689 /nfs/dbraw/zinc/28/36/89/211283689.db2.gz UKAYRRKRPIDEBV-UHFFFAOYSA-N 1 1 352.522 3.937 50 0 FHAAMO CC(C)CC[N@H+]1CCN(Cc2ccc(C(F)(F)F)cc2)C[C@@H]1CCO ZINC000019842199 211260053 /nfs/dbraw/zinc/26/00/53/211260053.db2.gz GBCWBDOTRGFMKJ-SFHVURJKSA-N 1 1 358.448 3.620 50 0 FHAAMO CC(C)(C)c1cc(C(=O)NCCC[NH+]2CCOCC2)cc(C(C)(C)C)c1 ZINC000019878110 211258608 /nfs/dbraw/zinc/25/86/08/211258608.db2.gz 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3.851 50 0 FHAAMO CSCCC[N@H+]1CCC[C@@H]1C(=O)Nc1ccc(-c2cscn2)cc1 ZINC000014958440 211105792 /nfs/dbraw/zinc/10/57/92/211105792.db2.gz YLQLASRYPXTAEU-QGZVFWFLSA-N 1 1 361.536 3.966 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Cc1csc(-c2cccs2)n1 ZINC000014247689 211088595 /nfs/dbraw/zinc/08/85/95/211088595.db2.gz XREWCMHUUFFIFV-AWEZNQCLSA-N 1 1 363.552 3.795 50 0 FHAAMO COc1ccc(OCC[N@@H+](C)Cc2cc(=O)oc3c(C)c(C)ccc23)cc1 ZINC000012992547 211016431 /nfs/dbraw/zinc/01/64/31/211016431.db2.gz LFFJUZFEHRBSRI-UHFFFAOYSA-N 1 1 367.445 3.929 50 0 FHAAMO CC(C)[N@@H+](CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C)Cc1ccccc1 ZINC000012909990 211005633 /nfs/dbraw/zinc/00/56/33/211005633.db2.gz NBVACZPBDCJARY-KRWDZBQOSA-N 1 1 365.477 3.661 50 0 FHAAMO Cc1cccc(NC(=O)C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1C ZINC000012906060 211004641 /nfs/dbraw/zinc/00/46/41/211004641.db2.gz WYKUSAGBXRUAQA-SFHVURJKSA-N 1 1 365.477 3.593 50 0 FHAAMO Cc1cccc(NC(=O)C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)c1C ZINC000012906060 211004644 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3.962 50 0 FHAAMO COc1ccc(-c2nc(C[N@@H+](CCO)Cc3ccccc3)c(C)o2)cc1C ZINC000011838710 210897741 /nfs/dbraw/zinc/89/77/41/210897741.db2.gz KQOSAIICRNDEPW-UHFFFAOYSA-N 1 1 366.461 3.962 50 0 FHAAMO COc1ccc(/C=C/C(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000003178953 210454319 /nfs/dbraw/zinc/45/43/19/210454319.db2.gz BDEKRAAFNLQIJJ-LHDXCKJESA-N 1 1 362.473 3.851 50 0 FHAAMO COc1c2c(cc3c1[C@@H](CC(=O)[C@H]1CC=C(C)CC1)[N@H+](C)CC3)OCO2 ZINC000020111877 220313219 /nfs/dbraw/zinc/31/32/19/220313219.db2.gz XPECFPNIEZESQR-GOEBONIOSA-N 1 1 357.450 3.659 50 0 FHAAMO COc1c2c(cc3c1[C@@H](CC(=O)[C@H]1CC=C(C)CC1)[N@@H+](C)CC3)OCO2 ZINC000020111877 220313223 /nfs/dbraw/zinc/31/32/23/220313223.db2.gz XPECFPNIEZESQR-GOEBONIOSA-N 1 1 357.450 3.659 50 0 FHAAMO C[C@@H]1C[N@@H+](C2CCN(Cc3ccccc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000001167337 210328484 /nfs/dbraw/zinc/32/84/84/210328484.db2.gz AOUKAAGBQSJMAJ-GASCZTMLSA-N 1 1 356.432 3.779 50 0 FHAAMO COc1ccc(Br)cc1C[NH2+]Cc1cccc(OC)c1OC ZINC000000851040 210281155 /nfs/dbraw/zinc/28/11/55/210281155.db2.gz DOBXQSGKFQPACA-UHFFFAOYSA-N 1 1 366.255 3.765 50 0 FHAAMO Clc1ccc(CNc2nc3ccccc3n2CC[NH+]2CCOCC2)cc1 ZINC000000809668 210274870 /nfs/dbraw/zinc/27/48/70/210274870.db2.gz PMAXIAMBXKWCPW-UHFFFAOYSA-N 1 1 370.884 3.634 50 0 FHAAMO CC[N@@H+]1CCc2nc(NC(=O)CSc3ccc(F)c(F)c3)sc2C1 ZINC000048325839 221007749 /nfs/dbraw/zinc/00/77/49/221007749.db2.gz WDVXPWKJGITKPH-UHFFFAOYSA-N 1 1 369.462 3.530 50 0 FHAAMO CC[N@H+]1CCc2nc(NC(=O)CSc3ccc(F)c(F)c3)sc2C1 ZINC000048325839 221007750 /nfs/dbraw/zinc/00/77/50/221007750.db2.gz WDVXPWKJGITKPH-UHFFFAOYSA-N 1 1 369.462 3.530 50 0 FHAAMO COc1cc([C@@H]2[NH2+]Cc3cc4c(cc3-n3cccc32)OCO4)ccc1F ZINC000055231417 221063172 /nfs/dbraw/zinc/06/31/72/221063172.db2.gz WZALNQKDAQULAI-FQEVSTJZSA-N 1 1 352.365 3.546 50 0 FHAAMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2nc(C(C)C)sc2n1 ZINC000064592890 221149080 /nfs/dbraw/zinc/14/90/80/221149080.db2.gz XWKDRJNAVXOXQE-UHFFFAOYSA-N 1 1 374.485 3.826 50 0 FHAAMO Cc1nc2ccc(Cl)cn2c1C[N@@H+](C)C[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000065373912 221205145 /nfs/dbraw/zinc/20/51/45/221205145.db2.gz WVFSWDKDGWAXPP-HNNXBMFYSA-N 1 1 374.916 3.519 50 0 FHAAMO COc1ccc(/C=C/C[NH+]2CCN(c3nc4cc(C)ccc4o3)CC2)cc1 ZINC000065406262 221215073 /nfs/dbraw/zinc/21/50/73/221215073.db2.gz PMRVDALXAOMSAS-ONEGZZNKSA-N 1 1 363.461 3.980 50 0 FHAAMO Cc1noc(-c2ccnc(-c3ccc([C@@H](C)[NH+]4CCOCC4)cc3)c2)n1 ZINC000065430844 221219291 /nfs/dbraw/zinc/21/92/91/221219291.db2.gz QMUDYBFYHPDNKV-CQSZACIVSA-N 1 1 350.422 3.500 50 0 FHAAMO Cc1cc(=O)oc2cc(C[N@H+]3CC[C@@H](c4ccc(F)cc4)[C@H](O)C3)ccc12 ZINC000065498531 221226718 /nfs/dbraw/zinc/22/67/18/221226718.db2.gz ZOYWSUXLGYIQCB-VQTJNVASSA-N 1 1 367.420 3.591 50 0 FHAAMO CCOC(=O)C[N@@H+]1CC[C@H](c2ccnc(-c3cnc4ccccc4c3)c2)C1 ZINC000065536047 221232330 /nfs/dbraw/zinc/23/23/30/221232330.db2.gz CPZVWTGXOIQZDX-SFHVURJKSA-N 1 1 361.445 3.649 50 0 FHAAMO CCOC(=O)C[N@H+]1CC[C@H](c2ccnc(-c3cnc4ccccc4c3)c2)C1 ZINC000065536047 221232333 /nfs/dbraw/zinc/23/23/33/221232333.db2.gz CPZVWTGXOIQZDX-SFHVURJKSA-N 1 1 361.445 3.649 50 0 FHAAMO C[N@@H+](Cc1cccc2cnccc21)C1CCN(C(=O)c2ccccc2)CC1 ZINC000067642632 221265578 /nfs/dbraw/zinc/26/55/78/221265578.db2.gz AFEHPRWCPISSQN-UHFFFAOYSA-N 1 1 359.473 3.971 50 0 FHAAMO CC[C@@H](O)C[N@@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067643463 221265668 /nfs/dbraw/zinc/26/56/68/221265668.db2.gz FFVAAJZLZHJHIT-OAHLLOKOSA-N 1 1 370.474 3.634 50 0 FHAAMO CC[C@@H](O)C[N@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067643463 221265669 /nfs/dbraw/zinc/26/56/69/221265669.db2.gz FFVAAJZLZHJHIT-OAHLLOKOSA-N 1 1 370.474 3.634 50 0 FHAAMO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1nc(-c2ccccc2)no1 ZINC000067502343 221257442 /nfs/dbraw/zinc/25/74/42/221257442.db2.gz CWIUJDIYVQEAEO-IBGZPJMESA-N 1 1 365.433 3.995 50 0 FHAAMO COc1ccc(-c2n[nH]cc2C[NH2+]Cc2nc3c(ccc(C)c3C)[nH]2)cc1 ZINC000067739993 221278824 /nfs/dbraw/zinc/27/88/24/221278824.db2.gz WYUNPXQHMVFGTK-UHFFFAOYSA-N 1 1 361.449 3.868 50 0 FHAAMO Cc1[nH+]ccn1[C@H](C)C(=O)N1CCC(c2n[nH]cc2-c2ccccc2)CC1 ZINC000067754396 221280384 /nfs/dbraw/zinc/28/03/84/221280384.db2.gz YGMXYNIVXCCQQZ-OAHLLOKOSA-N 1 1 363.465 3.549 50 0 FHAAMO CC(C)c1cc(C2CCN(C(=O)[C@H](C)n3cc[nH+]c3C(C)C)CC2)[nH]n1 ZINC000067758215 221281544 /nfs/dbraw/zinc/28/15/44/221281544.db2.gz ZKKPPANFANPSQJ-HNNXBMFYSA-N 1 1 357.502 3.820 50 0 FHAAMO OCC1(CCOc2ccccc2)CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000067894561 221302964 /nfs/dbraw/zinc/30/29/64/221302964.db2.gz XBDWVTDNBMGUBL-UHFFFAOYSA-N 1 1 365.477 3.607 50 0 FHAAMO Cc1cccc2nc([C@H]3CCCN3C(=O)C3CC[NH+](C(C)C)CC3)[nH]c21 ZINC000067920121 221304982 /nfs/dbraw/zinc/30/49/82/221304982.db2.gz RSNKOVVAGXNVAO-GOSISDBHSA-N 1 1 354.498 3.655 50 0 FHAAMO COc1ccc2cc([C@@H]3C[N@H+](CCCn4cccn4)CCO3)ccc2c1 ZINC000071422361 221347472 /nfs/dbraw/zinc/34/74/72/221347472.db2.gz WBTVEPVXXKJDQM-NRFANRHFSA-N 1 1 351.450 3.509 50 0 FHAAMO COc1ccc2cc([C@@H]3C[N@@H+](CCCn4cccn4)CCO3)ccc2c1 ZINC000071422361 221347474 /nfs/dbraw/zinc/34/74/74/221347474.db2.gz WBTVEPVXXKJDQM-NRFANRHFSA-N 1 1 351.450 3.509 50 0 FHAAMO Cc1ccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)o1 ZINC000071745897 221358405 /nfs/dbraw/zinc/35/84/05/221358405.db2.gz MEMJNFWQAWREJL-FQEVSTJZSA-N 1 1 358.457 3.986 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2ccncc2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071749201 221360510 /nfs/dbraw/zinc/36/05/10/221360510.db2.gz PJAPFDSMAOMHOC-HXUWFJFHSA-N 1 1 355.457 3.593 50 0 FHAAMO Cc1oc(-c2ccc3ccccc3c2)nc1C[NH+]1CCC(CC(N)=O)CC1 ZINC000071661776 221353946 /nfs/dbraw/zinc/35/39/46/221353946.db2.gz FNBYEABHOAZVCU-UHFFFAOYSA-N 1 1 363.461 3.891 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](CCCc3cccnc3)C2)c(C)c1 ZINC000071764816 221371809 /nfs/dbraw/zinc/37/18/09/221371809.db2.gz UFOIBIUAZARKIC-LJQANCHMSA-N 1 1 352.478 3.926 50 0 FHAAMO Cc1cccc(CN2CCC[C@H]2[C@@H]2CCC[N@@H+]2Cc2cccc(C)n2)n1 ZINC000071772089 221373393 /nfs/dbraw/zinc/37/33/93/221373393.db2.gz SXBLLUAXFAKRPB-VXKWHMMOSA-N 1 1 350.510 3.722 50 0 FHAAMO C[C@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1cccc2ccccc21 ZINC000095395907 132210805 /nfs/dbraw/zinc/21/08/05/132210805.db2.gz UHAOBPHBNQBUIP-SFHVURJKSA-N 1 1 360.505 3.837 50 0 FHAAMO Cc1cccc(N2CCC([N@H+]3CCc4nc(-c5cccnc5)[nH]c4C3)CC2)c1 ZINC000216487830 132271685 /nfs/dbraw/zinc/27/16/85/132271685.db2.gz QYMFNONCQXPKDC-UHFFFAOYSA-N 1 1 373.504 3.807 50 0 FHAAMO Clc1cccc(N2CC[NH+](Cc3cnn(-c4ccccc4)c3)CC2)c1 ZINC000057423173 136129363 /nfs/dbraw/zinc/12/93/63/136129363.db2.gz VRFZDASNWWPZJI-UHFFFAOYSA-N 1 1 352.869 3.848 50 0 FHAAMO Nc1cc(N2CCC[C@@H](C(=O)c3ccc(Oc4ccccc4)cc3)C2)nc[nH+]1 ZINC000071662813 136139704 /nfs/dbraw/zinc/13/97/04/136139704.db2.gz LXKNVMFZFJDMCU-QGZVFWFLSA-N 1 1 374.444 3.950 50 0 FHAAMO Oc1cccc(C[N@H+]2CCCC23CCN(c2cnc4ccccc4n2)CC3)c1 ZINC000072438401 136147558 /nfs/dbraw/zinc/14/75/58/136147558.db2.gz FWUCJOYHGKDNOS-UHFFFAOYSA-N 1 1 374.488 3.970 50 0 FHAAMO Cc1ccc(NC(=O)N2CC[N@H+](CC(C)C)[C@H](CCO)C2)cc1C(C)C ZINC000096167195 222065993 /nfs/dbraw/zinc/06/59/93/222065993.db2.gz DOLWBWVHLMPNGN-LJQANCHMSA-N 1 1 361.530 3.675 50 0 FHAAMO Cc1cc2[nH]c(C(=O)Nc3ccc(F)cc3)c(C[NH+]3CCOCC3)c2s1 ZINC000096363836 222117632 /nfs/dbraw/zinc/11/76/32/222117632.db2.gz NOCNYBUYZJFXHX-UHFFFAOYSA-N 1 1 373.453 3.761 50 0 FHAAMO OCC[C@H]1CN(Cc2ccc(Cl)cc2)CC[N@@H+]1Cc1ccccc1F ZINC000096806823 222130791 /nfs/dbraw/zinc/13/07/91/222130791.db2.gz TZFQHNQFUJEHQQ-IBGZPJMESA-N 1 1 362.876 3.548 50 0 FHAAMO OCC[C@H]1CN(Cc2ccc(Cl)cc2)CC[N@H+]1Cc1ccccc1F ZINC000096806823 222130794 /nfs/dbraw/zinc/13/07/94/222130794.db2.gz TZFQHNQFUJEHQQ-IBGZPJMESA-N 1 1 362.876 3.548 50 0 FHAAMO CS(=O)(=O)C[C@@H]1CCC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000097532320 222189773 /nfs/dbraw/zinc/18/97/73/222189773.db2.gz QMFDJJWAZIOBFK-GOSISDBHSA-N 1 1 357.519 3.575 50 0 FHAAMO O=C(c1cnoc1-c1ccccc1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000097213159 222168422 /nfs/dbraw/zinc/16/84/22/222168422.db2.gz PWCYGUAHAWXTCP-UHFFFAOYSA-N 1 1 367.474 3.751 50 0 FHAAMO Cc1cc(C)n([C@H]2CCN(Cc3cc(C[NH+]4CCCCC4)cs3)C2)n1 ZINC000097413190 222178696 /nfs/dbraw/zinc/17/86/96/222178696.db2.gz DARWHFAKCHSWJB-IBGZPJMESA-N 1 1 358.555 3.994 50 0 FHAAMO O=C(NCc1ccccc1C(F)(F)F)[C@H](c1cccnc1)[NH+]1CCCC1 ZINC000097437008 222180355 /nfs/dbraw/zinc/18/03/55/222180355.db2.gz BJCMWFZGYOXYQE-KRWDZBQOSA-N 1 1 363.383 3.554 50 0 FHAAMO Cc1ccc(NC(=O)CC(C)C)cc1NC(=O)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000097468290 222183309 /nfs/dbraw/zinc/18/33/09/222183309.db2.gz BGDHXPNAEPQZAP-SFHVURJKSA-N 1 1 372.513 3.682 50 0 FHAAMO Cc1ccccc1C[N@H+]1CC[C@@H](CNc2nccc(-c3ccccn3)n2)C1 ZINC000097797486 222214251 /nfs/dbraw/zinc/21/42/51/222214251.db2.gz DWJGUKBHJGRGER-SFHVURJKSA-N 1 1 359.477 3.781 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)cc1 ZINC000102930287 222313914 /nfs/dbraw/zinc/31/39/14/222313914.db2.gz UGUQPXYOAXEZGN-NRFANRHFSA-N 1 1 374.440 3.612 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)cc1 ZINC000102930287 222313920 /nfs/dbraw/zinc/31/39/20/222313920.db2.gz UGUQPXYOAXEZGN-NRFANRHFSA-N 1 1 374.440 3.612 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000105633542 222372082 /nfs/dbraw/zinc/37/20/82/222372082.db2.gz GMJLZJAHZJNDSD-JQHSSLGASA-N 1 1 360.498 3.536 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000105633542 222372086 /nfs/dbraw/zinc/37/20/86/222372086.db2.gz GMJLZJAHZJNDSD-JQHSSLGASA-N 1 1 360.498 3.536 50 0 FHAAMO Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000106088367 222382216 /nfs/dbraw/zinc/38/22/16/222382216.db2.gz NVXGPWPUHQINDK-GDBMZVCRSA-N 1 1 372.513 3.585 50 0 FHAAMO Cc1oc(-c2cccc(C(F)(F)F)c2)nc1CN1CC[N@@H+](C)[C@@H](C)C1 ZINC000106718798 222387567 /nfs/dbraw/zinc/38/75/67/222387567.db2.gz OIKUOARTEJPPCB-LBPRGKRZSA-N 1 1 353.388 3.805 50 0 FHAAMO CCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC[N@@H+](C)C3 ZINC000020813936 263382491 /nfs/dbraw/zinc/38/24/91/263382491.db2.gz DZQOTGMXXXKFFN-UHFFFAOYSA-N 1 1 371.531 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COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccccc2)c(OC)c1 ZINC000012820404 571121901 /nfs/dbraw/zinc/12/19/01/571121901.db2.gz IRCYEUUQDDSTFZ-IBGZPJMESA-N 1 1 354.450 3.504 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N(C)c2ccccc2)c(OC)c1 ZINC000012820404 571121902 /nfs/dbraw/zinc/12/19/02/571121902.db2.gz IRCYEUUQDDSTFZ-IBGZPJMESA-N 1 1 354.450 3.504 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H]1C1CCCCC1)NCc1ccc(OC(F)F)cc1 ZINC000071811017 571126110 /nfs/dbraw/zinc/12/61/10/571126110.db2.gz HJJCNFQVUNPCRM-SFHVURJKSA-N 1 1 366.452 3.949 50 0 FHAAMO C[C@@H](c1ccc(F)cc1F)[NH+]1CCC(C(=O)Nc2nccs2)CC1 ZINC000058162283 571126363 /nfs/dbraw/zinc/12/63/63/571126363.db2.gz BFLAQFBOOSPXTR-NSHDSACASA-N 1 1 351.422 3.833 50 0 FHAAMO CC(C)N(C)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1 ZINC000248033641 571127539 /nfs/dbraw/zinc/12/75/39/571127539.db2.gz UIQRXDCAUSOKAQ-QGZVFWFLSA-N 1 1 356.514 3.696 50 0 FHAAMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cc(-c2cnn(C)c2C)no1 ZINC000184486899 571128123 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367.518 3.965 50 0 FHAAMO CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(N2CCCCCC2)nc1 ZINC000067540928 571146935 /nfs/dbraw/zinc/14/69/35/571146935.db2.gz QJVZPSBUPISTLB-UHFFFAOYSA-N 1 1 369.513 3.602 50 0 FHAAMO CC(C)(C)n1cc(C[N@@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)nn1 ZINC000373812230 571150096 /nfs/dbraw/zinc/15/00/96/571150096.db2.gz KWJBTCADXDKCEJ-CYBMUJFWSA-N 1 1 357.433 3.693 50 0 FHAAMO CC(C)(C)n1cc(C[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)nn1 ZINC000373812230 571150099 /nfs/dbraw/zinc/15/00/99/571150099.db2.gz KWJBTCADXDKCEJ-CYBMUJFWSA-N 1 1 357.433 3.693 50 0 FHAAMO Cc1cc2[nH+]c(NCCCO)n(CC(=O)c3ccc(Cl)cc3)c2cc1C ZINC000075278466 571159167 /nfs/dbraw/zinc/15/91/67/571159167.db2.gz YZFLPTJXFBRFJD-UHFFFAOYSA-N 1 1 371.868 3.984 50 0 FHAAMO C[N@@H+](CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)C1CCCC1 ZINC000053436572 571160323 /nfs/dbraw/zinc/16/03/23/571160323.db2.gz WRFGSSBDWZSGOQ-INIZCTEOSA-N 1 1 357.479 3.893 50 0 FHAAMO Cc1cccc(Cl)c1NC(=O)N1CCCC[C@H]1CC[NH+]1CCOCC1 ZINC000072126313 571170388 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3.902 50 0 FHAAMO Cc1ccc(F)c(CN2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CC[NH+]3CC2)c1 ZINC000072147180 571173591 /nfs/dbraw/zinc/17/35/91/571173591.db2.gz VTGSSFORRDVDHD-MDNUFGMLSA-N 1 1 366.480 3.902 50 0 FHAAMO c1c(C[N@@H+]2CCCC[C@H]2CCN2CCOCC2)onc1C1CCCCC1 ZINC000072147751 571173686 /nfs/dbraw/zinc/17/36/86/571173686.db2.gz REKKAECUARAAPH-IBGZPJMESA-N 1 1 361.530 3.799 50 0 FHAAMO Cc1c[nH]c(C[N@H+]2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@@H]32)c(C)c1=O ZINC000072153062 571174644 /nfs/dbraw/zinc/17/46/44/571174644.db2.gz NXKAFBXFDWYKFN-IEIRFRATSA-N 1 1 366.505 3.644 50 0 FHAAMO C[NH+]1CCC(N(Cc2cnc(CC3CCCC3)[nH]2)Cc2cccnc2)CC1 ZINC000072154153 571174794 /nfs/dbraw/zinc/17/47/94/571174794.db2.gz XZGVXNKRWMFYAP-UHFFFAOYSA-N 1 1 367.541 3.634 50 0 FHAAMO Fc1cc(C(F)(F)F)ccc1C[N@H+]1CCCC[C@@H]1CCN1CCOCC1 ZINC000072154665 571175170 /nfs/dbraw/zinc/17/51/70/571175170.db2.gz XNHFWTRSOLLIDQ-QGZVFWFLSA-N 1 1 374.422 3.921 50 0 FHAAMO CN(C)C(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccnc3)cc2)C1 ZINC000072158272 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Cc1ccc(OCC[N@H+]2CCCn3nc([C@H](O)C4CCC4)cc3C2)cc1C ZINC000230568730 571309510 /nfs/dbraw/zinc/30/95/10/571309510.db2.gz LJMOYGKUWLQMBP-JOCHJYFZSA-N 1 1 369.509 3.618 50 0 FHAAMO CC[N@H+]1CCCN(C(=O)c2ccc(-c3ccc(O)c(C)c3C)cc2)CC1 ZINC000584898933 571315922 /nfs/dbraw/zinc/31/59/22/571315922.db2.gz SXJMKKPEKBIOGI-UHFFFAOYSA-N 1 1 352.478 3.844 50 0 FHAAMO O=C(Cn1ccc2c1cccc2Cl)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000079190306 571327210 /nfs/dbraw/zinc/32/72/10/571327210.db2.gz JOQAECZPCJTBBX-MAUKXSAKSA-N 1 1 359.901 3.675 50 0 FHAAMO CCOCc1ccc(NC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000467950088 571327922 /nfs/dbraw/zinc/32/79/22/571327922.db2.gz UMUVAKRVKRWAFK-HXUWFJFHSA-N 1 1 367.493 3.867 50 0 FHAAMO O[C@@H](C[NH+]1CCN(c2ccccc2F)CC1)c1ccc(C(F)(F)F)cc1 ZINC000020218804 571328623 /nfs/dbraw/zinc/32/86/23/571328623.db2.gz ATWBCLBKGGRUAZ-SFHVURJKSA-N 1 1 368.374 3.700 50 0 FHAAMO COc1cccc(OC)c1CN[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000095435783 571329589 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50 0 FHAAMO C[C@H]1CCC[N@@H+](CCCNC(=O)N[C@@H]2CCOc3c(Cl)cccc32)C1 ZINC000056805549 571341751 /nfs/dbraw/zinc/34/17/51/571341751.db2.gz OOFAAMJQGUBCBW-WMLDXEAASA-N 1 1 365.905 3.585 50 0 FHAAMO Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)no1 ZINC000057154925 571342409 /nfs/dbraw/zinc/34/24/09/571342409.db2.gz MLWJYMKFAJQRJS-AZUAARDMSA-N 1 1 353.466 3.559 50 0 FHAAMO O=C(Nc1ccccc1)[C@@H]([NH2+]C[C@@H]1COc2ccccc2O1)c1ccccc1 ZINC000057352274 571342625 /nfs/dbraw/zinc/34/26/25/571342625.db2.gz SDPRPTRHGZCLGG-KNQAVFIVSA-N 1 1 374.440 3.796 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1C(=O)NC1CC1)c1ccccc1Cl ZINC000057456356 571343508 /nfs/dbraw/zinc/34/35/08/571343508.db2.gz WAMSXFMAAJBNQR-CYBMUJFWSA-N 1 1 371.868 3.522 50 0 FHAAMO O=C(NC1CC1)[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1 ZINC000057593671 571344675 /nfs/dbraw/zinc/34/46/75/571344675.db2.gz SAFQDPGNDQAOOV-KRWDZBQOSA-N 1 1 366.358 3.954 50 0 FHAAMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)c(Cl)c1 ZINC000057775728 571345353 /nfs/dbraw/zinc/34/53/53/571345353.db2.gz SYONUYOOOHKCMZ-LJQANCHMSA-N 1 1 357.885 3.576 50 0 FHAAMO CCOc1ccc2oc(C(=O)NC[C@H](c3ccco3)[NH+](C)C)c(C)c2c1 ZINC000003339481 571347727 /nfs/dbraw/zinc/34/77/27/571347727.db2.gz NJCFXGYNUBRVHF-MRXNPFEDSA-N 1 1 356.422 3.766 50 0 FHAAMO COc1cccc(CN(CC(C)C)C(=O)NC[C@H]2CCC[N@H+]2C(C)C)c1 ZINC000670441184 571348586 /nfs/dbraw/zinc/34/85/86/571348586.db2.gz ILEUAZJPRSKSIO-LJQANCHMSA-N 1 1 361.530 3.736 50 0 FHAAMO CC(=O)Nc1ccc2nc(C[N@@H+](CC3CCC3)C[C@H]3CCCO3)ccc2c1 ZINC000670445413 571350178 /nfs/dbraw/zinc/35/01/78/571350178.db2.gz AWMFXEBGLBJGTM-OAQYLSRUSA-N 1 1 367.493 3.974 50 0 FHAAMO O=C(NCC[N@@H+]1CCc2ccccc2C1)c1cc(Cl)sc1Cl ZINC000031338435 571352148 /nfs/dbraw/zinc/35/21/48/571352148.db2.gz FTVRDKHJRKJZDG-UHFFFAOYSA-N 1 1 355.290 3.843 50 0 FHAAMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1cc(Cl)sc1Cl ZINC000031338435 571352149 /nfs/dbraw/zinc/35/21/49/571352149.db2.gz FTVRDKHJRKJZDG-UHFFFAOYSA-N 1 1 355.290 3.843 50 0 FHAAMO C[NH+](C)Cc1nc2ccccc2c(SCC(=O)Nc2ccc(F)cc2)n1 ZINC000031619172 571352925 /nfs/dbraw/zinc/35/29/25/571352925.db2.gz UBHARESZEDXPPD-UHFFFAOYSA-N 1 1 370.453 3.561 50 0 FHAAMO CCCCCc1ccc(C(=O)OC[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(=O)o1 ZINC000004028787 571354256 /nfs/dbraw/zinc/35/42/56/571354256.db2.gz IBTXHLUOGHLSCI-QFBILLFUSA-N 1 1 361.482 3.794 50 0 biogenic FHAAMO CCOC(=O)c1c(NC(=O)c2ccco2)sc2c1CC[N@@H+](C(C)C)C2 ZINC000004086907 571355001 /nfs/dbraw/zinc/35/50/01/571355001.db2.gz QETVTDAFOLFFSP-UHFFFAOYSA-N 1 1 362.451 3.537 50 0 FHAAMO CCOC(=O)c1c(NC(=O)c2ccco2)sc2c1CC[N@H+](C(C)C)C2 ZINC000004086907 571355002 /nfs/dbraw/zinc/35/50/02/571355002.db2.gz QETVTDAFOLFFSP-UHFFFAOYSA-N 1 1 362.451 3.537 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(COc2ccccc2)cc1)c1ccco1 ZINC000008073449 571358800 /nfs/dbraw/zinc/35/88/00/571358800.db2.gz BALZYVQIJNUVFD-HXUWFJFHSA-N 1 1 364.445 3.891 50 0 FHAAMO CC[N@H+](Cc1ccc(Cl)s1)Cc1cc(=O)n2c(C)csc2n1 ZINC000008132461 571359368 /nfs/dbraw/zinc/35/93/68/571359368.db2.gz RZAQLINOAGZTKR-UHFFFAOYSA-N 1 1 353.900 3.801 50 0 FHAAMO CC[N@@H+](Cc1ccc(Cl)s1)Cc1cc(=O)n2c(C)csc2n1 ZINC000008132461 571359369 /nfs/dbraw/zinc/35/93/69/571359369.db2.gz RZAQLINOAGZTKR-UHFFFAOYSA-N 1 1 353.900 3.801 50 0 FHAAMO Cc1cc(C[N@@H+]2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)[nH]n1 ZINC000023130483 936349883 /nfs/dbraw/zinc/34/98/83/936349883.db2.gz CKFOUZZFPHLPIK-CQSZACIVSA-N 1 1 351.372 3.832 50 0 FHAAMO Cc1cc(C[N@H+]2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)[nH]n1 ZINC000023130483 936349888 /nfs/dbraw/zinc/34/98/88/936349888.db2.gz CKFOUZZFPHLPIK-CQSZACIVSA-N 1 1 351.372 3.832 50 0 FHAAMO Cc1cccc(N2CCC(NC(=O)c3ccc4ccccc4c3O)CC2)[nH+]1 ZINC000116668847 928852878 /nfs/dbraw/zinc/85/28/78/928852878.db2.gz DLVHNXUCSBBYMT-UHFFFAOYSA-N 1 1 361.445 3.648 50 0 FHAAMO CC[N@@H+](Cc1nc(-c2ccc(F)c(F)c2)no1)[C@H]1CCOC(C)(C)C1 ZINC000289693778 930820168 /nfs/dbraw/zinc/82/01/68/930820168.db2.gz HANJRVWWSMQBLN-ZDUSSCGKSA-N 1 1 351.397 3.794 50 0 FHAAMO COc1ccc(CC[N@@H+](C)[C@@H]2CCCN(Cc3ccsc3)C2)cc1OC ZINC000022913289 935448542 /nfs/dbraw/zinc/44/85/42/935448542.db2.gz KBMCMHIKTBONTO-LJQANCHMSA-N 1 1 374.550 3.904 50 0 FHAAMO CCC[N@@H+](CC(=O)NCc1cccs1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000076019812 938996199 /nfs/dbraw/zinc/99/61/99/938996199.db2.gz ZKWOVTREISEHSD-MSOLQXFVSA-N 1 1 364.555 3.814 50 0 FHAAMO CCC[N@@H+](CC(=O)NCc1cccs1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000076019815 938996221 /nfs/dbraw/zinc/99/62/21/938996221.db2.gz ZKWOVTREISEHSD-ROUUACIJSA-N 1 1 364.555 3.814 50 0 FHAAMO c1cc(CN2CCC([N@@H+]3C[C@H](OCC4CC4)C34CCCCC4)CC2)ccn1 ZINC000581802440 940610714 /nfs/dbraw/zinc/61/07/14/940610714.db2.gz KGZYQVWMPRUGNF-QFIPXVFZSA-N 1 1 369.553 3.860 50 0 FHAAMO COC[C@](C)([NH2+]CC(=O)Nc1nc2ccc(F)cc2s1)c1ccccc1 ZINC000181129830 941110261 /nfs/dbraw/zinc/11/02/61/941110261.db2.gz MNWMKTFGHORSNB-IBGZPJMESA-N 1 1 373.453 3.525 50 0 FHAAMO Cc1[nH]nc(C(=O)N2CC[NH+](C3c4ccccc4-c4ccccc43)CC2)c1C ZINC000328637247 941934432 /nfs/dbraw/zinc/93/44/32/941934432.db2.gz ASNSEXOJSSATMV-UHFFFAOYSA-N 1 1 372.472 3.554 50 0 FHAAMO Cc1c[nH+]c(CC[C@@H]2CCCN2C(=O)Cc2ccccc2F)n1CC1CC1 ZINC000257194946 942689731 /nfs/dbraw/zinc/68/97/31/942689731.db2.gz VATYZVCDDRJQIR-IBGZPJMESA-N 1 1 369.484 3.907 50 0 FHAAMO CN1CC2(C[C@@H]1C(=O)Nc1ccccc1)CC[NH+](Cc1ccsc1)CC2 ZINC000675010578 943606274 /nfs/dbraw/zinc/60/62/74/943606274.db2.gz KKEZEUPXYDHDTK-LJQANCHMSA-N 1 1 369.534 3.673 50 0 FHAAMO Cc1nnc([C@@H]2CC[N@@H+](Cc3ccccc3)CCN2Cc2ccccc2)[nH]1 ZINC000675013316 943614209 /nfs/dbraw/zinc/61/42/09/943614209.db2.gz JHBUUKDMGFOEBW-NRFANRHFSA-N 1 1 361.493 3.562 50 0 FHAAMO Cc1nc([C@@H]2CC[N@H+](Cc3ccccc3)CCN2Cc2ccccc2)n[nH]1 ZINC000675013316 943614213 /nfs/dbraw/zinc/61/42/13/943614213.db2.gz JHBUUKDMGFOEBW-NRFANRHFSA-N 1 1 361.493 3.562 50 0 FHAAMO Cc1nc([C@@H]2CC[N@@H+](Cc3ccccc3)CCN2Cc2ccccc2)n[nH]1 ZINC000675013316 943614217 /nfs/dbraw/zinc/61/42/17/943614217.db2.gz JHBUUKDMGFOEBW-NRFANRHFSA-N 1 1 361.493 3.562 50 0 FHAAMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)Nc2cnn([C@H](C)CC)c2C)C1 ZINC000331743812 944557654 /nfs/dbraw/zinc/55/76/54/944557654.db2.gz HBKNWCCQJISNRJ-ZBFHGGJFSA-N 1 1 358.490 3.790 50 0 FHAAMO CNC(=O)c1ccc(C[N@@H+]2CC=C(c3c[nH]c4cc(F)ccc43)CC2)cc1 ZINC000066871885 945889909 /nfs/dbraw/zinc/88/99/09/945889909.db2.gz HSHTTZMDMWZJMQ-UHFFFAOYSA-N 1 1 363.436 3.956 50 0 FHAAMO Cc1nc2ccccc2nc1CN1CCC[N@H+](C2Cc3ccccc3C2)CC1 ZINC000215643197 222651872 /nfs/dbraw/zinc/65/18/72/222651872.db2.gz LDTMAODFTUIWQM-UHFFFAOYSA-N 1 1 372.516 3.613 50 0 FHAAMO CCc1nccn1Cc1nc([C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)no1 ZINC000299796015 210035459 /nfs/dbraw/zinc/03/54/59/210035459.db2.gz LNZRHWNRAWSBNN-KSZLIROESA-N 1 1 363.465 3.570 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@H+]2CCC[C@H](c3noc(C)n3)C2)s1 ZINC000299782635 210027137 /nfs/dbraw/zinc/02/71/37/210027137.db2.gz FVEHJIYFNVAJSL-AWEZNQCLSA-N 1 1 370.478 3.890 50 0 FHAAMO O=C(NCCc1ccccc1F)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299784531 210026921 /nfs/dbraw/zinc/02/69/21/210026921.db2.gz XJQVWLSLXHXSSZ-TYPHKJRUSA-N 1 1 352.453 3.710 50 0 FHAAMO C[C@H]1C[N@@H+](C2CCN(CCc3ccccc3)CC2)Cc2ccccc2O1 ZINC000299784796 210026292 /nfs/dbraw/zinc/02/62/92/210026292.db2.gz UUXLRHOTCARBJH-IBGZPJMESA-N 1 1 350.506 3.977 50 0 FHAAMO C[C@H]1C[N@H+](C2CCN(CCc3ccccc3)CC2)Cc2ccccc2O1 ZINC000299784796 210026297 /nfs/dbraw/zinc/02/62/97/210026297.db2.gz UUXLRHOTCARBJH-IBGZPJMESA-N 1 1 350.506 3.977 50 0 FHAAMO COc1ccc(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCCC2)cn1 ZINC000299777577 210023648 /nfs/dbraw/zinc/02/36/48/210023648.db2.gz OEEZTTKDWVUZMT-SFHVURJKSA-N 1 1 373.884 3.701 50 0 FHAAMO CCc1oc2c(cccc2NC(=O)N2CCC([NH+]3CCOCC3)CC2)c1C ZINC000299779443 210022704 /nfs/dbraw/zinc/02/27/04/210022704.db2.gz UEQRWRYRQHRPJB-UHFFFAOYSA-N 1 1 371.481 3.632 50 0 FHAAMO CCOCC1(CNC(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)CCC1 ZINC000299768060 210017735 /nfs/dbraw/zinc/01/77/35/210017735.db2.gz HPBQSGNLWNCFOF-ZCNNSNEGSA-N 1 1 356.510 3.535 50 0 FHAAMO CCCC[C@H]1C[N@@H+](CCC(=O)NCc2ccncc2)Cc2ccccc2O1 ZINC000299768563 210017462 /nfs/dbraw/zinc/01/74/62/210017462.db2.gz OJSWTMBMWOFPPZ-FQEVSTJZSA-N 1 1 367.493 3.541 50 0 FHAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@H](c3n[nH]cc3CC(C)C)C2)cc1 ZINC000299766565 210015345 /nfs/dbraw/zinc/01/53/45/210015345.db2.gz FHUOTPYWOMIFKY-SFHVURJKSA-N 1 1 355.482 3.774 50 0 FHAAMO CSCc1ccc(C(=O)NCC[N@H+]2CC[C@@H](c3ccccc3C)C2)o1 ZINC000299764035 210013221 /nfs/dbraw/zinc/01/32/21/210013221.db2.gz QVZSKROXGFHRDK-MRXNPFEDSA-N 1 1 358.507 3.670 50 0 FHAAMO CC(=O)Nc1ccc(NC(=O)C2=CC[N@@H+](Cc3cccc(C)c3)CC2)cc1 ZINC000064818019 212045014 /nfs/dbraw/zinc/04/50/14/212045014.db2.gz SEECRMGFNROSKC-UHFFFAOYSA-N 1 1 363.461 3.724 50 0 FHAAMO Cc1cccn2c(=O)cc(C[N@H+](Cc3ccc(F)cc3)CC(C)C)nc12 ZINC000064590796 212040089 /nfs/dbraw/zinc/04/00/89/212040089.db2.gz DHWDKOCEOVQZPM-UHFFFAOYSA-N 1 1 353.441 3.800 50 0 FHAAMO O=C(Cc1cccc2cccnc21)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000062228466 212030610 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/nfs/dbraw/zinc/50/70/72/526507072.db2.gz MYYVIIUMLHGUDC-RBUKOAKNSA-N 1 1 371.550 3.980 50 0 FHAAMO Cc1noc(C)c1C[N@H+]1C[C@@H]2CC[C@H](C1)N(CCSc1ccccc1)C2 ZINC000091663383 526507076 /nfs/dbraw/zinc/50/70/76/526507076.db2.gz MYYVIIUMLHGUDC-RBUKOAKNSA-N 1 1 371.550 3.980 50 0 FHAAMO O=C(N[C@@H]1CCCC[C@H]1C(F)(F)F)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000240894787 526889007 /nfs/dbraw/zinc/88/90/07/526889007.db2.gz IPVKQAFLSHPNNC-GVDBMIGSSA-N 1 1 369.431 3.531 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCC[C@H](COc2ccccc2C)C1 ZINC000082098057 527391719 /nfs/dbraw/zinc/39/17/19/527391719.db2.gz MDHGCXMVHJKTJL-IBGZPJMESA-N 1 1 355.482 3.598 50 0 FHAAMO CCCc1ncncc1C(=O)NC[C@H](c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC000215214166 568058197 /nfs/dbraw/zinc/05/81/97/568058197.db2.gz HETLQPYSOXFTCR-LJQANCHMSA-N 1 1 372.900 3.649 50 0 FHAAMO Cc1cc(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)cc(C)n1 ZINC000215342348 568064834 /nfs/dbraw/zinc/06/48/34/568064834.db2.gz HUKJCPAUQYOBQT-IBGZPJMESA-N 1 1 357.885 3.919 50 0 FHAAMO C[N@H+]1CCCC[C@@H]1CC(=O)NCc1ccccc1OCc1ccccc1 ZINC000215853572 568092556 /nfs/dbraw/zinc/09/25/56/568092556.db2.gz RGBQFTCXIYGMGU-HXUWFJFHSA-N 1 1 352.478 3.756 50 0 FHAAMO c1cncc(OC2CC[NH+](Cc3cnc(C4CCCCC4)nc3)CC2)c1 ZINC000216042089 568102333 /nfs/dbraw/zinc/10/23/33/568102333.db2.gz CZEHLVWWWMEYOF-UHFFFAOYSA-N 1 1 352.482 3.963 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@H+]2CCC[C@H](c3nnc(C)[nH]3)C2)s1 ZINC000216203584 568112257 /nfs/dbraw/zinc/11/22/57/568112257.db2.gz PFLRYDUESHXWSY-AWEZNQCLSA-N 1 1 369.494 3.625 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@@H+]2CCC[C@H](c3nc(C)n[nH]3)C2)s1 ZINC000216203584 568112258 /nfs/dbraw/zinc/11/22/58/568112258.db2.gz PFLRYDUESHXWSY-AWEZNQCLSA-N 1 1 369.494 3.625 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@H+]2CCC[C@H](c3nc(C)n[nH]3)C2)s1 ZINC000216203584 568112259 /nfs/dbraw/zinc/11/22/59/568112259.db2.gz PFLRYDUESHXWSY-AWEZNQCLSA-N 1 1 369.494 3.625 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@@H+]2CCC[C@H](c3n[nH]c(C)n3)C2)s1 ZINC000216203584 568112260 /nfs/dbraw/zinc/11/22/60/568112260.db2.gz PFLRYDUESHXWSY-AWEZNQCLSA-N 1 1 369.494 3.625 50 0 FHAAMO COc1ccccc1-c1ncc(C[N@H+]2CCC[C@H](c3n[nH]c(C)n3)C2)s1 ZINC000216203584 568112261 /nfs/dbraw/zinc/11/22/61/568112261.db2.gz PFLRYDUESHXWSY-AWEZNQCLSA-N 1 1 369.494 3.625 50 0 FHAAMO Cn1nc(C[NH+]2CCC(CCn3cccn3)CC2)c2c1cccc2Cl ZINC000216272362 568115803 /nfs/dbraw/zinc/11/58/03/568115803.db2.gz LFUWDKUUCLTIPV-UHFFFAOYSA-N 1 1 357.889 3.726 50 0 FHAAMO COc1cc(OC)c(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)cc1Cl ZINC000216329074 568118193 /nfs/dbraw/zinc/11/81/93/568118193.db2.gz ZFQLTXBKTBAHDW-GOSISDBHSA-N 1 1 360.885 3.846 50 0 FHAAMO Cc1nc([C@@H]2CCC[N@@H+](Cc3cc(C)cc(C)c3-n3cccn3)C2)no1 ZINC000216446880 568123698 /nfs/dbraw/zinc/12/36/98/568123698.db2.gz ZSCPRVMUUZKHTE-QGZVFWFLSA-N 1 1 351.454 3.560 50 0 FHAAMO C[NH+](C)Cc1csc(C[N@H+]2CCCN(Cc3cccc(F)c3)CC2)c1 ZINC000219043806 568263467 /nfs/dbraw/zinc/26/34/67/568263467.db2.gz DNXMTAHYMQAJOW-UHFFFAOYSA-N 1 1 361.530 3.657 50 0 FHAAMO C[C@H](c1ccc(Cl)cc1)[N@H+](C)CC(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000032777533 568404353 /nfs/dbraw/zinc/40/43/53/568404353.db2.gz ZAIOPCCMIYPTDD-CQSZACIVSA-N 1 1 373.884 3.673 50 0 FHAAMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CC(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000032777533 568404354 /nfs/dbraw/zinc/40/43/54/568404354.db2.gz ZAIOPCCMIYPTDD-CQSZACIVSA-N 1 1 373.884 3.673 50 0 FHAAMO CCOc1ccc(-c2ccc(C[N@H+]3C[C@H]4CC[C@@H]3CN(C(C)=O)C4)o2)cc1 ZINC000091906650 570441949 /nfs/dbraw/zinc/44/19/49/570441949.db2.gz QQASCPGVHFEDEX-PKOBYXMFSA-N 1 1 368.477 3.788 50 0 FHAAMO COc1ccc([C@@H]2C[N@@H+](Cc3ccccc3SC)C[C@H]2N(C)C)cc1 ZINC000091951562 570443653 /nfs/dbraw/zinc/44/36/53/570443653.db2.gz HNTPNKKSYRPYAO-VQTJNVASSA-N 1 1 356.535 3.947 50 0 FHAAMO COc1ccc([C@@H]2CN(Cc3ccccc3SC)C[C@H]2[NH+](C)C)cc1 ZINC000091951562 570443656 /nfs/dbraw/zinc/44/36/56/570443656.db2.gz HNTPNKKSYRPYAO-VQTJNVASSA-N 1 1 356.535 3.947 50 0 FHAAMO O=C(c1cc(Cl)ccc1F)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccncc1)C2 ZINC000091997958 570444509 /nfs/dbraw/zinc/44/45/09/570444509.db2.gz UDNYXTANRFQNGN-DOTOQJQBSA-N 1 1 373.859 3.611 50 0 FHAAMO Cc1[nH]c2c(cc(C)cc2C)c1CC(=O)NCCCNc1ccc(C)c[nH+]1 ZINC000092003658 570444971 /nfs/dbraw/zinc/44/49/71/570444971.db2.gz KSEAGAJIAZSVHJ-UHFFFAOYSA-N 1 1 364.493 3.957 50 0 FHAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)N3CCCC3)CC2)C1 ZINC000092080479 570447139 /nfs/dbraw/zinc/44/71/39/570447139.db2.gz YQSLKVMDWZNRHB-HXUWFJFHSA-N 1 1 355.526 3.794 50 0 FHAAMO CCc1ocnc1C(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@@H+](C)C2 ZINC000095352657 570452046 /nfs/dbraw/zinc/45/20/46/570452046.db2.gz CXCCBOLBGMJRGP-SFHVURJKSA-N 1 1 367.493 3.579 50 0 FHAAMO CC(C)[NH+]1CCC(C(=O)N2CCCC[C@H]2c2nc3ccc(F)cc3[nH]2)CC1 ZINC000095352523 570452287 /nfs/dbraw/zinc/45/22/87/570452287.db2.gz HMADOBSEZIFFMQ-IBGZPJMESA-N 1 1 372.488 3.876 50 0 FHAAMO CSc1nc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccc2)C3)cs1 ZINC000095355679 570452690 /nfs/dbraw/zinc/45/26/90/570452690.db2.gz CYWZRGSEGGAHNO-JKSUJKDBSA-N 1 1 373.547 3.602 50 0 FHAAMO O=C(c1cccc(Cl)c1F)N1C[C@H]2CC[C@H](C[N@@H+]2CC2CCC2)C1 ZINC000095363923 570454336 /nfs/dbraw/zinc/45/43/36/570454336.db2.gz DJUZVZUFMPHEGM-HUUCEWRRSA-N 1 1 350.865 3.816 50 0 FHAAMO CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@H](c1ccc(F)cc1)[NH+](C)C ZINC000095364247 570455135 /nfs/dbraw/zinc/45/51/35/570455135.db2.gz OGGCPAFYRYSOKK-FQEVSTJZSA-N 1 1 367.424 3.742 50 0 FHAAMO O=C(C1CCC1)N1C[C@H]2CC[C@H](C[N@H+]2Cc2ccc3cccc(F)c3n2)C1 ZINC000095369594 570456290 /nfs/dbraw/zinc/45/62/90/570456290.db2.gz METUTPZXGQTIPD-DNVCBOLYSA-N 1 1 367.468 3.597 50 0 FHAAMO O=C(C1CCC1)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccc3cccc(F)c3n2)C1 ZINC000095369594 570456293 /nfs/dbraw/zinc/45/62/93/570456293.db2.gz METUTPZXGQTIPD-DNVCBOLYSA-N 1 1 367.468 3.597 50 0 FHAAMO CCC[N@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1cc(C)nc3c(C)cccc13)C2 ZINC000095375275 570457386 /nfs/dbraw/zinc/45/73/86/570457386.db2.gz WPENBFDRNXYSPD-QZTJIDSGSA-N 1 1 351.494 3.798 50 0 FHAAMO O=C(NCc1n[nH]c2c1CCCCC2)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000095376509 570457769 /nfs/dbraw/zinc/45/77/69/570457769.db2.gz ZOUALDJMBYXSHL-UHFFFAOYSA-N 1 1 366.509 3.595 50 0 FHAAMO Cc1nnc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](C2CC2)C3)o1 ZINC000095378693 570458242 /nfs/dbraw/zinc/45/82/42/570458242.db2.gz ZWVSMPIPUOHUKP-IBGZPJMESA-N 1 1 366.509 3.612 50 0 FHAAMO c1c(C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)onc1-c1ccccc1 ZINC000095380327 570458413 /nfs/dbraw/zinc/45/84/13/570458413.db2.gz UIKHHVYDFYNCTI-PZJWPPBQSA-N 1 1 374.488 3.833 50 0 FHAAMO c1c(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2cccnc2)C3)onc1-c1ccccc1 ZINC000095380327 570458416 /nfs/dbraw/zinc/45/84/16/570458416.db2.gz UIKHHVYDFYNCTI-PZJWPPBQSA-N 1 1 374.488 3.833 50 0 FHAAMO c1c(CN2C[C@H]3CC[C@@H]2C[N@@H+](Cc2cccnc2)C3)onc1-c1ccccc1 ZINC000095380327 570458418 /nfs/dbraw/zinc/45/84/18/570458418.db2.gz UIKHHVYDFYNCTI-PZJWPPBQSA-N 1 1 374.488 3.833 50 0 FHAAMO Cc1ccc2ncccc2c1CNC(=O)[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000095380061 570458500 /nfs/dbraw/zinc/45/85/00/570458500.db2.gz RPLSCZMIEXJAEE-HXUWFJFHSA-N 1 1 351.425 3.601 50 0 FHAAMO O=C([C@H]1CCC[N@@H+](Cc2ccco2)C1)N1CC=C(c2ccccc2)CC1 ZINC000095380433 570458969 /nfs/dbraw/zinc/45/89/69/570458969.db2.gz NDAPMJKQXQRRSK-FQEVSTJZSA-N 1 1 350.462 3.808 50 0 FHAAMO Oc1cccc([C@@H]2C[N@H+](Cc3cccc(F)c3F)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000095388431 570460863 /nfs/dbraw/zinc/46/08/63/570460863.db2.gz WSNLEEKZEYFQKT-VLCRHTCISA-N 1 1 370.443 3.733 50 0 FHAAMO Oc1cccc([C@@H]2C[N@@H+](Cc3cccc(F)c3F)[C@H]3[C@@H]2N2CCC3CC2)c1 ZINC000095388431 570460865 /nfs/dbraw/zinc/46/08/65/570460865.db2.gz WSNLEEKZEYFQKT-VLCRHTCISA-N 1 1 370.443 3.733 50 0 FHAAMO Cn1ccnc1CN1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095390199 570460889 /nfs/dbraw/zinc/46/08/89/570460889.db2.gz MUSBPSIKIOSSES-HXUWFJFHSA-N 1 1 364.537 3.654 50 0 FHAAMO FC(F)Oc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)cc1 ZINC000095391872 570461248 /nfs/dbraw/zinc/46/12/48/570461248.db2.gz AGEVWLKFWUUDGQ-RBUKOAKNSA-N 1 1 373.447 3.779 50 0 FHAAMO CN(Cc1ccc2ccccc2n1)C(=O)[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000095392428 570461282 /nfs/dbraw/zinc/46/12/82/570461282.db2.gz UCYIXIKGOCSNAI-HXUWFJFHSA-N 1 1 351.425 3.635 50 0 FHAAMO O=C(c1ccc2cc[nH]c2c1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000095391822 570461309 /nfs/dbraw/zinc/46/13/09/570461309.db2.gz VCEITLQOWWYMMA-GHTZIAJQSA-N 1 1 359.473 3.905 50 0 FHAAMO CC(=O)c1ccc(NC(=O)NC[C@H]2CCC[N@@H+](Cc3ccco3)C2)cc1 ZINC000095513140 570466031 /nfs/dbraw/zinc/46/60/31/570466031.db2.gz BRLZUJIMQWVEBN-MRXNPFEDSA-N 1 1 355.438 3.516 50 0 FHAAMO C[N@H+]1CCCC[C@@H]1CNC(=O)Nc1cccc(OCc2ccccc2)c1 ZINC000095522198 570467747 /nfs/dbraw/zinc/46/77/47/570467747.db2.gz OFFAJCVXAAQGCA-LJQANCHMSA-N 1 1 353.466 3.871 50 0 FHAAMO Fc1ccc(-c2n[nH]cc2CN2C[C@H]3CC[C@H](C[N@@H+]3CC3CC3)C2)cc1 ZINC000095523325 570468057 /nfs/dbraw/zinc/46/80/57/570468057.db2.gz LZEKWHMZZQUVNT-OXJNMPFZSA-N 1 1 354.473 3.522 50 0 FHAAMO COc1ccc2c(c1)CCN(C(=O)c1ccc(-c3[nH+]c(C)[nH]c3C)cc1)C2 ZINC000584903097 570510002 /nfs/dbraw/zinc/51/00/02/570510002.db2.gz IHRVKRYKDXVYQA-UHFFFAOYSA-N 1 1 361.445 3.901 50 0 FHAAMO CN(Cc1ccsc1)C(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC000584902685 570511582 /nfs/dbraw/zinc/51/15/82/570511582.db2.gz FHLWZGLGQSMEQZ-QGZVFWFLSA-N 1 1 361.486 3.693 50 0 FHAAMO CN(Cc1ccsc1)C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC000584902685 570511586 /nfs/dbraw/zinc/51/15/86/570511586.db2.gz FHLWZGLGQSMEQZ-QGZVFWFLSA-N 1 1 361.486 3.693 50 0 FHAAMO O=C(c1cccc(C[NH+]2CCSCC2)c1)c1cc(F)c(F)c(F)c1 ZINC000002515314 570523825 /nfs/dbraw/zinc/52/38/25/570523825.db2.gz VWRBEALJMJOXMU-UHFFFAOYSA-N 1 1 351.393 3.884 50 0 FHAAMO CCOc1ccccc1C[N@H+]1CCC[C@H](C(=O)N(C)Cc2ccccc2)C1 ZINC000002734718 570528895 /nfs/dbraw/zinc/52/88/95/570528895.db2.gz SXMVAVVUUHFGAG-NRFANRHFSA-N 1 1 366.505 3.956 50 0 FHAAMO C[C@H](CNC(=O)[C@H]1CCCC[C@H]1C(F)(F)F)[N@@H+]1CCc2sccc2C1 ZINC000247985920 570594888 /nfs/dbraw/zinc/59/48/88/570594888.db2.gz IQSRMHVLFHNKBK-VHDGCEQUSA-N 1 1 374.472 3.980 50 0 FHAAMO C[C@H](CNC(=O)[C@H]1CCCC[C@H]1C(F)(F)F)[N@H+]1CCc2sccc2C1 ZINC000247985920 570594895 /nfs/dbraw/zinc/59/48/95/570594895.db2.gz IQSRMHVLFHNKBK-VHDGCEQUSA-N 1 1 374.472 3.980 50 0 FHAAMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cccc(NC(=O)C3CC3)c2)C1 ZINC000248108741 570596832 /nfs/dbraw/zinc/59/68/32/570596832.db2.gz PYMXNNIMDSDOCG-YRNRMSPPSA-N 1 1 369.509 3.513 50 0 FHAAMO O=S1(=O)CC[C@@H]([NH2+]Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000011915352 570601554 /nfs/dbraw/zinc/60/15/54/570601554.db2.gz DTXJGXKOFBPJKV-LLVKDONJSA-N 1 1 360.262 3.530 50 0 FHAAMO Cc1ccsc1CCNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000426435433 570605893 /nfs/dbraw/zinc/60/58/93/570605893.db2.gz QIURGPLNRWEEOW-SFHVURJKSA-N 1 1 357.523 3.515 50 0 FHAAMO Fc1ccc(NC(=S)NCC[N@H+]2CCc3ccccc3C2)cc1Cl ZINC000004908461 570612852 /nfs/dbraw/zinc/61/28/52/570612852.db2.gz AOJVJGLPCBUUKK-UHFFFAOYSA-N 1 1 363.889 3.824 50 0 FHAAMO Cc1ccc(OCCCCNC(=O)[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1 ZINC000078875859 570634107 /nfs/dbraw/zinc/63/41/07/570634107.db2.gz BYRQISQEMFDWFL-NRFANRHFSA-N 1 1 352.478 3.545 50 0 FHAAMO Cc1ccc(OCCCCNC(=O)[C@@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC000078875859 570634108 /nfs/dbraw/zinc/63/41/08/570634108.db2.gz BYRQISQEMFDWFL-NRFANRHFSA-N 1 1 352.478 3.545 50 0 FHAAMO CC(C)N(C(=O)[C@@H](C)[N@@H+](C)Cc1ccc(Br)cc1)C(C)C ZINC000071920709 570678593 /nfs/dbraw/zinc/67/85/93/570678593.db2.gz FQDIBCIUHJRCCI-CQSZACIVSA-N 1 1 355.320 3.915 50 0 FHAAMO CC(C)C[N@H+]1CCOc2ccc([C@@](C)(O)COc3ccccc3)cc2C1 ZINC000011782842 570706830 /nfs/dbraw/zinc/70/68/30/570706830.db2.gz AZIFVSPAFDQGEW-QFIPXVFZSA-N 1 1 355.478 3.824 50 0 FHAAMO CC(C)c1nc(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3F)C2)cs1 ZINC000011817137 570707549 /nfs/dbraw/zinc/70/75/49/570707549.db2.gz GMWWYGAOMDBZPG-HNNXBMFYSA-N 1 1 361.486 3.800 50 0 FHAAMO CC(C)c1nc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3F)C2)cs1 ZINC000011817137 570707551 /nfs/dbraw/zinc/70/75/51/570707551.db2.gz GMWWYGAOMDBZPG-HNNXBMFYSA-N 1 1 361.486 3.800 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)c(OC)c1 ZINC000011874067 570710300 /nfs/dbraw/zinc/71/03/00/570710300.db2.gz HJTCWVZPEITUSZ-MRXNPFEDSA-N 1 1 357.425 3.938 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)c(OC)c1 ZINC000011874067 570710303 /nfs/dbraw/zinc/71/03/03/570710303.db2.gz HJTCWVZPEITUSZ-MRXNPFEDSA-N 1 1 357.425 3.938 50 0 FHAAMO OC[C@]1(CCCc2ccccc2)CCC[N@H+](C2CSCCSC2)C1 ZINC000012074336 570716376 /nfs/dbraw/zinc/71/63/76/570716376.db2.gz SLGYYLWGTRECML-HXUWFJFHSA-N 1 1 365.608 3.932 50 0 FHAAMO COCc1ccc(C[N@@H+]2CCC[C@@H](C(=O)c3ccc(OC)cc3OC)C2)o1 ZINC000012194390 570726262 /nfs/dbraw/zinc/72/62/62/570726262.db2.gz UCIBZUABTDNRAS-OAHLLOKOSA-N 1 1 373.449 3.538 50 0 FHAAMO COCc1ccc(C[N@H+]2CCC[C@@H](C(=O)c3ccc(OC)cc3OC)C2)o1 ZINC000012194390 570726264 /nfs/dbraw/zinc/72/62/64/570726264.db2.gz UCIBZUABTDNRAS-OAHLLOKOSA-N 1 1 373.449 3.538 50 0 FHAAMO Cc1ccc(C)c(-n2cc(C[N@@H+]3CCC[C@H]3C(N)=O)c(-c3ccccc3)n2)c1 ZINC000012298680 570733359 /nfs/dbraw/zinc/73/33/59/570733359.db2.gz ZNDTXGGACRVTHB-FQEVSTJZSA-N 1 1 374.488 3.606 50 0 FHAAMO Cc1ccc(C)c(-n2cc(C[N@H+]3CCC[C@H]3C(N)=O)c(-c3ccccc3)n2)c1 ZINC000012298680 570733361 /nfs/dbraw/zinc/73/33/61/570733361.db2.gz ZNDTXGGACRVTHB-FQEVSTJZSA-N 1 1 374.488 3.606 50 0 FHAAMO CCOC(=O)C[C@H]1CCCC[N@H+]1Cc1c[nH]nc1-c1ccc(F)cc1F ZINC000012316405 570736225 /nfs/dbraw/zinc/73/62/25/570736225.db2.gz YFFWHUPCDKHYMU-OAHLLOKOSA-N 1 1 363.408 3.663 50 0 FHAAMO CCN(Cc1nc(C)c[nH]1)CC1CC[NH+](CCc2ccccc2C)CC1 ZINC000012317758 570736360 /nfs/dbraw/zinc/73/63/60/570736360.db2.gz ALXTWGWXPAXCDM-UHFFFAOYSA-N 1 1 354.542 3.803 50 0 FHAAMO COc1ccccc1CC[N@H+]1CCC[C@@H](CN(C)C(=O)c2ccsc2)C1 ZINC000012429935 570744325 /nfs/dbraw/zinc/74/43/25/570744325.db2.gz HGFZFPLATQNWGP-KRWDZBQOSA-N 1 1 372.534 3.783 50 0 FHAAMO CCOC(=O)[C@@]1(Cc2ccccc2F)CCC[N@@H+](Cc2cccc(C)n2)C1 ZINC000012432618 570744799 /nfs/dbraw/zinc/74/47/99/570744799.db2.gz LHLXRCOQOGAKRS-JOCHJYFZSA-N 1 1 370.468 3.917 50 0 FHAAMO O=C(CC[C@H]1CCC[N@@H+](Cc2cccc3cccnc32)C1)N1CCCC1 ZINC000012457221 570747184 /nfs/dbraw/zinc/74/71/84/570747184.db2.gz HMFFUIQGHRDFOM-GOSISDBHSA-N 1 1 351.494 3.849 50 0 FHAAMO C[N@H+]1CCC[C@@H](CN(CCc2ccccc2)C(=O)c2ccc(F)c(F)c2)C1 ZINC000012578786 570751486 /nfs/dbraw/zinc/75/14/86/570751486.db2.gz KECMNJKLYQNSEB-GOSISDBHSA-N 1 1 372.459 3.992 50 0 FHAAMO CCOC(=O)[C@@H]1CCC[N@H+](Cc2nc(-c3ccc(F)cc3F)oc2C)C1 ZINC000012588204 570752000 /nfs/dbraw/zinc/75/20/00/570752000.db2.gz VIKDGLBNIOQQFA-CYBMUJFWSA-N 1 1 364.392 3.703 50 0 FHAAMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc(F)cc3F)oc2C)C1 ZINC000012588204 570752004 /nfs/dbraw/zinc/75/20/04/570752004.db2.gz VIKDGLBNIOQQFA-CYBMUJFWSA-N 1 1 364.392 3.703 50 0 FHAAMO Cc1ncc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccccc3F)C2)s1 ZINC000012593392 570752607 /nfs/dbraw/zinc/75/26/07/570752607.db2.gz GMRGUEKLTPMTNE-QGZVFWFLSA-N 1 1 361.530 3.977 50 0 FHAAMO CN(C(=O)c1ccnc(Cl)c1)[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000012702041 570756921 /nfs/dbraw/zinc/75/69/21/570756921.db2.gz KSLURRSIEVNONG-IBGZPJMESA-N 1 1 371.912 3.904 50 0 FHAAMO O=C(Nc1cccc(-n2cccn2)c1)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000012705232 570757419 /nfs/dbraw/zinc/75/74/19/570757419.db2.gz VKCRUHLTKVLSGJ-HXUWFJFHSA-N 1 1 364.424 3.615 50 0 FHAAMO O=C(Nc1cccc(-n2cccn2)c1)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000012705232 570757422 /nfs/dbraw/zinc/75/74/22/570757422.db2.gz VKCRUHLTKVLSGJ-HXUWFJFHSA-N 1 1 364.424 3.615 50 0 FHAAMO O=C(N[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1)c1ccc2[nH]ccc2c1 ZINC000012745252 570759131 /nfs/dbraw/zinc/75/91/31/570759131.db2.gz YPIGVRXDSMBACN-FQEVSTJZSA-N 1 1 359.473 3.530 50 0 FHAAMO C[C@H](c1ccc(F)cc1)[N@H+](C)CC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000012789469 570761537 /nfs/dbraw/zinc/76/15/37/570761537.db2.gz ZECKBHVOBYAKDO-OAHLLOKOSA-N 1 1 369.440 3.584 50 0 FHAAMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000012789469 570761542 /nfs/dbraw/zinc/76/15/42/570761542.db2.gz ZECKBHVOBYAKDO-OAHLLOKOSA-N 1 1 369.440 3.584 50 0 FHAAMO NC(=O)[C@@H](c1ccc(F)cc1)[NH+]1CCC(c2c[nH]c3ccccc32)CC1 ZINC000012790664 570761808 /nfs/dbraw/zinc/76/18/08/570761808.db2.gz PQEAFUBYYBJERC-HXUWFJFHSA-N 1 1 351.425 3.713 50 0 FHAAMO COCc1ccc(C[N@H+]2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)o1 ZINC000012836079 570765347 /nfs/dbraw/zinc/76/53/47/570765347.db2.gz UGVQFPGECPKZQK-FQEVSTJZSA-N 1 1 363.885 3.897 50 0 FHAAMO C[C@@H](c1cc2ccccc2o1)[N@H+](C)CC(=O)Nc1ccc2c(c1)OCO2 ZINC000032754458 570793770 /nfs/dbraw/zinc/79/37/70/570793770.db2.gz GFACORWCVPGRRL-ZDUSSCGKSA-N 1 1 352.390 3.793 50 0 FHAAMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CC(=O)Nc1ccc2c(c1)OCO2 ZINC000032754458 570793773 /nfs/dbraw/zinc/79/37/73/570793773.db2.gz GFACORWCVPGRRL-ZDUSSCGKSA-N 1 1 352.390 3.793 50 0 FHAAMO Cc1ccccc1C[N@@H+](C[C@@H](O)COc1ccccc1C)C[C@@H]1CCCO1 ZINC000104973103 570865733 /nfs/dbraw/zinc/86/57/33/570865733.db2.gz LPBYLAZOYHYLRD-YADHBBJMSA-N 1 1 369.505 3.724 50 0 FHAAMO CC[N@@H+](C[C@@H](O)c1ccccc1)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000104983012 570866293 /nfs/dbraw/zinc/86/62/93/570866293.db2.gz JXAMYVRVCYAMKB-UYAOXDASSA-N 1 1 358.869 3.889 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(Br)ccc1F ZINC000046989066 570878241 /nfs/dbraw/zinc/87/82/41/570878241.db2.gz RTCYJBZEQVQUAN-CYBMUJFWSA-N 1 1 371.294 3.973 50 0 FHAAMO CCOc1ccc(C(=O)Nc2nc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cs2)cn1 ZINC000044954863 570903691 /nfs/dbraw/zinc/90/36/91/570903691.db2.gz QSMGFUMGIVBSPA-OKILXGFUSA-N 1 1 374.510 3.667 50 0 FHAAMO CCOc1ccc(C(=O)Nc2nc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cs2)cn1 ZINC000044954863 570903694 /nfs/dbraw/zinc/90/36/94/570903694.db2.gz QSMGFUMGIVBSPA-OKILXGFUSA-N 1 1 374.510 3.667 50 0 FHAAMO C[C@@H](O)C1CC[NH+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 ZINC000111288132 570930933 /nfs/dbraw/zinc/93/09/33/570930933.db2.gz AOKHSQNQUVKHPL-QRWLVFNGSA-N 1 1 356.441 3.598 50 0 FHAAMO Cc1ncsc1C(=O)Nc1nc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cs1 ZINC000043286182 570937132 /nfs/dbraw/zinc/93/71/32/570937132.db2.gz PUDZUVPXNDLSKU-PHIMTYICSA-N 1 1 350.513 3.638 50 0 FHAAMO Cc1ncsc1C(=O)Nc1nc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cs1 ZINC000043286182 570937134 /nfs/dbraw/zinc/93/71/34/570937134.db2.gz PUDZUVPXNDLSKU-PHIMTYICSA-N 1 1 350.513 3.638 50 0 FHAAMO O=C(Nc1ccccc1)[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000247034592 570943488 /nfs/dbraw/zinc/94/34/88/570943488.db2.gz ZXVIYFJEAQCEJQ-FGZHOGPDSA-N 1 1 373.456 3.915 50 0 FHAAMO O=C(Nc1ccccc1)[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000247034592 570943490 /nfs/dbraw/zinc/94/34/90/570943490.db2.gz ZXVIYFJEAQCEJQ-FGZHOGPDSA-N 1 1 373.456 3.915 50 0 FHAAMO C[N@@H+](CCC(=O)Nc1cccc(Cl)c1)Cc1cnn(-c2ccccc2)c1 ZINC000028901163 570950030 /nfs/dbraw/zinc/95/00/30/570950030.db2.gz JCASDFWERKWIFC-UHFFFAOYSA-N 1 1 368.868 3.986 50 0 FHAAMO C[N@H+](CCOc1ccccc1Cl)CC(=O)N[C@H]1CCCc2ccccc21 ZINC000049581225 570964853 /nfs/dbraw/zinc/96/48/53/570964853.db2.gz NOZOYKSQENWFNN-IBGZPJMESA-N 1 1 372.896 3.844 50 0 FHAAMO C[N@@H+](CCOc1ccccc1Cl)CC(=O)N[C@H]1CCCc2ccccc21 ZINC000049581225 570964858 /nfs/dbraw/zinc/96/48/58/570964858.db2.gz NOZOYKSQENWFNN-IBGZPJMESA-N 1 1 372.896 3.844 50 0 FHAAMO COc1cccc(NC(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000025061228 570990062 /nfs/dbraw/zinc/99/00/62/570990062.db2.gz RVMYKIPAAHCWTF-UYAOXDASSA-N 1 1 351.450 3.843 50 0 FHAAMO C=C1c2ccccc2NC(=O)N1C[C@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000025065990 570990524 /nfs/dbraw/zinc/99/05/24/570990524.db2.gz PRWANLDIXRYTCP-GOSISDBHSA-N 1 1 368.506 3.555 50 0 FHAAMO C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+](C)CCC(=O)NC1CC1 ZINC000026913061 571009191 /nfs/dbraw/zinc/00/91/91/571009191.db2.gz HKLQFHYQMAODCN-INIZCTEOSA-N 1 1 365.477 3.600 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccccc1OC(F)F)c1ccccc1Cl ZINC000029050518 571036443 /nfs/dbraw/zinc/03/64/43/571036443.db2.gz FUDUHTWPEQEONW-HNNXBMFYSA-N 1 1 368.811 3.974 50 0 FHAAMO CCOC(=O)c1sc(NC(=O)C[N@H+](C)[C@H]2CCc3ccccc32)cc1C ZINC000029489313 571040954 /nfs/dbraw/zinc/04/09/54/571040954.db2.gz GLCZBYVMJSQZSB-INIZCTEOSA-N 1 1 372.490 3.791 50 0 FHAAMO CCOC(=O)c1sc(NC(=O)C[N@@H+](C)[C@H]2CCc3ccccc32)cc1C ZINC000029489313 571040959 /nfs/dbraw/zinc/04/09/59/571040959.db2.gz GLCZBYVMJSQZSB-INIZCTEOSA-N 1 1 372.490 3.791 50 0 FHAAMO COC(=O)c1oc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1C ZINC000029833284 571044200 /nfs/dbraw/zinc/04/42/00/571044200.db2.gz FXICGFMXZXFSAN-CQSZACIVSA-N 1 1 354.406 3.895 50 0 FHAAMO C[NH+]1CCN(C(=S)c2cn(Cc3ccccc3F)c3ccccc23)CC1 ZINC000004140364 571050054 /nfs/dbraw/zinc/05/00/54/571050054.db2.gz YVYHCWGKGKFTBR-UHFFFAOYSA-N 1 1 367.493 3.752 50 0 FHAAMO CC(C)(C)OC(=O)N1CC[N@H+](CCc2ccccc2)[C@H](c2ccncc2)C1 ZINC000225736386 571060818 /nfs/dbraw/zinc/06/08/18/571060818.db2.gz CGFOGKSWBNPSHN-FQEVSTJZSA-N 1 1 367.493 3.918 50 0 FHAAMO CC(C)(C)OC(=O)N1CC[N@@H+](CCc2ccccc2)[C@H](c2ccncc2)C1 ZINC000225736386 571060820 /nfs/dbraw/zinc/06/08/20/571060820.db2.gz CGFOGKSWBNPSHN-FQEVSTJZSA-N 1 1 367.493 3.918 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)CC12CC3CC(CC(C3)C1)C2 ZINC000040005790 571067882 /nfs/dbraw/zinc/06/78/82/571067882.db2.gz KNCWLXZCJZTWOG-NEFAXPCMSA-N 1 1 358.530 3.939 50 0 FHAAMO CCOCCCC(=O)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000040112641 571079320 /nfs/dbraw/zinc/07/93/20/571079320.db2.gz JJCUGYRLNWFNIC-LJQANCHMSA-N 1 1 372.534 3.780 50 0 FHAAMO CCOCCCC(=O)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000040112641 571079322 /nfs/dbraw/zinc/07/93/22/571079322.db2.gz JJCUGYRLNWFNIC-LJQANCHMSA-N 1 1 372.534 3.780 50 0 FHAAMO CCCC(=O)OC[C@@H](O)C[N@@H+](Cc1ccc(C)cc1)Cc1ccc(F)cc1 ZINC000036101999 571079587 /nfs/dbraw/zinc/07/95/87/571079587.db2.gz WKVFMLMOFGBRQT-NRFANRHFSA-N 1 1 373.468 3.841 50 0 FHAAMO COc1ccc(Cl)cc1C[NH2+][C@H](CN1CCCC1=O)c1ccccc1 ZINC000040153253 571086767 /nfs/dbraw/zinc/08/67/67/571086767.db2.gz WWGWJZIQDFLSHH-GOSISDBHSA-N 1 1 358.869 3.802 50 0 FHAAMO CSc1cccc(CN2CC[N@H+](Cc3ccsc3)[C@H](CCO)C2)c1 ZINC000039467682 571089353 /nfs/dbraw/zinc/08/93/53/571089353.db2.gz VKNJVXFMYSQACZ-GOSISDBHSA-N 1 1 362.564 3.539 50 0 FHAAMO 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FHAAMO COc1ccccc1C[C@H](C)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1F ZINC000244840269 571117939 /nfs/dbraw/zinc/11/79/39/571117939.db2.gz UKDQWBUUIZHSOQ-ZDUSSCGKSA-N 1 1 364.848 3.989 50 0 FHAAMO COc1ccccc1C[C@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1F ZINC000244840269 571117940 /nfs/dbraw/zinc/11/79/40/571117940.db2.gz UKDQWBUUIZHSOQ-ZDUSSCGKSA-N 1 1 364.848 3.989 50 0 FHAAMO CC(C)c1noc([C@@H]2CCC[N@H+](Cc3nnc(-c4cccc(F)c4)o3)C2)n1 ZINC000244882460 571118599 /nfs/dbraw/zinc/11/85/99/571118599.db2.gz XSDOLMHJPFOYLQ-CQSZACIVSA-N 1 1 371.416 3.762 50 0 FHAAMO CC(C)c1noc([C@@H]2CCC[N@@H+](Cc3nnc(-c4cccc(F)c4)o3)C2)n1 ZINC000244882460 571118601 /nfs/dbraw/zinc/11/86/01/571118601.db2.gz XSDOLMHJPFOYLQ-CQSZACIVSA-N 1 1 371.416 3.762 50 0 FHAAMO c1cc(C[N@@H+](Cc2ccc(-n3cncn3)cc2)C[C@H]2CCCO2)cs1 ZINC000055271013 571118832 /nfs/dbraw/zinc/11/88/32/571118832.db2.gz FMRNJAVFNYMQPC-LJQANCHMSA-N 1 1 354.479 3.510 50 0 FHAAMO CC(C)n1nc(C[NH2+]Cc2ccc3c(c2)OCO3)c(-c2ccccc2)n1 ZINC000248007230 571126962 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c1c(CNc2nc(C3CCCC3)nc3c2C[NH2+]C3)[nH]nc1-c1ccccc1 ZINC000072157768 571175331 /nfs/dbraw/zinc/17/53/31/571175331.db2.gz FTZASHYCQRMHNQ-UHFFFAOYSA-N 1 1 360.465 3.740 50 0 FHAAMO CC(C)c1ccc(NC(=O)N[C@H]2CCC[N@H+](Cc3ccccn3)C2)cc1 ZINC000072162524 571176040 /nfs/dbraw/zinc/17/60/40/571176040.db2.gz QESZUMXSDXRCML-FQEVSTJZSA-N 1 1 352.482 3.991 50 0 FHAAMO CC(C)c1ccc(NC(=O)N[C@H]2CCC[N@@H+](Cc3ccccn3)C2)cc1 ZINC000072162524 571176041 /nfs/dbraw/zinc/17/60/41/571176041.db2.gz QESZUMXSDXRCML-FQEVSTJZSA-N 1 1 352.482 3.991 50 0 FHAAMO COc1cccc(OC[C@H]2CCC[N@@H+](Cc3ccc(O)c(OC)c3)C2)c1 ZINC000072164368 571176275 /nfs/dbraw/zinc/17/62/75/571176275.db2.gz ZQORNXSFFUMLOW-KRWDZBQOSA-N 1 1 357.450 3.700 50 0 FHAAMO Cc1nc([C@@H]2CCC[N@@H+](Cc3ccc(-c4ccccc4F)o3)C2)cc(=O)[nH]1 ZINC000072173936 571177785 /nfs/dbraw/zinc/17/77/85/571177785.db2.gz HIDRZTBWQVCAFY-OAHLLOKOSA-N 1 1 367.424 3.857 50 0 FHAAMO O=C(/C=C/c1ccc(Cl)cc1)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000029882008 571185067 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C[C@@H]([NH2+]CC(=O)NCCc1nc2ccccc2s1)c1ccccc1Cl ZINC000014075442 211069550 /nfs/dbraw/zinc/06/95/50/211069550.db2.gz ZCXWCLUJDGCVDL-CYBMUJFWSA-N 1 1 373.909 3.959 50 0 FHAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2ccc(OC)cc2OC)cc1 ZINC000013003986 211019241 /nfs/dbraw/zinc/01/92/41/211019241.db2.gz YWZMSBJISUUFLK-IBGZPJMESA-N 1 1 355.434 3.828 50 0 FHAAMO Cc1nc(-c2ccc3c(c2)CCN3C(=O)C[N@@H+]2CCCC[C@@H]2C)cs1 ZINC000012999106 211016483 /nfs/dbraw/zinc/01/64/83/211016483.db2.gz HGQXXZLZNMWDQB-AWEZNQCLSA-N 1 1 355.507 3.882 50 0 FHAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2cc(OC)ccc2OC)cc1 ZINC000012986326 211015547 /nfs/dbraw/zinc/01/55/47/211015547.db2.gz PTGSNAQEPSEDNK-IBGZPJMESA-N 1 1 355.434 3.828 50 0 FHAAMO Cc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000012987461 211015234 /nfs/dbraw/zinc/01/52/34/211015234.db2.gz APACRZLRLVQGDM-KRWDZBQOSA-N 1 1 363.465 3.516 50 0 FHAAMO Cc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1C ZINC000012987461 211015242 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CC1CC[NH+](Cc2nc(-c3ccc(N4CCC[C@H](C)C4)nc3)no2)CC1 ZINC000065216034 221182036 /nfs/dbraw/zinc/18/20/36/221182036.db2.gz HMKQCHUWXWHBOT-INIZCTEOSA-N 1 1 355.486 3.600 50 0 FHAAMO Fc1ccc(C[N@H+]2CCC[C@@H](c3nncn3Cc3ccccc3)C2)cc1 ZINC000065287796 221195608 /nfs/dbraw/zinc/19/56/08/221195608.db2.gz VHKWGRJPFZYVEO-LJQANCHMSA-N 1 1 350.441 3.845 50 0 FHAAMO O=C(CC[N@H+]1CCC[C@H]1c1ccccn1)Nc1nc2ccccc2s1 ZINC000065384733 221208611 /nfs/dbraw/zinc/20/86/11/221208611.db2.gz WDIVXVZTUPZPFW-INIZCTEOSA-N 1 1 352.463 3.857 50 0 FHAAMO CCc1nc(Cn2cnc(-c3ccccc3)c2[C@H]2CCC[N@H+](CC)C2)no1 ZINC000065387946 221209853 /nfs/dbraw/zinc/20/98/53/221209853.db2.gz BKGYQMONHAIVHI-KRWDZBQOSA-N 1 1 365.481 3.743 50 0 FHAAMO CC(=O)c1cc(C[N@@H+]2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)n(C)c1 ZINC000065387696 221210246 /nfs/dbraw/zinc/21/02/46/221210246.db2.gz KZFZXQKFXZZKFN-XZOQPEGZSA-N 1 1 362.473 3.731 50 0 FHAAMO CC(=O)c1cc(C[N@H+]2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)n(C)c1 ZINC000065387696 221210249 /nfs/dbraw/zinc/21/02/49/221210249.db2.gz KZFZXQKFXZZKFN-XZOQPEGZSA-N 1 1 362.473 3.731 50 0 FHAAMO Cc1cc2cc(NC(=O)c3ccc(C[N@H+]4CC[C@H](O)C4)cc3)ccc2o1 ZINC000065406048 221214003 /nfs/dbraw/zinc/21/40/03/221214003.db2.gz XAGKHPNOHXQWIK-IBGZPJMESA-N 1 1 350.418 3.560 50 0 FHAAMO CCc1ccc2oc(=O)cc(C[NH2+]Cc3ccc(OC)c(F)c3F)c2c1 ZINC000065404347 221214067 /nfs/dbraw/zinc/21/40/67/221214067.db2.gz SAARPUNOSOIPMW-UHFFFAOYSA-N 1 1 359.372 3.932 50 0 FHAAMO O=C(c1ccco1)N1CCC[N@H+](Cc2ccc([C@H]3CCCO3)s2)CC1 ZINC000065495652 221226774 /nfs/dbraw/zinc/22/67/74/221226774.db2.gz NYQSHVYVJWQYMF-MRXNPFEDSA-N 1 1 360.479 3.541 50 0 FHAAMO O=C(c1ccco1)N1CCC[N@@H+](Cc2ccc([C@H]3CCCO3)s2)CC1 ZINC000065495652 221226776 /nfs/dbraw/zinc/22/67/76/221226776.db2.gz NYQSHVYVJWQYMF-MRXNPFEDSA-N 1 1 360.479 3.541 50 0 FHAAMO CC[C@H](Cn1cnc(-c2ccccc2)c1-c1nccs1)[NH+]1CCOCC1 ZINC000065507339 221228391 /nfs/dbraw/zinc/22/83/91/221228391.db2.gz MCOXNTZZSBPWNW-QGZVFWFLSA-N 1 1 368.506 3.784 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@@](C)(CO)C3)c(C)o2)c(OC)c1C ZINC000067489960 221257693 /nfs/dbraw/zinc/25/76/93/221257693.db2.gz RBAAXKTVEXXYRL-OAQYLSRUSA-N 1 1 374.481 3.570 50 0 FHAAMO CCNC(=O)[C@@H](C)[N@@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067588773 221260362 /nfs/dbraw/zinc/26/03/62/221260362.db2.gz CDJVILOXXSABES-MRXNPFEDSA-N 1 1 374.488 3.626 50 0 FHAAMO CCNC(=O)[C@@H](C)[N@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067588773 221260364 /nfs/dbraw/zinc/26/03/64/221260364.db2.gz CDJVILOXXSABES-MRXNPFEDSA-N 1 1 374.488 3.626 50 0 FHAAMO CCc1cc(N2Cc3cnc(-c4ccccc4)nc3C2)nc(N2CCCC2)[nH+]1 ZINC000067641534 221263991 /nfs/dbraw/zinc/26/39/91/221263991.db2.gz AMIRQBNLXRNAMF-UHFFFAOYSA-N 1 1 372.476 3.616 50 0 FHAAMO Cc1oc(-c2cccc(Cl)c2)nc1C[N@H+](C)CC1(CO)CCOCC1 ZINC000067726876 221277625 /nfs/dbraw/zinc/27/76/25/221277625.db2.gz RSPFPKOEFUHPML-UHFFFAOYSA-N 1 1 364.873 3.524 50 0 FHAAMO Cc1oc(-c2cccc(C(F)(F)F)c2)nc1CN1CCC(C[NH3+])CC1 ZINC000067677043 221270503 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Fc1ccc(-c2[nH]nc3c2C[N@@H+](CCCc2cccnc2)CC3)cc1F ZINC000067975690 221312367 /nfs/dbraw/zinc/31/23/67/221312367.db2.gz HCLTYCGTPKBNQB-UHFFFAOYSA-N 1 1 354.404 3.741 50 0 FHAAMO O=C(/C=C/c1cccc(Cl)c1)OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000069890357 221328475 /nfs/dbraw/zinc/32/84/75/221328475.db2.gz QEXIMWDOVDITEM-XTXLJPNXSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(/C=C/c1cccc(Cl)c1)OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000069890357 221328478 /nfs/dbraw/zinc/32/84/78/221328478.db2.gz QEXIMWDOVDITEM-XTXLJPNXSA-N 1 1 371.864 3.797 50 0 FHAAMO Cc1ccc(-c2cc(C(=O)N3CCC[N@@H+](CC4CC4)[C@H](C(C)C)C3)[nH]n2)o1 ZINC000071416040 221346680 /nfs/dbraw/zinc/34/66/80/221346680.db2.gz FCMUJBUZASOUDD-IBGZPJMESA-N 1 1 370.497 3.561 50 0 FHAAMO Cc1nc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)c(C)o1 ZINC000071404133 221346860 /nfs/dbraw/zinc/34/68/60/221346860.db2.gz SSTBLVBZZHEZFM-IBGZPJMESA-N 1 1 373.472 3.803 50 0 FHAAMO COc1ccc2cc([C@H]3C[N@H+](CCC(=O)NC(C)(C)C)CCO3)ccc2c1 ZINC000071479635 221350757 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FHAAMO CC(C)[C@H]1C[N@@H+](Cc2ccc(O)cc2)CCC(=O)N1Cc1ccc(F)cc1 ZINC000071759739 221366064 /nfs/dbraw/zinc/36/60/64/221366064.db2.gz WQKXFJIJQJCJKM-OAQYLSRUSA-N 1 1 370.468 3.790 50 0 FHAAMO COc1ccc2cc(C(=O)[C@H]3CCC[N@@H+](CCc4cn[nH]c4)C3)ccc2c1 ZINC000071639262 221354425 /nfs/dbraw/zinc/35/44/25/221354425.db2.gz LBUDLSPOYQDAGG-FQEVSTJZSA-N 1 1 363.461 3.709 50 0 FHAAMO Cc1c[nH]c(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1 ZINC000071715313 221354913 /nfs/dbraw/zinc/35/49/13/221354913.db2.gz UJHGLWGYEBYOQF-HXUWFJFHSA-N 1 1 357.473 3.835 50 0 FHAAMO CC(C)(C)OC(=O)[C@@H]([NH3+])Cc1cn(C(=O)OC(C)(C)C)c2ccccc12 ZINC000071788283 221376570 /nfs/dbraw/zinc/37/65/70/221376570.db2.gz HUJOZLUMSHQHDO-HNNXBMFYSA-N 1 1 360.454 3.636 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Cc2ccc(Cl)cc2F)cc1 ZINC000072119350 221407934 /nfs/dbraw/zinc/40/79/34/221407934.db2.gz DJDLWSDHTIFZNN-UHFFFAOYSA-N 1 1 357.816 3.832 50 0 FHAAMO c1cn(Cc2ccccc2)c([C@@H]2CCCN(c3ncnc4c3CCC4)C2)[nH+]1 ZINC000082096289 132194307 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Clc1cccnc1N1CCC[C@H](c2[nH+]ccn2Cc2cscn2)C1 ZINC000095522986 132214194 /nfs/dbraw/zinc/21/41/94/132214194.db2.gz HLZBMADUZRUGKK-ZDUSSCGKSA-N 1 1 359.886 3.820 50 0 FHAAMO c1cn(Cc2ccccn2)c([C@@H]2CCCN(c3ccc4c([nH+]3)CCCC4)C2)n1 ZINC000095526461 132214647 /nfs/dbraw/zinc/21/46/47/132214647.db2.gz UIFOYFHQGZMTPB-LJQANCHMSA-N 1 1 373.504 3.984 50 0 FHAAMO Cc1ccc(N2C(=O)C[C@H](Nc3ccc([NH+]4CCCCC4)cc3)C2=O)cc1 ZINC000101129405 132233572 /nfs/dbraw/zinc/23/35/72/132233572.db2.gz YDDQIEFDZKQVKT-FQEVSTJZSA-N 1 1 363.461 3.729 50 0 FHAAMO OCC[C@H]1CN(c2ccnc3ccc(Cl)cc32)CC[N@H+]1C1CCCC1 ZINC000107012066 132240639 /nfs/dbraw/zinc/24/06/39/132240639.db2.gz XRGFHCPHVDLLQF-KRWDZBQOSA-N 1 1 359.901 3.704 50 0 FHAAMO CC(C)c1nc2sc3c(ncnc3N3CC[NH+](C)CC3)c2c2c1CCC2 ZINC000002410694 132383429 /nfs/dbraw/zinc/38/34/29/132383429.db2.gz NVXYOQCCIOQFFV-UHFFFAOYSA-N 1 1 367.522 3.603 50 0 FHAAMO COc1ccccc1N1CC[NH+](Cc2c[nH]nc2-c2ccc(F)cc2)CC1 ZINC000015923362 132880433 /nfs/dbraw/zinc/88/04/33/132880433.db2.gz 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C[C@H](NC(=O)CC[N@@H+](C)CCOc1ccccc1Cl)c1ccccc1 ZINC000012787967 570760824 /nfs/dbraw/zinc/76/08/24/570760824.db2.gz CTANYJKSQPIVFS-INIZCTEOSA-N 1 1 360.885 3.918 50 0 FHAAMO CCN(C(=O)C[N@@H+]1CCC[C@H]1c1cc(OC)ccc1OC)c1ccccc1 ZINC000012789432 570761280 /nfs/dbraw/zinc/76/12/80/570761280.db2.gz WFVDKTAYHQOTCJ-FQEVSTJZSA-N 1 1 368.477 3.894 50 0 FHAAMO CCN(C(=O)C[N@H+]1CCC[C@H]1c1cc(OC)ccc1OC)c1ccccc1 ZINC000012789432 570761282 /nfs/dbraw/zinc/76/12/82/570761282.db2.gz WFVDKTAYHQOTCJ-FQEVSTJZSA-N 1 1 368.477 3.894 50 0 FHAAMO Cc1cccc(NC(=O)C[N@H+](C)CCC(=O)Nc2cccc(Cl)c2)c1C ZINC000012788132 570761474 /nfs/dbraw/zinc/76/14/74/570761474.db2.gz PSYBDRSTJLAGPC-UHFFFAOYSA-N 1 1 373.884 3.856 50 0 FHAAMO Cc1cccc(NC(=O)C[N@@H+](C)CCC(=O)Nc2cccc(Cl)c2)c1C ZINC000012788132 570761479 /nfs/dbraw/zinc/76/14/79/570761479.db2.gz PSYBDRSTJLAGPC-UHFFFAOYSA-N 1 1 373.884 3.856 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)C2CCC(C)CC2)c(OC)c1 ZINC000012797447 570763056 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3.972 50 0 FHAAMO CSC[C@@H](C)N(C)c1cc(C(C)C)nc(C[N@H+](C)[C@H](C)CSC)n1 ZINC000107364099 570896709 /nfs/dbraw/zinc/89/67/09/570896709.db2.gz SFZDKWXQLFPNND-HUUCEWRRSA-N 1 1 370.632 3.971 50 0 FHAAMO CSC[C@@H](C)N(C)c1cc(C(C)C)nc(C[N@@H+](C)[C@H](C)CSC)n1 ZINC000107364099 570896711 /nfs/dbraw/zinc/89/67/11/570896711.db2.gz SFZDKWXQLFPNND-HUUCEWRRSA-N 1 1 370.632 3.971 50 0 FHAAMO CSc1cccc(C[N@@H+]2CCN(Cc3ccccc3F)[C@@H](CCO)C2)c1 ZINC000019770544 570902376 /nfs/dbraw/zinc/90/23/76/570902376.db2.gz WXZGYIKRYJBXRY-IBGZPJMESA-N 1 1 374.525 3.616 50 0 FHAAMO CSc1cccc(C[N@H+]2CCN(Cc3ccccc3F)[C@@H](CCO)C2)c1 ZINC000019770544 570902379 /nfs/dbraw/zinc/90/23/79/570902379.db2.gz WXZGYIKRYJBXRY-IBGZPJMESA-N 1 1 374.525 3.616 50 0 FHAAMO CCc1nnsc1C(=O)NCc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000048310341 570943915 /nfs/dbraw/zinc/94/39/15/570943915.db2.gz YVYHVDOXTORDBU-GASCZTMLSA-N 1 1 372.538 3.508 50 0 FHAAMO CSc1ccc(C)c(C(=O)NCc2ccnc(-n3cc[nH+]c3C)c2)c1 ZINC000048354482 570949692 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COc1ccc(OCC[NH+]2CCN(c3nc4ccccc4s3)CC2)cc1 ZINC000025369766 570995087 /nfs/dbraw/zinc/99/50/87/570995087.db2.gz PEFURVVBHGURMZ-UHFFFAOYSA-N 1 1 369.490 3.506 50 0 FHAAMO COc1cc2c(cc1OC)C[N@H+](Cn1cnc3cc(C)c(C)cc31)CC2 ZINC000025765499 571000011 /nfs/dbraw/zinc/00/00/11/571000011.db2.gz VTGVSHCIAXHFST-UHFFFAOYSA-N 1 1 351.450 3.686 50 0 FHAAMO COc1cc2c(cc1OC)C[N@@H+](Cn1cnc3cc(C)c(C)cc31)CC2 ZINC000025765499 571000013 /nfs/dbraw/zinc/00/00/13/571000013.db2.gz VTGVSHCIAXHFST-UHFFFAOYSA-N 1 1 351.450 3.686 50 0 FHAAMO Cc1cc(C[N@@H+](C)Cc2cc3c(cc2OC(F)F)OCO3)cc(C)c1O ZINC000225421533 571034127 /nfs/dbraw/zinc/03/41/27/571034127.db2.gz RKTAVWVXJQNYGF-UHFFFAOYSA-N 1 1 365.376 3.971 50 0 FHAAMO Cc1cc(C[N@H+](C)Cc2cc3c(cc2OC(F)F)OCO3)cc(C)c1O ZINC000225421533 571034130 /nfs/dbraw/zinc/03/41/30/571034130.db2.gz RKTAVWVXJQNYGF-UHFFFAOYSA-N 1 1 365.376 3.971 50 0 FHAAMO CC1(C)C(=O)Nc2ccccc2N1C(=O)C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000008320234 571039733 /nfs/dbraw/zinc/03/97/33/571039733.db2.gz 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Cc1ccccc1OCC[N@H+](C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000015099201 211121585 /nfs/dbraw/zinc/12/15/85/211121585.db2.gz RQPUNEFPBIPOFV-UHFFFAOYSA-N 1 1 366.383 3.963 50 0 FHAAMO COc1cc(C[N@H+]2CCC[C@H](Nc3cccc(F)c3)C2)cc(OC)c1O ZINC000015074845 211119266 /nfs/dbraw/zinc/11/92/66/211119266.db2.gz QUKKPORRYITWGA-KRWDZBQOSA-N 1 1 360.429 3.625 50 0 FHAAMO CCN(C[C@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)C1CCCC1 ZINC000014967793 211109253 /nfs/dbraw/zinc/10/92/53/211109253.db2.gz GCHUZGIGOIRLLI-FQEVSTJZSA-N 1 1 372.553 3.988 50 0 FHAAMO COCC[N@@H+](Cc1nc(-c2cc3c(cc2Cl)OCO3)oc1C)C(C)C ZINC000014967733 211109078 /nfs/dbraw/zinc/10/90/78/211109078.db2.gz DIVITEBBGZLLEG-UHFFFAOYSA-N 1 1 366.845 3.889 50 0 FHAAMO Cc1ccc(C[N@@H+]2CCc3nnc(CCc4ccccc4)n3CC2)c(C)c1 ZINC000014887534 211104498 /nfs/dbraw/zinc/10/44/98/211104498.db2.gz DNQMLUABYZTVNX-UHFFFAOYSA-N 1 1 360.505 3.738 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(SC(F)(F)F)cc1)c1ccco1 ZINC000014202145 211085436 /nfs/dbraw/zinc/08/54/36/211085436.db2.gz HSQWKXVKTXQPDG-CYBMUJFWSA-N 1 1 358.385 3.924 50 0 FHAAMO Cc1ccsc1C[N@@H+](C)CCC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000014136427 211077578 /nfs/dbraw/zinc/07/75/78/211077578.db2.gz KLPGVVULAQIUIQ-UHFFFAOYSA-N 1 1 371.506 3.644 50 0 FHAAMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc2ccccc2n1 ZINC000014071433 211070574 /nfs/dbraw/zinc/07/05/74/211070574.db2.gz SLJANTNMDZWMEC-PGRDOPGGSA-N 1 1 357.457 3.991 50 0 FHAAMO CC1CCC(NC(=O)C[NH+]2CCC(c3nc4ccccc4o3)CC2)CC1 ZINC000007988257 210763654 /nfs/dbraw/zinc/76/36/54/210763654.db2.gz BVRWYVXHDYXZOX-UHFFFAOYSA-N 1 1 355.482 3.702 50 0 FHAAMO O=C(OC[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccccc1Br ZINC000004872387 210574665 /nfs/dbraw/zinc/57/46/65/210574665.db2.gz PMZBYYOEWUUODT-XJKSGUPXSA-N 1 1 352.272 3.870 50 0 FHAAMO O=C(C[NH+]1CCCCC1)N1N=C(c2cccs2)C[C@@H]1c1ccc(O)cc1 ZINC000010433983 210371506 /nfs/dbraw/zinc/37/15/06/210371506.db2.gz FNJQFXIMHYYQCK-GOSISDBHSA-N 1 1 369.490 3.617 50 0 FHAAMO O=C(C[NH+]1CCCC1)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000001241049 210338174 /nfs/dbraw/zinc/33/81/74/210338174.db2.gz BSORSBJEHBVCGI-QGZVFWFLSA-N 1 1 357.841 3.707 50 0 FHAAMO Cc1cccn2c(=O)cc(C[NH2+][C@@H](c3cccs3)c3ccccc3)nc12 ZINC000009741210 210337161 /nfs/dbraw/zinc/33/71/61/210337161.db2.gz ZCWZBUDJSQJWNE-HXUWFJFHSA-N 1 1 361.470 3.944 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc(C2SCCS2)cc1)c1ccco1 ZINC000021903072 220370142 /nfs/dbraw/zinc/37/01/42/220370142.db2.gz HAFQTDSEYIJDDG-HNNXBMFYSA-N 1 1 362.520 3.791 50 0 FHAAMO C[NH+](C)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000022075437 220376544 /nfs/dbraw/zinc/37/65/44/220376544.db2.gz DENGAOJHCDVQCM-UHFFFAOYSA-N 1 1 363.299 3.679 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1ccco1 ZINC000023236009 220420416 /nfs/dbraw/zinc/42/04/16/220420416.db2.gz JBHDTJFPJRMOFM-IBGZPJMESA-N 1 1 351.450 3.672 50 0 FHAAMO Fc1cccc(N[C@@H]2CCC[N@@H+](Cc3cnc(N4CCCC4)s3)C2)c1 ZINC000055243153 221062779 /nfs/dbraw/zinc/06/27/79/221062779.db2.gz ZRMYVGCTFKWYIL-QGZVFWFLSA-N 1 1 360.502 3.959 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc2nc(Cc3ccccc3)oc2c1 ZINC000064967896 221159926 /nfs/dbraw/zinc/15/99/26/221159926.db2.gz ZBDDIYKKUDYXPW-GOSISDBHSA-N 1 1 363.461 3.633 50 0 FHAAMO C[N@@H+](Cc1nc(-c2ccc(N3CCCCC3)nc2)no1)C1CCCCC1 ZINC000065215927 221181055 /nfs/dbraw/zinc/18/10/55/221181055.db2.gz PJFIANRCRKHANV-UHFFFAOYSA-N 1 1 355.486 3.886 50 0 FHAAMO Cn1cc(C[NH+]2CCN(C(=O)c3cccc(Cl)c3)CC2)c2ccccc21 ZINC000065330068 221200089 /nfs/dbraw/zinc/20/00/89/221200089.db2.gz YEIISKKILAZYPV-UHFFFAOYSA-N 1 1 367.880 3.790 50 0 FHAAMO C[C@@H]1CCC[N@@H+](Cc2ccc(C(=O)Nc3ccc(CCO)cc3)cc2)C1 ZINC000065381571 221207436 /nfs/dbraw/zinc/20/74/36/221207436.db2.gz SPBUAKQJEDOAQT-QGZVFWFLSA-N 1 1 352.478 3.706 50 0 FHAAMO Cc1c(CO)cccc1NC(=O)c1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000065403598 221213736 /nfs/dbraw/zinc/21/37/36/221213736.db2.gz ZRWRJIAWUOILFQ-INIZCTEOSA-N 1 1 352.478 3.972 50 0 FHAAMO CCn1nc(C)c(NC(=O)C[N@H+](Cc2ccccn2)C2CCCCC2)c1C ZINC000065410044 221216276 /nfs/dbraw/zinc/21/62/76/221216276.db2.gz SKSKSHMPYPUJTM-UHFFFAOYSA-N 1 1 369.513 3.688 50 0 FHAAMO CCn1nc(C)c(NC(=O)C[N@@H+](Cc2ccccn2)C2CCCCC2)c1C ZINC000065410044 221216278 /nfs/dbraw/zinc/21/62/78/221216278.db2.gz SKSKSHMPYPUJTM-UHFFFAOYSA-N 1 1 369.513 3.688 50 0 FHAAMO O=C(Nc1nncs1)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000065423065 221217579 /nfs/dbraw/zinc/21/75/79/221217579.db2.gz XNUKQNYCFFGINX-KRWDZBQOSA-N 1 1 365.462 3.523 50 0 FHAAMO Cc1ccc([C@H](C)NC(=O)c2cc3n(n2)CCC[N@@H+](C(C)C)C3)cc1C ZINC000065431053 221218476 /nfs/dbraw/zinc/21/84/76/221218476.db2.gz QDIXWQDTFCXZQN-KRWDZBQOSA-N 1 1 354.498 3.605 50 0 FHAAMO Cc1ccc([C@H](C)NC(=O)c2cc3n(n2)CCC[N@H+](C(C)C)C3)cc1C ZINC000065431053 221218478 /nfs/dbraw/zinc/21/84/78/221218478.db2.gz QDIXWQDTFCXZQN-KRWDZBQOSA-N 1 1 354.498 3.605 50 0 FHAAMO C[N@H+](Cc1cccc(C(=O)Nc2cccc(F)c2F)c1)C[C@H]1CCCO1 ZINC000065452286 221219883 /nfs/dbraw/zinc/21/98/83/221219883.db2.gz ZDCWDIRDCTWKEI-MRXNPFEDSA-N 1 1 360.404 3.828 50 0 FHAAMO O=C(Nc1nccc2ccccc21)c1ccc(C[N@H+]2CCCOCC2)cc1 ZINC000065456313 221221473 /nfs/dbraw/zinc/22/14/73/221221473.db2.gz MFMASHPULSSIHI-UHFFFAOYSA-N 1 1 361.445 3.709 50 0 FHAAMO CC(C)(C)C[C@H]1CCC[N@H+]1CC(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000065497560 221226852 /nfs/dbraw/zinc/22/68/52/221226852.db2.gz ZUXCQUVTICOGMY-AZUAARDMSA-N 1 1 357.542 3.530 50 0 FHAAMO Cc1ccccc1N1CC[N@@H+](C2CCN(Cc3ccccn3)CC2)[C@H](C)C1 ZINC000065509079 221228788 /nfs/dbraw/zinc/22/87/88/221228788.db2.gz LDTSFISBNZVSTG-HXUWFJFHSA-N 1 1 364.537 3.565 50 0 FHAAMO O=C([C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CCc2sccc2C1 ZINC000065513944 221230235 /nfs/dbraw/zinc/23/02/35/221230235.db2.gz KIDAXZSOYVGJDP-QGZVFWFLSA-N 1 1 358.482 3.684 50 0 FHAAMO CC[N@H+]1CCCC[C@H]1C(=O)N1CCc2onc(-c3ccc(Cl)cc3)c2C1 ZINC000067654499 221266766 /nfs/dbraw/zinc/26/67/66/221266766.db2.gz VWKKZYZJRJDXCV-KRWDZBQOSA-N 1 1 373.884 3.754 50 0 FHAAMO Cc1ccc(-c2cc(O)c3c(c2)C[N@H+](CCCn2cccn2)CCO3)s1 ZINC000067490781 221257862 /nfs/dbraw/zinc/25/78/62/221257862.db2.gz DEJTVJYJZBDBCF-UHFFFAOYSA-N 1 1 369.490 3.910 50 0 FHAAMO CCN(CCc1nc2cc(C)ccc2[nH]1)C(=O)[C@@H]([NH3+])c1ccccc1Cl ZINC000067739541 221278792 /nfs/dbraw/zinc/27/87/92/221278792.db2.gz GBDARZHPZGNXLQ-IBGZPJMESA-N 1 1 370.884 3.616 50 0 FHAAMO CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)[C@@H]([NH3+])c1ccccc1Cl ZINC000067739541 221278795 /nfs/dbraw/zinc/27/87/95/221278795.db2.gz GBDARZHPZGNXLQ-IBGZPJMESA-N 1 1 370.884 3.616 50 0 FHAAMO Cc1ccc(NC(=O)c2cccc(C[N@@H+](C)[C@@H](C)c3ccco3)c2)nn1 ZINC000067804344 221287785 /nfs/dbraw/zinc/28/77/85/221287785.db2.gz DSYBKXFMGKJSEM-HNNXBMFYSA-N 1 1 350.422 3.823 50 0 FHAAMO Cc1ccc(NC(=O)c2cccc(C[N@H+](C)[C@@H](C)c3ccco3)c2)nn1 ZINC000067804344 221287788 /nfs/dbraw/zinc/28/77/88/221287788.db2.gz DSYBKXFMGKJSEM-HNNXBMFYSA-N 1 1 350.422 3.823 50 0 FHAAMO CCNc1cc[nH+]c(NCc2cccnc2Oc2ccc(F)cc2F)n1 ZINC000067847635 221294158 /nfs/dbraw/zinc/29/41/58/221294158.db2.gz ZNYAZULGPZVVAQ-UHFFFAOYSA-N 1 1 357.364 3.986 50 0 FHAAMO COc1cc(NC(=O)C[NH2+][C@@H](C)c2nc3ccccc3[nH]2)ccc1Cl ZINC000067955272 221309244 /nfs/dbraw/zinc/30/92/44/221309244.db2.gz HWERDLMCOLFEPP-NSHDSACASA-N 1 1 358.829 3.514 50 0 FHAAMO O=C(/C=C/c1ccc(Cl)cc1)OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000068852315 221319165 /nfs/dbraw/zinc/31/91/65/221319165.db2.gz PHKSYIGBILJVSP-ZBWUASRJSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(/C=C/c1ccc(Cl)cc1)OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000068852315 221319169 /nfs/dbraw/zinc/31/91/69/221319169.db2.gz PHKSYIGBILJVSP-ZBWUASRJSA-N 1 1 371.864 3.797 50 0 FHAAMO COc1ccc(OC)c(-c2nc(C[N@H+]3CCC[C@H](C(C)(C)O)C3)c(C)o2)c1 ZINC000071422450 221348061 /nfs/dbraw/zinc/34/80/61/221348061.db2.gz KLYNTILUAOVLTO-HNNXBMFYSA-N 1 1 374.481 3.650 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2cccnc2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071614910 221352280 /nfs/dbraw/zinc/35/22/80/221352280.db2.gz DGRKAEMEGGKCSW-FQEVSTJZSA-N 1 1 355.457 3.593 50 0 FHAAMO C[C@@H]1CCC[N@@H+]1Cc1c(C(=O)N2CCCCCCC2)nc2sccn12 ZINC000071575341 221352847 /nfs/dbraw/zinc/35/28/47/221352847.db2.gz IXNOOSNPEZTTRS-OAHLLOKOSA-N 1 1 360.527 3.786 50 0 FHAAMO C[C@@H]1CCC[N@H+]1Cc1c(C(=O)N2CCCCCCC2)nc2sccn12 ZINC000071575341 221352850 /nfs/dbraw/zinc/35/28/50/221352850.db2.gz IXNOOSNPEZTTRS-OAHLLOKOSA-N 1 1 360.527 3.786 50 0 FHAAMO NC(=O)COc1cccc(C[N@H+]2CCC[C@H](CCc3ccc(F)cc3)C2)c1 ZINC000071738521 221357191 /nfs/dbraw/zinc/35/71/91/221357191.db2.gz WTPLQLLNFMZXSR-GOSISDBHSA-N 1 1 370.468 3.535 50 0 FHAAMO COc1c(F)ccc(C(=O)N2CCC[N@@H+](CC3CC3)[C@@H](C(C)C)C2)c1F ZINC000071750675 221362673 /nfs/dbraw/zinc/36/26/73/221362673.db2.gz VBTDWCKHJUAPEB-QGZVFWFLSA-N 1 1 366.452 3.556 50 0 FHAAMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(-c3cc(F)cc(F)c3)nc2)C1 ZINC000071752049 221363348 /nfs/dbraw/zinc/36/33/48/221363348.db2.gz FMGYMKYHMRHEKE-OAHLLOKOSA-N 1 1 373.447 3.735 50 0 FHAAMO Cc1cc(C(F)(F)F)nc(CCn2cc[nH+]c2[C@H]2CCOC(C)(C)C2)n1 ZINC000071735822 221356428 /nfs/dbraw/zinc/35/64/28/221356428.db2.gz LEXCJAWYICWUQB-ZDUSSCGKSA-N 1 1 368.403 3.916 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2cccc3cccnc32)CCC[N@H+]1CC1CC1 ZINC000071779976 221375025 /nfs/dbraw/zinc/37/50/25/221375025.db2.gz BTPVTYUYKZQFHU-FQEVSTJZSA-N 1 1 351.494 3.817 50 0 FHAAMO Cc1nc2c(c(NCC[C@@H](c3ccco3)c3ccc(F)cc3)n1)C[NH2+]C2 ZINC000072148274 221426238 /nfs/dbraw/zinc/42/62/38/221426238.db2.gz MGLQWAKUGXMZMZ-MRXNPFEDSA-N 1 1 352.413 3.754 50 0 FHAAMO Clc1ccc(N2CCC[C@@H](c3[nH+]ccn3Cc3cccnc3)C2)nc1 ZINC000091793143 132203992 /nfs/dbraw/zinc/20/39/92/132203992.db2.gz OWSHTLAMPHOBOS-MRXNPFEDSA-N 1 1 353.857 3.759 50 0 FHAAMO Cc1ccc[nH+]c1N1CCN(C(=O)c2c(C)nccc2-c2ccccc2)CC1 ZINC000095363408 132208064 /nfs/dbraw/zinc/20/80/64/132208064.db2.gz TWCZIGWNVGFGKF-UHFFFAOYSA-N 1 1 372.472 3.723 50 0 FHAAMO CCCCSc1nc(N2CCC[C@@H](OCc3cccnc3)C2)cc(N)[nH+]1 ZINC000095363535 132208141 /nfs/dbraw/zinc/20/81/41/132208141.db2.gz BBBKAWHALFPXFC-MRXNPFEDSA-N 1 1 373.526 3.532 50 0 FHAAMO CCCCSc1nc(N)cc(N2CCC[C@@H](OCc3cccnc3)C2)[nH+]1 ZINC000095363535 132208144 /nfs/dbraw/zinc/20/81/44/132208144.db2.gz BBBKAWHALFPXFC-MRXNPFEDSA-N 1 1 373.526 3.532 50 0 FHAAMO C[N@@H+](CCn1cccn1)C1CCN(c2cccc(-c3cscn3)c2)CC1 ZINC000048087864 136122889 /nfs/dbraw/zinc/12/28/89/136122889.db2.gz NMGLLTPKYCTTFF-UHFFFAOYSA-N 1 1 367.522 3.607 50 0 FHAAMO CC(C)c1nc(N2CCC3(CC2)C[C@H](c2ccccc2)C[N@@H+](C)C3)no1 ZINC000096136120 222039796 /nfs/dbraw/zinc/03/97/96/222039796.db2.gz QCHPEAGZCDNMKA-SFHVURJKSA-N 1 1 354.498 3.899 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000096791703 222130408 /nfs/dbraw/zinc/13/04/08/222130408.db2.gz GKRHOMATCHHPOV-CYBMUJFWSA-N 1 1 368.403 3.942 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000096791703 222130412 /nfs/dbraw/zinc/13/04/12/222130412.db2.gz GKRHOMATCHHPOV-CYBMUJFWSA-N 1 1 368.403 3.942 50 0 FHAAMO C[C@@H]1C[C@@H]1c1ccc(/C=C\C(=O)N2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000096926241 222141200 /nfs/dbraw/zinc/14/12/00/222141200.db2.gz ZEOKUKKJXKXNLI-KCGHDHBMSA-N 1 1 350.462 3.761 50 0 FHAAMO Cc1ccc(C[NH+]2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)s1 ZINC000097032700 222154637 /nfs/dbraw/zinc/15/46/37/222154637.db2.gz CIVQPJAKYSZDHM-MRXNPFEDSA-N 1 1 368.506 3.985 50 0 FHAAMO Cc1ccn(-c2ccccc2NC(=O)NCC[N@H+](C)C2CCCCC2)n1 ZINC000097164738 222165630 /nfs/dbraw/zinc/16/56/30/222165630.db2.gz MVQVFAVYXUJKBR-UHFFFAOYSA-N 1 1 355.486 3.567 50 0 FHAAMO C[C@H]([NH2+]CC(=O)NCc1cccc(Cl)c1)c1nc2c(s1)CCCC2 ZINC000097165644 222166388 /nfs/dbraw/zinc/16/63/88/222166388.db2.gz FYLVPKCJTWWIAX-LBPRGKRZSA-N 1 1 363.914 3.642 50 0 FHAAMO CCc1n[nH]c(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCCCC2)c1C ZINC000097173378 222167808 /nfs/dbraw/zinc/16/78/08/222167808.db2.gz OUHOLSXXSDGKNT-IBGZPJMESA-N 1 1 354.498 3.628 50 0 FHAAMO COc1ccc(NC(=O)N[C@@H]2CCC[N@H+](Cc3cccnc3)C2)cc1Cl ZINC000097294970 222173085 /nfs/dbraw/zinc/17/30/85/222173085.db2.gz SGVYLRBYERRPSJ-MRXNPFEDSA-N 1 1 374.872 3.530 50 0 FHAAMO COc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1Cl ZINC000097294970 222173089 /nfs/dbraw/zinc/17/30/89/222173089.db2.gz SGVYLRBYERRPSJ-MRXNPFEDSA-N 1 1 374.872 3.530 50 0 FHAAMO COc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)cc1OC ZINC000097492905 222184602 /nfs/dbraw/zinc/18/46/02/222184602.db2.gz GJMYWQJHNZDOSB-ZDUSSCGKSA-N 1 1 362.857 3.989 50 0 FHAAMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)cc1OC ZINC000097492905 222184604 /nfs/dbraw/zinc/18/46/04/222184604.db2.gz GJMYWQJHNZDOSB-ZDUSSCGKSA-N 1 1 362.857 3.989 50 0 FHAAMO OCCCCN1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000097495253 222185792 /nfs/dbraw/zinc/18/57/92/222185792.db2.gz FNJSKHLJFMWBQI-UHFFFAOYSA-N 1 1 358.913 3.897 50 0 FHAAMO Clc1nc(N2CCCC2)sc1C[N@@H+]1CCC[C@H](c2ccncn2)C1 ZINC000097604278 222198380 /nfs/dbraw/zinc/19/83/80/222198380.db2.gz AXHAXMIPDRWCAY-ZDUSSCGKSA-N 1 1 363.918 3.566 50 0 FHAAMO Clc1nc(N2CCCC2)sc1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000097604278 222198383 /nfs/dbraw/zinc/19/83/83/222198383.db2.gz AXHAXMIPDRWCAY-ZDUSSCGKSA-N 1 1 363.918 3.566 50 0 FHAAMO Clc1ccc(-c2n[nH]cc2C[N@H+]2CCC[C@@H](Cn3ccnc3)C2)cc1 ZINC000097729553 222207140 /nfs/dbraw/zinc/20/71/40/222207140.db2.gz UHHYJXDORMYOFC-OAHLLOKOSA-N 1 1 355.873 3.839 50 0 FHAAMO CCCc1cc(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCCC2)[nH]n1 ZINC000097785593 222213510 /nfs/dbraw/zinc/21/35/10/222213510.db2.gz HBZZKUWCQFNLMN-IBGZPJMESA-N 1 1 374.916 3.973 50 0 FHAAMO C/C=C\c1ccc(OC[C@H](O)C[N@@H+](C)Cc2sccc2C)c(OC)c1 ZINC000098053917 222222788 /nfs/dbraw/zinc/22/27/88/222222788.db2.gz DHSBVPREELRXGV-KEGWNNHHSA-N 1 1 361.507 3.970 50 0 FHAAMO CCOc1ccc(CN2CC[N@@H+](Cc3ccc(C)s3)C[C@H]2CCO)cc1 ZINC000104528032 222359591 /nfs/dbraw/zinc/35/95/91/222359591.db2.gz VXPMMMFXVZFOIM-LJQANCHMSA-N 1 1 374.550 3.524 50 0 FHAAMO OCC[C@H]1CN(Cc2cccc3cccnc32)CC[N@H+]1CC1CCCCC1 ZINC000107100630 222389911 /nfs/dbraw/zinc/38/99/11/222389911.db2.gz XMAQDSUSYYXBRH-QFIPXVFZSA-N 1 1 367.537 3.684 50 0 FHAAMO COc1ccc(C[N@@H+](CC(=O)NCC(C)C)[C@@H](C)Cc2cccs2)cc1 ZINC000024892312 263387812 /nfs/dbraw/zinc/38/78/12/263387812.db2.gz HNTLBVTZGHBHGD-KRWDZBQOSA-N 1 1 374.550 3.962 50 0 FHAAMO O=C(NCC[N@H+]1CC[C@H](c2ccccc2)C1)Nc1ccnn1C1CCCC1 ZINC000299763213 534341232 /nfs/dbraw/zinc/34/12/32/534341232.db2.gz ZACILBWVPULWBR-SFHVURJKSA-N 1 1 367.497 3.609 50 0 FHAAMO CC(=O)c1ccc(NCc2cc3n(n2)CCC[N@H+](C2CCCCC2)C3)nc1 ZINC000082121557 518386327 /nfs/dbraw/zinc/38/63/27/518386327.db2.gz CSCNLOJHWLOQKQ-UHFFFAOYSA-N 1 1 367.497 3.631 50 0 FHAAMO CCCCOc1ccc(C(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000019913875 520865593 /nfs/dbraw/zinc/86/55/93/520865593.db2.gz JWOFBNVJXZJNFX-UHFFFAOYSA-N 1 1 352.478 3.824 50 0 FHAAMO CCOc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccc([C@H]3C[C@H]3C)o2)cc1 ZINC000252444246 521179415 /nfs/dbraw/zinc/17/94/15/521179415.db2.gz YAYSSCCEOUOSQC-QINHECLXSA-N 1 1 359.466 3.673 50 0 FHAAMO CCCn1ncc(C(=O)N[C@H](CCn2cc[nH+]c2C)c2ccccc2)c1C ZINC000091636563 521671300 /nfs/dbraw/zinc/67/13/00/521671300.db2.gz UGNPZLKATRHHJO-HXUWFJFHSA-N 1 1 365.481 3.668 50 0 FHAAMO CCN1CC[NH+](CCCOc2ccc(Br)cc2C(C)C)CC1 ZINC000020406382 521682089 /nfs/dbraw/zinc/68/20/89/521682089.db2.gz YMOSPFOSJIHZQC-UHFFFAOYSA-N 1 1 369.347 3.979 50 0 FHAAMO CCC[N@@H+](Cc1ccc(C)cc1)CN1C(=O)NC2(C1=O)[C@H](C)CCC[C@H]2C ZINC000252457301 521683318 /nfs/dbraw/zinc/68/33/18/521683318.db2.gz WJDURTDAVDJIHQ-QZTJIDSGSA-N 1 1 371.525 3.911 50 0 FHAAMO CCC[N@H+](Cc1ccc(C)cc1)CN1C(=O)NC2(C1=O)[C@H](C)CCC[C@H]2C ZINC000252457301 521683319 /nfs/dbraw/zinc/68/33/19/521683319.db2.gz WJDURTDAVDJIHQ-QZTJIDSGSA-N 1 1 371.525 3.911 50 0 FHAAMO COc1ccc(/C=C/C[N@H+]2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)cc1 ZINC000091644527 523404738 /nfs/dbraw/zinc/40/47/38/523404738.db2.gz BFXAZNMZQKECHH-WOFSGTTBSA-N 1 1 363.505 3.700 50 0 FHAAMO COCC[N@H+]1CCC[C@H](CN(C)C(=O)c2cc(Cl)c(C)c(Cl)c2)C1 ZINC000091665132 523830381 /nfs/dbraw/zinc/83/03/81/523830381.db2.gz IOTCDBDOUHHABF-CQSZACIVSA-N 1 1 373.324 3.732 50 0 FHAAMO CC[C@H](C)C(=O)NCC[N@@H+]1Cc2ccccc2O[C@H](c2ccccc2)C1 ZINC000019745334 523831625 /nfs/dbraw/zinc/83/16/25/523831625.db2.gz TWNPTKFYBPJEQQ-UWJYYQICSA-N 1 1 352.478 3.785 50 0 FHAAMO Cc1ccc(C[N@H+]2CCN(Cc3cc4ccccc4[nH]3)C[C@@H]2CCO)cc1 ZINC000020452438 524457392 /nfs/dbraw/zinc/45/73/92/524457392.db2.gz VROSALOXWHNWSE-QFIPXVFZSA-N 1 1 363.505 3.545 50 0 FHAAMO Cc1ccc(CNC(=O)CC[C@@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)o1 ZINC000020861976 524500113 /nfs/dbraw/zinc/50/01/13/524500113.db2.gz OVTIHCIEKQCMAV-SFHVURJKSA-N 1 1 366.505 3.864 50 0 FHAAMO Cc1cc(C)n(CCC[N@H+](C)[C@H]2CCCN(CCCc3ccccc3)C2)n1 ZINC000020541222 524517039 /nfs/dbraw/zinc/51/70/39/524517039.db2.gz VLQRPTWYUGEANO-QHCPKHFHSA-N 1 1 368.569 3.919 50 0 FHAAMO Cc1cc(C)n(CCCN(C)[C@H]2CCC[N@H+](CCCc3ccccc3)C2)n1 ZINC000020541222 524517048 /nfs/dbraw/zinc/51/70/48/524517048.db2.gz VLQRPTWYUGEANO-QHCPKHFHSA-N 1 1 368.569 3.919 50 0 FHAAMO Cc1cc(C)n(CCCN(C)[C@H]2CCC[N@@H+](CCCc3ccccc3)C2)n1 ZINC000020541222 524517057 /nfs/dbraw/zinc/51/70/57/524517057.db2.gz VLQRPTWYUGEANO-QHCPKHFHSA-N 1 1 368.569 3.919 50 0 FHAAMO Cc1ccccc1CNC(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000091593232 525157488 /nfs/dbraw/zinc/15/74/88/525157488.db2.gz UEOPYHDLXSUEFN-RBBKRZOGSA-N 1 1 363.505 3.801 50 0 FHAAMO Cc1ccc(NCCCNC(=O)c2csc(-c3cccs3)n2)[nH+]c1 ZINC000082121163 525279327 /nfs/dbraw/zinc/27/93/27/525279327.db2.gz SDXZIXQQHGUBEH-UHFFFAOYSA-N 1 1 358.492 3.807 50 0 FHAAMO Cc1ccc(OCC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)cc1 ZINC000019841954 525380531 /nfs/dbraw/zinc/38/05/31/525380531.db2.gz IRBFMTJWUNRKDD-UHFFFAOYSA-N 1 1 374.484 3.871 50 0 FHAAMO C[C@@H]1c2cccc(C(=O)N[C@H]3CC[N@@H+](Cc4ccccc4)C3)c2O[C@H]1C ZINC000252444150 525716399 /nfs/dbraw/zinc/71/63/99/525716399.db2.gz DOEWPCLDVJVGFT-BQFCYCMXSA-N 1 1 350.462 3.575 50 0 FHAAMO Cc1ccc(-c2cccc(C(=O)N3CCN(c4[nH+]cccc4C)CC3)c2)o1 ZINC000082107209 525757186 /nfs/dbraw/zinc/75/71/86/525757186.db2.gz KFEVOUDYUNTYCH-UHFFFAOYSA-N 1 1 361.445 3.921 50 0 FHAAMO C[C@H](C(=O)NCc1ccccc1)[N@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000089478872 526083623 /nfs/dbraw/zinc/08/36/23/526083623.db2.gz MWZHKIBHHQADGT-QGZVFWFLSA-N 1 1 359.473 3.962 50 0 FHAAMO C[C@H](C(=O)NCc1ccccc1)[N@@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000089478872 526083630 /nfs/dbraw/zinc/08/36/30/526083630.db2.gz MWZHKIBHHQADGT-QGZVFWFLSA-N 1 1 359.473 3.962 50 0 FHAAMO Cc1cc(=O)[nH]c(-c2ccc(C[N@@H+](C)CCn3ccc4ccccc43)cc2)n1 ZINC000020138512 526117436 /nfs/dbraw/zinc/11/74/36/526117436.db2.gz WSLQBYAWVHNAHZ-UHFFFAOYSA-N 1 1 372.472 3.832 50 0 FHAAMO O=C(CCCc1ccccc1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1cccnc1)C2 ZINC000091616930 526459099 /nfs/dbraw/zinc/45/90/99/526459099.db2.gz HUYQLPCRRYAACB-FCHUYYIVSA-N 1 1 363.505 3.527 50 0 FHAAMO O=C(NCc1cc2n(n1)CC[N@H+](C1CCCCC1)C2)c1cccc(Cl)c1 ZINC000082138290 526645587 /nfs/dbraw/zinc/64/55/87/526645587.db2.gz OVBVUMDYGATEPZ-UHFFFAOYSA-N 1 1 372.900 3.615 50 0 FHAAMO Clc1ccc([C@@H]2CCC[N@@H+](Cc3nc(-c4cnccn4)no3)C2)cc1 ZINC000020911825 526961468 /nfs/dbraw/zinc/96/14/68/526961468.db2.gz KYWAOEWYFJTQCE-CQSZACIVSA-N 1 1 355.829 3.560 50 0 FHAAMO Cn1cnnc1[C@H]1CCC[N@@H+](Cc2ncc(-c3cccc(Cl)c3)o2)C1 ZINC000089761913 527535220 /nfs/dbraw/zinc/53/52/20/527535220.db2.gz HOIHZVPHOGGZIG-AWEZNQCLSA-N 1 1 357.845 3.503 50 0 FHAAMO CCOc1cc(Cl)c(C[N@H+]2CCC[C@@H](c3ccncn3)C2)cc1OC ZINC000215228955 568059135 /nfs/dbraw/zinc/05/91/35/568059135.db2.gz LDMSJZIEYFDPJC-CQSZACIVSA-N 1 1 361.873 3.917 50 0 FHAAMO CN1CCN(Cc2ccccc2OCCC[NH+](C)C)[C@@H](c2ccccc2)C1 ZINC000215305330 568062871 /nfs/dbraw/zinc/06/28/71/568062871.db2.gz UJINXVNJZHIJNF-JOCHJYFZSA-N 1 1 367.537 3.506 50 0 FHAAMO c1cc(C[N@@H+]2CCC[C@@H](OCc3ccccn3)C2)sc1C[NH+]1CCCC1 ZINC000215730834 568085987 /nfs/dbraw/zinc/08/59/87/568085987.db2.gz GBDXDRASSJVTJU-LJQANCHMSA-N 1 1 371.550 3.920 50 0 FHAAMO O=C(COc1ccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1)N1CCCC1 ZINC000215769478 568087914 /nfs/dbraw/zinc/08/79/14/568087914.db2.gz ZYWYRYPCZMTNIO-NRFANRHFSA-N 1 1 368.452 3.774 50 0 FHAAMO O=C(COc1ccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1)N1CCCC1 ZINC000215769478 568087915 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CC[N@H+](C[C@H]1COc2ccccc2O1)[C@@H](C)C(=O)Nc1cc(C)ccc1C ZINC000216216464 568113036 /nfs/dbraw/zinc/11/30/36/568113036.db2.gz IPNWDCNBYNXDIZ-ROUUACIJSA-N 1 1 368.477 3.792 50 0 FHAAMO CC[N@@H+](C[C@H]1COc2ccccc2O1)[C@@H](C)C(=O)Nc1cc(C)ccc1C ZINC000216216464 568113037 /nfs/dbraw/zinc/11/30/37/568113037.db2.gz IPNWDCNBYNXDIZ-ROUUACIJSA-N 1 1 368.477 3.792 50 0 FHAAMO C[N@@H+](Cc1c(Cl)cncc1Cl)C[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000216385541 568121126 /nfs/dbraw/zinc/12/11/26/568121126.db2.gz GQDYJJWYVIGWOW-GFCCVEGCSA-N 1 1 356.297 3.611 50 0 FHAAMO C[N@H+](Cc1c(Cl)cncc1Cl)C[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000216385541 568121127 /nfs/dbraw/zinc/12/11/27/568121127.db2.gz GQDYJJWYVIGWOW-GFCCVEGCSA-N 1 1 356.297 3.611 50 0 FHAAMO C[C@H](CNC(=O)/C=C/c1ccc(Cl)cc1Cl)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000032429815 568389957 /nfs/dbraw/zinc/38/99/57/568389957.db2.gz BHCQBEMURIRTJE-OVMWZURDSA-N 1 1 371.308 3.621 50 0 FHAAMO CCCC[N@H+]1CCc2nc[nH]c2C12CCN(C(=O)c1csc(C)c1)CC2 ZINC000091808405 570439528 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3.718 50 0 FHAAMO O=C(C[N@@H+](Cc1ccc(F)cc1)C1CC1)NCCc1cccc(Cl)c1 ZINC000007789652 571289088 /nfs/dbraw/zinc/28/90/88/571289088.db2.gz HQGNHFVNGIOGLC-UHFFFAOYSA-N 1 1 360.860 3.802 50 0 FHAAMO O=C(C[N@H+](Cc1ccc(F)cc1)C1CC1)NCCc1cccc(Cl)c1 ZINC000007789652 571289089 /nfs/dbraw/zinc/28/90/89/571289089.db2.gz HQGNHFVNGIOGLC-UHFFFAOYSA-N 1 1 360.860 3.802 50 0 FHAAMO CN(Cc1cccc(O)c1)C(=O)NC[C@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000584894877 571315253 /nfs/dbraw/zinc/31/52/53/571315253.db2.gz BGNCHHJEYHMZHS-GOSISDBHSA-N 1 1 359.514 3.578 50 0 FHAAMO COc1cccc(OC)c1CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000095435782 571329575 /nfs/dbraw/zinc/32/95/75/571329575.db2.gz VMSJZEUHXMUBOJ-PKOBYXMFSA-N 1 1 354.494 3.847 50 0 FHAAMO CCN1CC[NH+]([C@@H](C)CNc2ccc3ccc(Cl)c(Cl)c3n2)CC1 ZINC000095986615 571333502 /nfs/dbraw/zinc/33/35/02/571333502.db2.gz GNYOCVOWJLTFBO-ZDUSSCGKSA-N 1 1 367.324 3.980 50 0 FHAAMO C[C@@H]([NH2+][C@H](C)c1cccc(-n2ccnc2)c1)c1nc(-c2cccnc2)no1 ZINC000096007202 571333893 /nfs/dbraw/zinc/33/38/93/571333893.db2.gz KQEAFUDTBMLIGI-HUUCEWRRSA-N 1 1 360.421 3.729 50 0 FHAAMO O=C(c1ccc(-n2cccc2)cc1)N1CC[C@H]([N@H+]2CCc3ccccc3C2)C1 ZINC000225686401 571337822 /nfs/dbraw/zinc/33/78/22/571337822.db2.gz BMHNMPJCQOWJBC-QHCPKHFHSA-N 1 1 371.484 3.750 50 0 FHAAMO CCOc1ccc(-n2cc(-c3ccccc3)c3c2nc[nH+]c3NCCO)cc1 ZINC000002715202 571340465 /nfs/dbraw/zinc/34/04/65/571340465.db2.gz TWDBFOLKYHMAKS-UHFFFAOYSA-N 1 1 374.444 3.890 50 0 FHAAMO CCC[N@@H+]1CCc2nc(NC(=O)COc3ccc(Cl)cc3)sc2C1 ZINC000056928507 571342223 /nfs/dbraw/zinc/34/22/23/571342223.db2.gz HVHNEEKYLKBMNP-UHFFFAOYSA-N 1 1 365.886 3.582 50 0 FHAAMO CCC[N@H+]1CCc2nc(NC(=O)COc3ccc(Cl)cc3)sc2C1 ZINC000056928507 571342224 /nfs/dbraw/zinc/34/22/24/571342224.db2.gz HVHNEEKYLKBMNP-UHFFFAOYSA-N 1 1 365.886 3.582 50 0 FHAAMO COc1ccc([C@@H]2CCCCC[N@@H+]2CN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000057292082 571342515 /nfs/dbraw/zinc/34/25/15/571342515.db2.gz AFKNQPGFUQEQFS-ZCNNSNEGSA-N 1 1 368.477 3.521 50 0 FHAAMO COc1ccc([C@@H]2CCCCC[N@H+]2CN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000057292082 571342516 /nfs/dbraw/zinc/34/25/16/571342516.db2.gz AFKNQPGFUQEQFS-ZCNNSNEGSA-N 1 1 368.477 3.521 50 0 FHAAMO COCC[NH2+][C@H](C(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000057406007 571343209 /nfs/dbraw/zinc/34/32/09/571343209.db2.gz MAGXHZFDCIHPCN-INIZCTEOSA-N 1 1 352.356 3.621 50 0 FHAAMO COc1ccccc1[C@@H](C)[NH2+]Cc1nc2ccc(Cl)cc2n1CCO ZINC000057838568 571345595 /nfs/dbraw/zinc/34/55/95/571345595.db2.gz SOVRIRFPZUDHGT-CYBMUJFWSA-N 1 1 359.857 3.541 50 0 FHAAMO C[C@@H](C(=O)NCC1CCCCC1)[N@H+](C)Cc1ccc(Br)cc1 ZINC000003417156 571349326 /nfs/dbraw/zinc/34/93/26/571349326.db2.gz QJCHHMVRPCRHFA-AWEZNQCLSA-N 1 1 367.331 3.966 50 0 FHAAMO C[C@@H](C(=O)NCC1CCCCC1)[N@@H+](C)Cc1ccc(Br)cc1 ZINC000003417156 571349327 /nfs/dbraw/zinc/34/93/27/571349327.db2.gz QJCHHMVRPCRHFA-AWEZNQCLSA-N 1 1 367.331 3.966 50 0 FHAAMO O=S(=O)(CC1CCCC1)NCC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000670442289 571349566 /nfs/dbraw/zinc/34/95/66/571349566.db2.gz GVLPFLVADNVGTL-HXUWFJFHSA-N 1 1 364.555 3.541 50 0 FHAAMO C[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1cnoc1-c1ccccc1 ZINC000670444737 571349992 /nfs/dbraw/zinc/34/99/92/571349992.db2.gz IRSAAEIUISAJJT-MRXNPFEDSA-N 1 1 361.445 3.518 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(F)c(F)c2F)cc1 ZINC000003454155 571350002 /nfs/dbraw/zinc/35/00/02/571350002.db2.gz IPADQFUMWWGLDG-NSHDSACASA-N 1 1 352.356 3.572 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(F)c(F)c2F)cc1 ZINC000003454155 571350003 /nfs/dbraw/zinc/35/00/03/571350003.db2.gz IPADQFUMWWGLDG-NSHDSACASA-N 1 1 352.356 3.572 50 0 FHAAMO C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](C[N@@H+](C)CCc4ccccn4)[C@H]3C=C12 ZINC000003999464 571353743 /nfs/dbraw/zinc/35/37/43/571353743.db2.gz WKHUDKYPKFTYKS-IVVFSKFDSA-N 1 1 368.521 3.870 50 0 biogenic FHAAMO COc1ccc(/C=C/C(=O)OC[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1OC ZINC000004029538 571354266 /nfs/dbraw/zinc/35/42/66/571354266.db2.gz QROSMYNPMUCJFW-QWXXHLNBSA-N 1 1 359.466 3.525 50 0 biogenic FHAAMO O=C(Cn1c2ccccc2nc1C[NH+]1CCCCCC1)N1CCCCCC1 ZINC000031903409 571354394 /nfs/dbraw/zinc/35/43/94/571354394.db2.gz ZATSFLPRFLOWIW-UHFFFAOYSA-N 1 1 368.525 3.815 50 0 FHAAMO C[C@@H](OC[C@H](O)C[N@@H+](C)CCOc1ccccc1)c1ccc(Cl)cc1 ZINC000004195223 571356718 /nfs/dbraw/zinc/35/67/18/571356718.db2.gz OCSMUQVEZDDREZ-VQIMIIECSA-N 1 1 363.885 3.789 50 0 FHAAMO O=C(CCn1ccc2ccc(F)cc21)NC[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000229716294 571357186 /nfs/dbraw/zinc/35/71/86/571357186.db2.gz LOCALLAVIUZBAU-MJGOQNOKSA-N 1 1 357.473 3.551 50 0 FHAAMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cc(F)c(F)cc1Cl ZINC000032398971 571357354 /nfs/dbraw/zinc/35/73/54/571357354.db2.gz NAZJJXDGSSYEEN-UHFFFAOYSA-N 1 1 364.823 3.796 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc(COc2ccccc2)cc1)c1ccco1 ZINC000008073448 571358816 /nfs/dbraw/zinc/35/88/16/571358816.db2.gz BALZYVQIJNUVFD-FQEVSTJZSA-N 1 1 364.445 3.891 50 0 FHAAMO Cc1onc(-c2ccccc2)c1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000008230203 571359936 /nfs/dbraw/zinc/35/99/36/571359936.db2.gz WLKXPFYSYAXVCM-QGZVFWFLSA-N 1 1 365.433 3.810 50 0 FHAAMO CC1=C(CC[N@@H+]2CCc3nnc([C@@H]4CCCO4)n3CC2)C(C)(C)CCC1 ZINC000023191448 937119136 /nfs/dbraw/zinc/11/91/36/937119136.db2.gz ZRWVTIFFOYXTDK-SFHVURJKSA-N 1 1 358.530 3.904 50 0 FHAAMO CC[C@@H](C)n1ncc(NC(=O)N2CC[NH+](Cc3ccccc3C)CC2)c1C ZINC000332311453 945169446 /nfs/dbraw/zinc/16/94/46/945169446.db2.gz SYCNKRBNDDKMBR-QGZVFWFLSA-N 1 1 369.513 3.821 50 0 FHAAMO Cc1ccnc(C)c1NC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000332542927 945227930 /nfs/dbraw/zinc/22/79/30/945227930.db2.gz YDIVRRSMRUXPBL-IYBDPMFKSA-N 1 1 353.466 3.560 50 0 FHAAMO Cc1ccnc(C)c1NC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000332542927 945227937 /nfs/dbraw/zinc/22/79/37/945227937.db2.gz YDIVRRSMRUXPBL-IYBDPMFKSA-N 1 1 353.466 3.560 50 0 FHAAMO CCC[C@@]1(COC)CCC[N@H+]1Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000194942070 940268614 /nfs/dbraw/zinc/26/86/14/940268614.db2.gz VSAGRJNRXJOXRP-SFHVURJKSA-N 1 1 351.397 3.796 50 0 FHAAMO C[C@H](c1nc2ccccc2n1CC(=O)N1CCCCCC1)[NH+]1CCCCC1 ZINC000082086971 941766664 /nfs/dbraw/zinc/76/66/64/941766664.db2.gz GADKGXYQLRQSGC-GOSISDBHSA-N 1 1 368.525 3.986 50 0 FHAAMO CCN(CC)C(=O)N1CCC[C@@H](Cc2[nH+]cc(C)n2Cc2ccccc2)C1 ZINC000257190928 942656123 /nfs/dbraw/zinc/65/61/23/942656123.db2.gz OGUFSWWLJNQYIK-FQEVSTJZSA-N 1 1 368.525 3.956 50 0 FHAAMO O=C(Nc1cccc(Cl)c1)[C@@H]1OCC[N@H+](C2CC2)[C@H]1c1ccccc1 ZINC000675009696 943601662 /nfs/dbraw/zinc/60/16/62/943601662.db2.gz CPELPULHLZYKNI-RBUKOAKNSA-N 1 1 356.853 3.883 50 0 FHAAMO O=C(Nc1cccc(Cl)c1)[C@@H]1OCC[N@@H+](C2CC2)[C@H]1c1ccccc1 ZINC000675009696 943601666 /nfs/dbraw/zinc/60/16/66/943601666.db2.gz CPELPULHLZYKNI-RBUKOAKNSA-N 1 1 356.853 3.883 50 0 FHAAMO CC(C)C(=O)N1CCc2nc[nH]c2[C@@H]1C1CC[NH+](CC2CCCCC2)CC1 ZINC000675012428 943610920 /nfs/dbraw/zinc/61/09/20/943610920.db2.gz KXHXAZGIFVAGQD-NRFANRHFSA-N 1 1 372.557 3.784 50 0 FHAAMO CC[C@H](OC1CCCCC1)C(=O)N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000329932134 944309215 /nfs/dbraw/zinc/30/92/15/944309215.db2.gz AYNAHVNTOBYQLO-IBGZPJMESA-N 1 1 360.498 3.888 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1[C@H](C)c1nnc(-c2cccs2)o1 ZINC000107497332 945665931 /nfs/dbraw/zinc/66/59/31/945665931.db2.gz MBGFXOQJLABIOG-RBSFLKMASA-N 1 1 374.510 3.725 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1[C@H](C)c1nnc(-c2cccs2)o1 ZINC000107497332 945665938 /nfs/dbraw/zinc/66/59/38/945665938.db2.gz MBGFXOQJLABIOG-RBSFLKMASA-N 1 1 374.510 3.725 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1[C@H](C)c1nnc(-c2cccs2)o1 ZINC000107497327 945666373 /nfs/dbraw/zinc/66/63/73/945666373.db2.gz MBGFXOQJLABIOG-QLFBSQMISA-N 1 1 374.510 3.725 50 0 FHAAMO CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1[C@H](C)c1nnc(-c2cccs2)o1 ZINC000107497327 945666376 /nfs/dbraw/zinc/66/63/76/945666376.db2.gz MBGFXOQJLABIOG-QLFBSQMISA-N 1 1 374.510 3.725 50 0 FHAAMO COCC[NH+]1CCC(C[N@@H+](Cc2ccncc2)Cc2ccccc2F)CC1 ZINC000011816529 210102719 /nfs/dbraw/zinc/10/27/19/210102719.db2.gz UDNDKQKEPFEJEB-UHFFFAOYSA-N 1 1 371.500 3.581 50 0 FHAAMO COCC[NH+]1CCC(CN(Cc2ccncc2)Cc2ccccc2F)CC1 ZINC000011816529 210102722 /nfs/dbraw/zinc/10/27/22/210102722.db2.gz UDNDKQKEPFEJEB-UHFFFAOYSA-N 1 1 371.500 3.581 50 0 FHAAMO CCc1ncc(CN2CC[C@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cn1 ZINC000055107985 210067472 /nfs/dbraw/zinc/06/74/72/210067472.db2.gz XSGXKXWQUNQVHE-HSZRJFAPSA-N 1 1 364.537 3.570 50 0 FHAAMO CC(=O)N(C)c1cccc(NC(=O)N2CCC[N@H+](C3CCCCC3)CC2)c1 ZINC000299802314 210042947 /nfs/dbraw/zinc/04/29/47/210042947.db2.gz ZUZBXXPGRJHDOK-UHFFFAOYSA-N 1 1 372.513 3.542 50 0 FHAAMO Cc1ccccc1C[N@H+]1CC[C@H](CNC(=O)Nc2cccnc2Cl)C1 ZINC000299787186 210028773 /nfs/dbraw/zinc/02/87/73/210028773.db2.gz VKHOQBRUWJBYDL-OAHLLOKOSA-N 1 1 358.873 3.687 50 0 FHAAMO CC(=O)c1[nH]c(C)c(C(=O)NC[C@@H](c2ccc(F)cc2)[NH+]2CCCC2)c1C ZINC000299782325 210024507 /nfs/dbraw/zinc/02/45/07/210024507.db2.gz DNXPKJOSHMXFSE-SFHVURJKSA-N 1 1 371.456 3.540 50 0 FHAAMO O=C(NCC[N@H+]1CC[C@H](c2ccccc2)C1)c1cccc(-c2ccncc2)c1 ZINC000299781953 210025713 /nfs/dbraw/zinc/02/57/13/210025713.db2.gz DFZPISJSVBJWOM-QHCPKHFHSA-N 1 1 371.484 3.968 50 0 FHAAMO O=C(NCc1cc(F)cc(F)c1)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299775145 210020672 /nfs/dbraw/zinc/02/06/72/210020672.db2.gz ABUXIRRZFMWEMW-ZCNNSNEGSA-N 1 1 356.416 3.807 50 0 FHAAMO COc1ccccc1CCNC(=O)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299772765 210019466 /nfs/dbraw/zinc/01/94/66/210019466.db2.gz BWWYJXUHLMQUTQ-HBMCJLEFSA-N 1 1 364.489 3.580 50 0 FHAAMO Fc1ccccc1Cn1nc(C[NH2+]Cc2cccnc2)c(-c2ccccc2)n1 ZINC000261492500 223074441 /nfs/dbraw/zinc/07/44/41/223074441.db2.gz DBJOSUMNIDIDEI-UHFFFAOYSA-N 1 1 373.435 3.817 50 0 FHAAMO O=C(NCc1cc(F)cc(F)c1)C1=CC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000064818087 212044993 /nfs/dbraw/zinc/04/49/93/212044993.db2.gz URKBCYYCEFSWOX-UHFFFAOYSA-N 1 1 360.379 3.552 50 0 FHAAMO Cc1ccc2nc(C[N@H+](Cc3ccc(F)cc3)CC(C)C)cc(=O)n2c1 ZINC000064590863 212040879 /nfs/dbraw/zinc/04/08/79/212040879.db2.gz GZZHTSPWRSAYAS-UHFFFAOYSA-N 1 1 353.441 3.800 50 0 FHAAMO COc1c2ccc(Cl)cc2sc1C(=O)N1CC[NH+](CC(C)C)CC1 ZINC000064756796 212043286 /nfs/dbraw/zinc/04/32/86/212043286.db2.gz TYFSFXNKNFEQOP-UHFFFAOYSA-N 1 1 366.914 3.977 50 0 FHAAMO CCSc1ncc(CN(CCc2ccccc2)C2CC[NH+](C)CC2)cn1 ZINC000063857766 212035802 /nfs/dbraw/zinc/03/58/02/212035802.db2.gz YDMHYHXYUIHKGG-UHFFFAOYSA-N 1 1 370.566 3.728 50 0 FHAAMO CCSc1ncc(C[N@@H+](CCc2ccccc2)C2CCN(C)CC2)cn1 ZINC000063857766 212035798 /nfs/dbraw/zinc/03/57/98/212035798.db2.gz YDMHYHXYUIHKGG-UHFFFAOYSA-N 1 1 370.566 3.728 50 0 FHAAMO Cc1cccc(-c2ncc(C[NH2+]CC(=O)Nc3cc(F)ccc3C)cn2)c1 ZINC000063832154 212033938 /nfs/dbraw/zinc/03/39/38/212033938.db2.gz XKTUUDFDQNTIOX-UHFFFAOYSA-N 1 1 364.424 3.628 50 0 FHAAMO CCCn1cc(C[N@H+]2CCC[C@@H](C(=O)c3cccc(OC)c3)C2)c(C)n1 ZINC000012712186 220019175 /nfs/dbraw/zinc/01/91/75/220019175.db2.gz MYPHROJFUCQNJH-GOSISDBHSA-N 1 1 355.482 3.705 50 0 FHAAMO Cc1ccc(-n2cc(C[N@H+]3CCC[C@H](O)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000012709320 220019328 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O=C(N[C@H]1CCC[N@@H+](CC2CCCCC2)C1)c1ccccc1-c1ncc[nH]1 ZINC000015079029 211121755 /nfs/dbraw/zinc/12/17/55/211121755.db2.gz DLYYQOBAJBATQP-SFHVURJKSA-N 1 1 366.509 3.851 50 0 FHAAMO COc1ccc(-n2ncc([C@H](C)[NH2+]Cc3cnc(SC)nc3)c2C)cc1 ZINC000015079508 211121049 /nfs/dbraw/zinc/12/10/49/211121049.db2.gz ZJTZJWGYLDBIIW-ZDUSSCGKSA-N 1 1 369.494 3.552 50 0 FHAAMO CCOC(=O)[C@]1(Cc2cccc(Cl)c2)CCC[N@H+](Cc2ccon2)C1 ZINC000015075473 211120111 /nfs/dbraw/zinc/12/01/11/211120111.db2.gz LALXDEYVCAJJKY-IBGZPJMESA-N 1 1 362.857 3.716 50 0 FHAAMO CCOC(=O)[C@]1(Cc2cccc(Cl)c2)CCC[N@@H+](Cc2ccon2)C1 ZINC000015075473 211120117 /nfs/dbraw/zinc/12/01/17/211120117.db2.gz LALXDEYVCAJJKY-IBGZPJMESA-N 1 1 362.857 3.716 50 0 FHAAMO Cc1c([C@H](C)[NH2+]C2CCN(C(C)C)CC2)cnn1-c1ccc(F)cc1F ZINC000015073554 211119167 /nfs/dbraw/zinc/11/91/67/211119167.db2.gz SSEZWWQLAFCTRG-AWEZNQCLSA-N 1 1 362.468 3.982 50 0 FHAAMO O=C1N(Cc2ccc(F)cc2)CCC[C@]12CC[N@@H+](CCc1ccccc1)C2 ZINC000015067110 211118045 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C[C@@H]([NH2+][C@H](C(=O)N1CCOCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000030282963 571046921 /nfs/dbraw/zinc/04/69/21/571046921.db2.gz SXUKIRXCUQIQLF-BEFAXECRSA-N 1 1 358.869 3.591 50 0 FHAAMO C[NH+]1CCN(C(=S)c2cn(Cc3cccc(F)c3)c3ccccc23)CC1 ZINC000004140365 571049975 /nfs/dbraw/zinc/04/99/75/571049975.db2.gz JINAMQIRPMDXCD-UHFFFAOYSA-N 1 1 367.493 3.752 50 0 FHAAMO O=C(C[NH+]1CCCC1)N1N=C(c2cccs2)C[C@@H]1c1ccc(F)cc1 ZINC000004165335 571052292 /nfs/dbraw/zinc/05/22/92/571052292.db2.gz SHWJUNVMCDIWBP-QGZVFWFLSA-N 1 1 357.454 3.661 50 0 FHAAMO Fc1ccc(-c2ccc(C[NH2+]Cc3cccnc3N3CCOCC3)o2)cc1 ZINC000030901638 571052761 /nfs/dbraw/zinc/05/27/61/571052761.db2.gz KQTNMHVTBKEEDC-UHFFFAOYSA-N 1 1 367.424 3.607 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(-c2ccncc2)nc2ccccc21 ZINC000004669111 571060951 /nfs/dbraw/zinc/06/09/51/571060951.db2.gz HBCPLIQRZKIHJN-KRWDZBQOSA-N 1 1 374.488 3.901 50 0 FHAAMO Cc1ccc(Nc2cc(N3CCN(C(=O)C(C)(C)C)CC3)nc(C)[nH+]2)cc1 ZINC000033014150 571061128 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CC(=O)c1cccc(OC[C@@H](O)C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000034870244 571075033 /nfs/dbraw/zinc/07/50/33/571075033.db2.gz VZAHBJUSERMORJ-GUYCJALGSA-N 1 1 363.404 3.600 50 0 FHAAMO C[C@@H](C(=O)NCc1cccs1)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000012751320 571076375 /nfs/dbraw/zinc/07/63/75/571076375.db2.gz QXNPTQZACLLSSC-LBPRGKRZSA-N 1 1 356.413 3.904 50 0 FHAAMO C[C@@H](C(=O)NCc1cccs1)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000012751320 571076378 /nfs/dbraw/zinc/07/63/78/571076378.db2.gz QXNPTQZACLLSSC-LBPRGKRZSA-N 1 1 356.413 3.904 50 0 FHAAMO C[C@H]1CCC[N@@H+](CCNC(=O)COc2ccc3oc4ccccc4c3c2)C1 ZINC000040110345 571078545 /nfs/dbraw/zinc/07/85/45/571078545.db2.gz ZCKKCXSLJYWNNT-INIZCTEOSA-N 1 1 366.461 3.813 50 0 FHAAMO COc1cc(Br)cc(C[NH2+]Cc2ccncc2)c1OC(C)C ZINC000040728596 571093638 /nfs/dbraw/zinc/09/36/38/571093638.db2.gz OCKXHWGQJMEYGA-UHFFFAOYSA-N 1 1 365.271 3.930 50 0 FHAAMO CC[C@@H](C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccccc1 ZINC000040157053 571087666 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FHAAMO CC[N@H+](CCN(C)CC(F)(F)F)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000084774747 571099754 /nfs/dbraw/zinc/09/97/54/571099754.db2.gz VMBXFNQLZPJGIL-UHFFFAOYSA-N 1 1 359.367 3.797 50 0 FHAAMO CC[N@@H+](CCN(C)CC(F)(F)F)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000084774747 571099757 /nfs/dbraw/zinc/09/97/57/571099757.db2.gz VMBXFNQLZPJGIL-UHFFFAOYSA-N 1 1 359.367 3.797 50 0 FHAAMO CCOC(=O)CCCCCCC(=O)c1ccccc1CN1CC[NH+](C)CC1 ZINC000043211790 571099991 /nfs/dbraw/zinc/09/99/91/571099991.db2.gz KSDPIWLYIDOADJ-UHFFFAOYSA-N 1 1 374.525 3.520 50 0 FHAAMO c1cc(-c2noc([C@@H]3C[N@H+](Cc4ccccc4)C[C@]34CCOC4)n2)cs1 ZINC000685942152 571102980 /nfs/dbraw/zinc/10/29/80/571102980.db2.gz FGQCMTOVLJGTGR-PXNSSMCTSA-N 1 1 367.474 3.804 50 0 FHAAMO CSC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2Br)OCCO3)C1 ZINC000240551510 571108899 /nfs/dbraw/zinc/10/88/99/571108899.db2.gz GUGYAOFROGZCCM-GFCCVEGCSA-N 1 1 372.328 3.795 50 0 FHAAMO O=C(c1ccccn1)[C@@H]1CCC[N@H+](Cc2cncn2C2CCCCC2)C1 ZINC000241081854 571109378 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0 FHAAMO CCOc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2c(C)nn(CC)c2C)cc1 ZINC000244678539 571114157 /nfs/dbraw/zinc/11/41/57/571114157.db2.gz IFMKOEKRYCOCGN-HNNXBMFYSA-N 1 1 358.486 3.550 50 0 FHAAMO CCOc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2c(C)nn(CC)c2C)cc1 ZINC000244678539 571114159 /nfs/dbraw/zinc/11/41/59/571114159.db2.gz IFMKOEKRYCOCGN-HNNXBMFYSA-N 1 1 358.486 3.550 50 0 FHAAMO CC(C)n1ccnc1[C@H]1CCC[N@@H+](Cc2cnc(-c3ccccn3)nc2)C1 ZINC000244652038 571114288 /nfs/dbraw/zinc/11/42/88/571114288.db2.gz GYQMDHPJWVTJFM-SFHVURJKSA-N 1 1 362.481 3.696 50 0 FHAAMO O=C(CC[N@H+]1CCCC[C@H]1c1nc2cc(F)ccc2[nH]1)Nc1cccnc1 ZINC000244673839 571114315 /nfs/dbraw/zinc/11/43/15/571114315.db2.gz HWNGDJCNJJGPKA-SFHVURJKSA-N 1 1 367.428 3.653 50 0 FHAAMO O=C(CC[N@@H+]1CCCC[C@H]1c1nc2cc(F)ccc2[nH]1)Nc1cccnc1 ZINC000244673839 571114317 /nfs/dbraw/zinc/11/43/17/571114317.db2.gz HWNGDJCNJJGPKA-SFHVURJKSA-N 1 1 367.428 3.653 50 0 FHAAMO COc1cccc(-c2nc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)c(C)o2)c1 ZINC000244659699 571114379 /nfs/dbraw/zinc/11/43/79/571114379.db2.gz HHJZIIATGRBVSL-MRXNPFEDSA-N 1 1 352.438 3.761 50 0 FHAAMO C[C@H](OC[C@@H](O)CNCCC[NH+]1CCCCCC1)c1ccc(Cl)cc1 ZINC000006051594 571114808 /nfs/dbraw/zinc/11/48/08/571114808.db2.gz DNXUXQKZKCFGGZ-PXNSSMCTSA-N 1 1 368.949 3.634 50 0 FHAAMO CSc1cccc(C[N@@H+](C)CCC(=O)Nc2nnc(C3CC3)s2)c1 ZINC000244723774 571115411 /nfs/dbraw/zinc/11/54/11/571115411.db2.gz MHEULEITMNNPNO-UHFFFAOYSA-N 1 1 362.524 3.598 50 0 FHAAMO CCN(Cc1cccnc1)C[C@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000055100491 571116618 /nfs/dbraw/zinc/11/66/18/571116618.db2.gz ZBPWXTYNSHDKAJ-JOCHJYFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@@H+](Cc1cccnc1)C[C@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055100491 571116631 /nfs/dbraw/zinc/11/66/31/571116631.db2.gz ZBPWXTYNSHDKAJ-JOCHJYFZSA-N 1 1 367.537 3.867 50 0 FHAAMO CC[N@H+](Cc1cccnc1)C[C@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055100491 571116635 /nfs/dbraw/zinc/11/66/35/571116635.db2.gz ZBPWXTYNSHDKAJ-JOCHJYFZSA-N 1 1 367.537 3.867 50 0 FHAAMO Cc1ccc([C@H](CNC(=O)c2cccc(-c3ccc(O)cc3)c2)[NH+](C)C)o1 ZINC000055211737 571117979 /nfs/dbraw/zinc/11/79/79/571117979.db2.gz ONJWIRQKCCRAKK-FQEVSTJZSA-N 1 1 364.445 3.993 50 0 FHAAMO C[C@H](CO)C[N@@H+](Cc1nn(C)c2cccc(Cl)c12)Cc1ccccc1 ZINC000055370812 571119882 /nfs/dbraw/zinc/11/98/82/571119882.db2.gz UPMVYFMMOGCCNW-HNNXBMFYSA-N 1 1 357.885 3.857 50 0 FHAAMO Cc1c(NCc2ccccn2)cccc1C(=O)N(C)C[C@H]1CCCC[N@H+]1C ZINC000055368954 571120024 /nfs/dbraw/zinc/12/00/24/571120024.db2.gz CSNZTCJILPMZDP-LJQANCHMSA-N 1 1 366.509 3.558 50 0 FHAAMO Cc1cccc(N2CCN(C(=O)C[N@H+]3CCC[C@@H]3c3cccs3)CC2)c1 ZINC000010055650 571122288 /nfs/dbraw/zinc/12/22/88/571122288.db2.gz JMUUDBFRJZZYLF-LJQANCHMSA-N 1 1 369.534 3.542 50 0 FHAAMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1 ZINC000248163195 571128359 /nfs/dbraw/zinc/12/83/59/571128359.db2.gz MRFYOPSNBPJVAS-QGZVFWFLSA-N 1 1 356.514 3.746 50 0 FHAAMO Cc1ccc(NC(=O)C[C@@H]2C=CCC2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000058208644 571128790 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354.450 3.504 50 0 FHAAMO CC[C@H](NC(=O)N[C@H]1CCC[N@@H+](CC)C1)c1ccccc1OC(F)F ZINC000052526921 571146157 /nfs/dbraw/zinc/14/61/57/571146157.db2.gz WAAUDJCZRCGXOQ-ZFWWWQNUSA-N 1 1 355.429 3.523 50 0 FHAAMO Cc1noc(C(C)C)c1C(=O)NC[C@@H](C(C)C)[N@H+]1CCc2ccccc2C1 ZINC000025540758 571148654 /nfs/dbraw/zinc/14/86/54/571148654.db2.gz QVZRBLKJRORIKY-IBGZPJMESA-N 1 1 369.509 3.919 50 0 FHAAMO Cc1ccc(F)c(C(=O)N2CC[NH+]([C@H]3CCc4ccccc4C3)CC2)c1F ZINC000072119585 571170065 /nfs/dbraw/zinc/17/00/65/571170065.db2.gz VRCUCXHOLSTRGL-SFHVURJKSA-N 1 1 370.443 3.589 50 0 FHAAMO OC[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 ZINC000072120880 571170115 /nfs/dbraw/zinc/17/01/15/571170115.db2.gz CVENJRORGGSIBY-GOSISDBHSA-N 1 1 370.276 3.963 50 0 FHAAMO CC(C)Cn1cncc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 ZINC000072134578 571171295 /nfs/dbraw/zinc/17/12/95/571171295.db2.gz ZQMUUDHSCLKZOU-DNVJHFABSA-N 1 1 364.537 3.601 50 0 FHAAMO CC(C)Cn1cncc1CN1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000072134578 571171296 /nfs/dbraw/zinc/17/12/96/571171296.db2.gz ZQMUUDHSCLKZOU-DNVJHFABSA-N 1 1 364.537 3.601 50 0 FHAAMO C[NH+](C)[C@H](CNS(=O)(=O)/C=C/c1ccccc1)c1cc2ccccc2o1 ZINC000575620313 571172650 /nfs/dbraw/zinc/17/26/50/571172650.db2.gz JKERZUFFBVMBCK-QFQMRYFISA-N 1 1 370.474 3.626 50 0 FHAAMO COc1cccc(OC[C@@H]2CCC[N@@H+](Cc3ccc(O)c(OC)c3)C2)c1 ZINC000072164367 571176474 /nfs/dbraw/zinc/17/64/74/571176474.db2.gz ZQORNXSFFUMLOW-QGZVFWFLSA-N 1 1 357.450 3.700 50 0 FHAAMO Cc1ccccc1N1CCC[N@@H+](Cc2sc(N(C)C)nc2Cl)CC1 ZINC000072166627 571176729 /nfs/dbraw/zinc/17/67/29/571176729.db2.gz VBASXPHAMKAWLU-UHFFFAOYSA-N 1 1 364.946 3.883 50 0 FHAAMO Cc1ccccc1N1CCC[N@H+](Cc2sc(N(C)C)nc2Cl)CC1 ZINC000072166627 571176730 /nfs/dbraw/zinc/17/67/30/571176730.db2.gz VBASXPHAMKAWLU-UHFFFAOYSA-N 1 1 364.946 3.883 50 0 FHAAMO Cc1nc(C[N@H+]2CCC[C@@H](Cc3nc4ccccc4[nH]3)C2)c2ccccn12 ZINC000072168179 571176987 /nfs/dbraw/zinc/17/69/87/571176987.db2.gz DTYOXKYZWSFLKY-KRWDZBQOSA-N 1 1 359.477 3.974 50 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Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ncc(C(C)(C)C)o3)C2)n1 ZINC000054205121 571204208 /nfs/dbraw/zinc/20/42/08/571204208.db2.gz ANZRQLMNPUJROX-OAHLLOKOSA-N 1 1 356.470 3.526 50 0 FHAAMO Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ncc(C(C)(C)C)o3)C2)n1 ZINC000054205121 571204212 /nfs/dbraw/zinc/20/42/12/571204212.db2.gz ANZRQLMNPUJROX-OAHLLOKOSA-N 1 1 356.470 3.526 50 0 FHAAMO O=C(c1cccc(-c2ccnc3ccccc32)c1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000534673034 571208662 /nfs/dbraw/zinc/20/86/62/571208662.db2.gz RUYJAJICAHSFNV-LJQANCHMSA-N 1 1 357.457 3.822 50 0 FHAAMO CN(C[C@H]1CCCC[N@H+]1C)C(=O)c1cccc(-c2cnc(N)c(Cl)c2)c1 ZINC000534673025 571208764 /nfs/dbraw/zinc/20/87/64/571208764.db2.gz FOQHSKAMJGNONG-QGZVFWFLSA-N 1 1 372.900 3.541 50 0 FHAAMO CC[NH+](CC)CCC[C@@H](C)NCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000006552425 571209094 /nfs/dbraw/zinc/20/90/94/571209094.db2.gz MJLYHNZPHXBZLC-CQSZACIVSA-N 1 1 350.894 3.990 50 0 FHAAMO C[N@H+](Cc1cc(-c2cccnc2)no1)Cc1ccc(-c2cc[nH]n2)s1 ZINC000077436701 571211504 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CCc1nc(C[N@@H+]2CCC[C@]3(CCC(=O)N(CCC(C)C)C3)C2)cs1 ZINC000077521346 571214646 /nfs/dbraw/zinc/21/46/46/571214646.db2.gz BJMCVLFEQDRFAO-FQEVSTJZSA-N 1 1 363.571 3.956 50 0 FHAAMO CCc1nc(C[N@H+]2CCC[C@]3(CCC(=O)N(CCC(C)C)C3)C2)cs1 ZINC000077521346 571214647 /nfs/dbraw/zinc/21/46/47/571214647.db2.gz BJMCVLFEQDRFAO-FQEVSTJZSA-N 1 1 363.571 3.956 50 0 FHAAMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(-c2cccc([C@H](C)O)c2)cc1 ZINC000426405092 571220830 /nfs/dbraw/zinc/22/08/30/571220830.db2.gz FXPCMLUBELQGRI-INIZCTEOSA-N 1 1 363.461 3.732 50 0 FHAAMO O=C1CC[C@]2(CCC[N@@H+](Cc3ccoc3)C2)CN1CCc1ccccc1 ZINC000082091261 571227892 /nfs/dbraw/zinc/22/78/92/571227892.db2.gz BGNKXPMYGNNLFA-QFIPXVFZSA-N 1 1 352.478 3.727 50 0 FHAAMO CCOc1cc(C[N@H+]2CCC[C@@]3(CCC(=O)N(C(C)C)C3)C2)ccc1OC ZINC000082137231 571229017 /nfs/dbraw/zinc/22/90/17/571229017.db2.gz NJVDDIYMNTUNSF-JOCHJYFZSA-N 1 1 374.525 3.707 50 0 FHAAMO O=C1Nc2ccccc2NC12CC[NH+](Cc1cc(F)ccc1Cl)CC2 ZINC000082138871 571229224 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Cc1ccc(-c2ccc(C(=O)N(C)Cc3ccc4c(c3)C[N@H+](C)C4)cc2)nn1 ZINC000426621530 571233564 /nfs/dbraw/zinc/23/35/64/571233564.db2.gz BJTIUWWEKVYADB-UHFFFAOYSA-N 1 1 372.472 3.670 50 0 FHAAMO CC(C)c1noc([C@H]2CCC[N@@H+](Cc3cc(=O)c4cccc(F)c4[nH]3)C2)n1 ZINC000091304739 571238754 /nfs/dbraw/zinc/23/87/54/571238754.db2.gz IMYMASDLCHCTQI-ZDUSSCGKSA-N 1 1 370.428 3.966 50 0 FHAAMO O=C(c1ccncc1)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2cc3ccccc3o2)C1 ZINC000091350651 571239224 /nfs/dbraw/zinc/23/92/24/571239224.db2.gz AOCUBXXOCFABST-VQIMIIECSA-N 1 1 361.445 3.564 50 0 FHAAMO O=C(C1CCC1)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccc3cc(F)ccc3n2)C1 ZINC000091416560 571239516 /nfs/dbraw/zinc/23/95/16/571239516.db2.gz FHQXMFURENSEJJ-FOIQADDNSA-N 1 1 367.468 3.597 50 0 FHAAMO CCOc1cc([C@H]2Nc3sc4c(c3C(=O)N2)CC[N@H+](CC)C4)ccc1O ZINC000006654912 571239568 /nfs/dbraw/zinc/23/95/68/571239568.db2.gz BZYPFOJGBZDNAZ-QGZVFWFLSA-N 1 1 373.478 3.659 50 0 FHAAMO CCn1cc[nH+]c1[C@H]1CCCN(Cc2c(F)c(F)c(OC)c(F)c2F)C1 ZINC000091459867 571239869 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Cn1cc(C[N@@H+](CCO)Cc2cccs2)c(-c2cccc(Cl)c2)n1 ZINC000013593449 220077458 /nfs/dbraw/zinc/07/74/58/220077458.db2.gz UQHLCJBGNFXAFS-UHFFFAOYSA-N 1 1 361.898 3.797 50 0 FHAAMO COc1cccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc4c3OCO4)C2)c1 ZINC000013595521 220077733 /nfs/dbraw/zinc/07/77/33/220077733.db2.gz HVXNIIQYPDBWGY-MRXNPFEDSA-N 1 1 353.418 3.519 50 0 FHAAMO NC(=O)[C@@H](c1ccccc1)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000014167532 220112796 /nfs/dbraw/zinc/11/27/96/220112796.db2.gz ZCFODGVQGJYKPO-GOSISDBHSA-N 1 1 351.475 3.702 50 0 FHAAMO Clc1ccc(C[N@H+]2CCc3nnc(CCc4ccccc4)n3CC2)cc1 ZINC000014881612 220135618 /nfs/dbraw/zinc/13/56/18/220135618.db2.gz VFFNBAXBDUEZAS-UHFFFAOYSA-N 1 1 366.896 3.775 50 0 FHAAMO Clc1ccc(C[N@@H+]2CCc3nnc(CCc4ccccc4)n3CC2)cc1 ZINC000014881612 220135622 /nfs/dbraw/zinc/13/56/22/220135622.db2.gz VFFNBAXBDUEZAS-UHFFFAOYSA-N 1 1 366.896 3.775 50 0 FHAAMO COc1ccc2c(c1)O[C@H](C)C[N@H+](CCC(=O)NCCC1=CCCCC1)C2 ZINC000014989244 220140223 /nfs/dbraw/zinc/14/02/23/220140223.db2.gz LHOQURZIGKVJPP-QGZVFWFLSA-N 1 1 372.509 3.675 50 0 FHAAMO Cc1ccc2c(c1)C[N@H+](CCC(=O)N[C@@H]1CCc3ccccc31)C[C@H](C)O2 ZINC000015006795 220140603 /nfs/dbraw/zinc/14/06/03/220140603.db2.gz HEKVYKQLHIMKBV-LAUBAEHRSA-N 1 1 364.489 3.772 50 0 FHAAMO O=C(CC[C@@H]1CCC[N@H+](Cc2ccc(CO)o2)C1)Nc1ccccc1F ZINC000015075580 220146185 /nfs/dbraw/zinc/14/61/85/220146185.db2.gz KBTWQXIBHAMNKB-HNNXBMFYSA-N 1 1 360.429 3.542 50 0 FHAAMO O=C(c1ccoc1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(F)c(F)c1)C2 ZINC000015067600 220143845 /nfs/dbraw/zinc/14/38/45/220143845.db2.gz HKNCDVCLYKOFLE-FQEVSTJZSA-N 1 1 360.404 3.686 50 0 FHAAMO CCOC(=O)[C@]1(CCc2ccccc2)CCC[N@H+](Cc2nccs2)C1 ZINC000015065099 220144712 /nfs/dbraw/zinc/14/47/12/220144712.db2.gz VGNFHKQWWIZWON-FQEVSTJZSA-N 1 1 358.507 3.921 50 0 FHAAMO CCOC(=O)[C@]1(CCc2ccccc2)CCC[N@@H+](Cc2nccs2)C1 ZINC000015065099 220144717 /nfs/dbraw/zinc/14/47/17/220144717.db2.gz VGNFHKQWWIZWON-FQEVSTJZSA-N 1 1 358.507 3.921 50 0 FHAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3ccc(C)o3)C2)cc1 ZINC000015070634 220145457 /nfs/dbraw/zinc/14/54/57/220145457.db2.gz LSXVVCCMILNBQX-HXUWFJFHSA-N 1 1 356.510 3.983 50 0 FHAAMO CCc1onc(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(OC)c(OC)c1OC ZINC000015866933 220170309 /nfs/dbraw/zinc/17/03/09/220170309.db2.gz CYFZCNNSJGJCFP-HNNXBMFYSA-N 1 1 360.454 3.908 50 0 FHAAMO CCc1onc(C)c1[C@@H]1CCC[N@H+]1Cc1ccc(OC)c(OC)c1OC ZINC000015866933 220170311 /nfs/dbraw/zinc/17/03/11/220170311.db2.gz CYFZCNNSJGJCFP-HNNXBMFYSA-N 1 1 360.454 3.908 50 0 FHAAMO Cc1cc(Br)cc(C)c1OCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000016247465 220181460 /nfs/dbraw/zinc/18/14/60/220181460.db2.gz DTJDPJMEWKKTEO-GASCZTMLSA-N 1 1 356.304 3.944 50 0 FHAAMO COc1ccc(OC)c([C@H](C)NC(=O)C[N@H+](C)[C@@H](C)c2cccs2)c1 ZINC000016435207 220183443 /nfs/dbraw/zinc/18/34/43/220183443.db2.gz NRNDIIDAOMAEFD-KBPBESRZSA-N 1 1 362.495 3.636 50 0 FHAAMO COc1ccc(OC)c([C@H](C)NC(=O)C[N@@H+](C)[C@@H](C)c2cccs2)c1 ZINC000016435207 220183447 /nfs/dbraw/zinc/18/34/47/220183447.db2.gz NRNDIIDAOMAEFD-KBPBESRZSA-N 1 1 362.495 3.636 50 0 FHAAMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@H+](C)CC(=O)Nc1cccc(Cl)c1 ZINC000017305749 220214264 /nfs/dbraw/zinc/21/42/64/220214264.db2.gz CILUAEBDXVUJAZ-AWEZNQCLSA-N 1 1 369.856 3.552 50 0 FHAAMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)CC(=O)Nc1cccc(Cl)c1 ZINC000017305749 220214267 /nfs/dbraw/zinc/21/42/67/220214267.db2.gz CILUAEBDXVUJAZ-AWEZNQCLSA-N 1 1 369.856 3.552 50 0 FHAAMO Cc1cc(C)n(CCNC(=O)c2ccc([C@@H]3CCC[N@@H+]3C(C)C)s2)n1 ZINC000019114357 220235338 /nfs/dbraw/zinc/23/53/38/220235338.db2.gz IMHGGNRQARSOKD-INIZCTEOSA-N 1 1 360.527 3.537 50 0 FHAAMO Cc1cc(NC(=O)C[N@@H+](C)Cc2ccc(Cl)cc2)n(-c2ccccc2)n1 ZINC000019534606 220268871 /nfs/dbraw/zinc/26/88/71/220268871.db2.gz QNFJVTIYWDJGIF-UHFFFAOYSA-N 1 1 368.868 3.905 50 0 FHAAMO Cc1cc(NC(=O)C[N@H+](C)Cc2ccc(Cl)cc2)n(-c2ccccc2)n1 ZINC000019534606 220268874 /nfs/dbraw/zinc/26/88/74/220268874.db2.gz QNFJVTIYWDJGIF-UHFFFAOYSA-N 1 1 368.868 3.905 50 0 FHAAMO COc1cccc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)c1OC ZINC000019536494 220269793 /nfs/dbraw/zinc/26/97/93/220269793.db2.gz DWOCUGRAUJEHPE-JXMROGBWSA-N 1 1 352.478 3.535 50 0 FHAAMO Cc1ccc(N2C(=O)C[C@H]([NH2+]Cc3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000019794705 220295850 /nfs/dbraw/zinc/29/58/50/220295850.db2.gz BZVREWRJOCTICC-INIZCTEOSA-N 1 1 363.244 3.724 50 0 FHAAMO c1ccc(C[N@H+]2CC[C@@H](N3CCc4onc(-c5ccccc5)c4C3)C2)cc1 ZINC000019835857 220300947 /nfs/dbraw/zinc/30/09/47/220300947.db2.gz HFFUQRHSUXRNPU-HXUWFJFHSA-N 1 1 359.473 3.974 50 0 FHAAMO Cc1cc(C(=O)N2CC[NH+](C3c4ccccc4-c4ccccc43)CC2)no1 ZINC000019835181 220300991 /nfs/dbraw/zinc/30/09/91/220300991.db2.gz HZHPQEGNPPFHAJ-UHFFFAOYSA-N 1 1 359.429 3.511 50 0 FHAAMO Cc1c2cccc(F)c2oc1C(=O)NC[C@@H]1Cc2ccccc2C[N@H+]1C ZINC000020206960 220318549 /nfs/dbraw/zinc/31/85/49/220318549.db2.gz GQZUKJXMQHRGIO-INIZCTEOSA-N 1 1 352.409 3.667 50 0 FHAAMO Cc1c2cccc(F)c2oc1C(=O)NC[C@@H]1Cc2ccccc2C[N@@H+]1C ZINC000020206960 220318552 /nfs/dbraw/zinc/31/85/52/220318552.db2.gz GQZUKJXMQHRGIO-INIZCTEOSA-N 1 1 352.409 3.667 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCNc1ncnc2onc(-c3ccc(F)cc3)c21 ZINC000020574494 220332870 /nfs/dbraw/zinc/33/28/70/220332870.db2.gz NCZRYOGAPQOJBY-ZDUSSCGKSA-N 1 1 355.417 3.710 50 0 FHAAMO COc1c2c(cc3c1[C@H](c1c[nH]c4ccc(C)cc41)[N@H+](C)CC3)OCO2 ZINC000020759109 220340106 /nfs/dbraw/zinc/34/01/06/220340106.db2.gz CQYGCOBNUPWBOY-IBGZPJMESA-N 1 1 350.418 3.791 50 0 FHAAMO COc1c2c(cc3c1[C@H](c1c[nH]c4ccc(C)cc41)[N@@H+](C)CC3)OCO2 ZINC000020759109 220340109 /nfs/dbraw/zinc/34/01/09/220340109.db2.gz CQYGCOBNUPWBOY-IBGZPJMESA-N 1 1 350.418 3.791 50 0 FHAAMO CCCC12CN3CC(CCC)(C[NH+](C1)C31C3CC4CC(C3)CC1C4)C2=O ZINC000020894182 220344707 /nfs/dbraw/zinc/34/47/07/220344707.db2.gz FJQOKENQYBLHNY-UHFFFAOYSA-N 1 1 356.554 3.926 50 0 FHAAMO OCC[C@@H]1CN(Cc2ccccc2C(F)(F)F)CC[N@H+]1C1CCCC1 ZINC000020915100 220346398 /nfs/dbraw/zinc/34/63/98/220346398.db2.gz BTGXRUHLKNVTCF-QGZVFWFLSA-N 1 1 356.432 3.517 50 0 FHAAMO OCC[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)CC[N@H+]1C1CCCC1 ZINC000020999066 220348083 /nfs/dbraw/zinc/34/80/83/220348083.db2.gz MPXVTRLBCRXHKM-GOSISDBHSA-N 1 1 356.432 3.517 50 0 FHAAMO C[N@@H+](CCCNC(=O)c1cccc2c1SCCC2=O)Cc1ccccc1 ZINC000021102990 220350620 /nfs/dbraw/zinc/35/06/20/220350620.db2.gz JIFIQEPCVVKFSG-UHFFFAOYSA-N 1 1 368.502 3.617 50 0 FHAAMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)sc2Cl)C[C@H](C)O1 ZINC000021058357 220350641 /nfs/dbraw/zinc/35/06/41/220350641.db2.gz GRYMIBSKCIVZBF-UWVGGRQHSA-N 1 1 365.326 3.673 50 0 FHAAMO CN(C(=O)Cn1c(C[NH+]2CCCCC2)nc2ccccc21)c1ccccc1 ZINC000021783139 220365637 /nfs/dbraw/zinc/36/56/37/220365637.db2.gz AAWQTHKIXYRLMR-UHFFFAOYSA-N 1 1 362.477 3.685 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000022028227 220374447 /nfs/dbraw/zinc/37/44/47/220374447.db2.gz VVPDYJONODNUES-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO CN(C)CC[NH2+][C@H](C(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000022038827 220375365 /nfs/dbraw/zinc/37/53/65/220375365.db2.gz WKJNSQMRGYJUCZ-KRWDZBQOSA-N 1 1 365.399 3.536 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)Cc3cccc(F)c3)n2)C1 ZINC000022292959 220382365 /nfs/dbraw/zinc/38/23/65/220382365.db2.gz HNYRXLGOGIJRKX-OKILXGFUSA-N 1 1 361.486 3.941 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)Cc3cccc(F)c3)n2)C1 ZINC000022292959 220382367 /nfs/dbraw/zinc/38/23/67/220382367.db2.gz HNYRXLGOGIJRKX-OKILXGFUSA-N 1 1 361.486 3.941 50 0 FHAAMO COc1ccccc1[C@H](CNC(=O)CSc1ccccc1C)[NH+](C)C ZINC000022678891 220394569 /nfs/dbraw/zinc/39/45/69/220394569.db2.gz HMYSMSSDFKTZAS-KRWDZBQOSA-N 1 1 358.507 3.515 50 0 FHAAMO COc1ccc(Cl)cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000022678362 220394625 /nfs/dbraw/zinc/39/46/25/220394625.db2.gz PAZYOHQDMRCDJI-INIZCTEOSA-N 1 1 362.857 3.899 50 0 FHAAMO Cc1cccc(C[NH+]2CCN([C@@H](C)c3nnc(-c4cccs4)o3)CC2)c1 ZINC000022802616 220398101 /nfs/dbraw/zinc/39/81/01/220398101.db2.gz YJLMNFCFYXKAHL-INIZCTEOSA-N 1 1 368.506 3.985 50 0 FHAAMO COc1ccccc1CC(=O)NCc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000040107119 220881667 /nfs/dbraw/zinc/88/16/67/220881667.db2.gz JNVOCKAOYRORCC-GOSISDBHSA-N 1 1 366.505 3.786 50 0 FHAAMO COc1cc(NC(=O)C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)cc(OC)c1 ZINC000048303168 221006308 /nfs/dbraw/zinc/00/63/08/221006308.db2.gz FLQXHAUZBHIHEQ-NRFANRHFSA-N 1 1 366.461 3.794 50 0 FHAAMO C[N@H+](CC(=O)N[C@H]1CCOc2ccccc21)Cc1csc2ccccc12 ZINC000052805927 221040439 /nfs/dbraw/zinc/04/04/39/221040439.db2.gz MDHUKIIMPZZVGT-SFHVURJKSA-N 1 1 366.486 3.973 50 0 FHAAMO C[N@@H+](CC(=O)N[C@H]1CCOc2ccccc21)Cc1csc2ccccc12 ZINC000052805927 221040442 /nfs/dbraw/zinc/04/04/42/221040442.db2.gz MDHUKIIMPZZVGT-SFHVURJKSA-N 1 1 366.486 3.973 50 0 FHAAMO CC(=O)Nc1ccc(NC(=O)C[N@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000053139558 221043828 /nfs/dbraw/zinc/04/38/28/221043828.db2.gz PSNLOQZATBAQCX-UHFFFAOYSA-N 1 1 355.438 3.621 50 0 FHAAMO CC(=O)Nc1ccc(NC(=O)C[N@@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000053139558 221043832 /nfs/dbraw/zinc/04/38/32/221043832.db2.gz PSNLOQZATBAQCX-UHFFFAOYSA-N 1 1 355.438 3.621 50 0 FHAAMO C[N@@H+](CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)C1CCCC1 ZINC000053436576 221045956 /nfs/dbraw/zinc/04/59/56/221045956.db2.gz WRFGSSBDWZSGOQ-MRXNPFEDSA-N 1 1 357.479 3.893 50 0 FHAAMO C[N@@H+](CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)C1CCCC1 ZINC000053436535 221046303 /nfs/dbraw/zinc/04/63/03/221046303.db2.gz RQVDPMBGQIZIRC-MRXNPFEDSA-N 1 1 357.479 3.893 50 0 FHAAMO Cc1nn(C)c(C)c1CCC(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000053720647 221048697 /nfs/dbraw/zinc/04/86/97/221048697.db2.gz CQMISUFOZAPIMQ-MRXNPFEDSA-N 1 1 368.525 3.983 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@@H](COCc2ccccc2)C1)Nc1ccc(F)cc1F ZINC000056908431 221082131 /nfs/dbraw/zinc/08/21/31/221082131.db2.gz ZBRZHIOBZFOIQT-QGZVFWFLSA-N 1 1 374.431 3.832 50 0 FHAAMO O=C(C[N@H+]1CCC[C@@H](COCc2ccccc2)C1)Nc1ccc(F)cc1F ZINC000056908431 221082134 /nfs/dbraw/zinc/08/21/34/221082134.db2.gz ZBRZHIOBZFOIQT-QGZVFWFLSA-N 1 1 374.431 3.832 50 0 FHAAMO COc1ccc([C@H]2CCCCC[N@@H+]2CN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000057292083 221085809 /nfs/dbraw/zinc/08/58/09/221085809.db2.gz AFKNQPGFUQEQFS-HSALFYBXSA-N 1 1 368.477 3.521 50 0 FHAAMO COc1ccc([C@H]2CCCCC[N@H+]2CN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)cc1 ZINC000057292083 221085811 /nfs/dbraw/zinc/08/58/11/221085811.db2.gz AFKNQPGFUQEQFS-HSALFYBXSA-N 1 1 368.477 3.521 50 0 FHAAMO Cc1ccccc1[C@@]1(O)CC[N@@H+](Cc2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000055393269 221068360 /nfs/dbraw/zinc/06/83/60/221068360.db2.gz OJTRCLBNOBEJBP-OAQYLSRUSA-N 1 1 351.425 3.618 50 0 FHAAMO C[C@@H](C1CC1)[N@@H+](C)CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000058191909 221104650 /nfs/dbraw/zinc/10/46/50/221104650.db2.gz UFNPLQOOUIAGRW-ZDUSSCGKSA-N 1 1 357.479 3.669 50 0 FHAAMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(O)CC2)cc1Cl ZINC000057405960 221087490 /nfs/dbraw/zinc/08/74/90/221087490.db2.gz NDBFHRYKGXIGFW-LJQANCHMSA-N 1 1 358.869 3.785 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1Cl ZINC000057524927 221090673 /nfs/dbraw/zinc/09/06/73/221090673.db2.gz QBYPOSVCEHMYMB-CQSZACIVSA-N 1 1 371.868 3.756 50 0 FHAAMO C[N@H+](Cc1ccccc1)C[C@H](O)Cn1c2ccccc2nc1C(F)(F)F ZINC000060343650 221129478 /nfs/dbraw/zinc/12/94/78/221129478.db2.gz WIYHIGVTWYZILZ-HNNXBMFYSA-N 1 1 363.383 3.548 50 0 FHAAMO Cc1ccccc1C[NH+]1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1 ZINC000058288924 221112768 /nfs/dbraw/zinc/11/27/68/221112768.db2.gz XTYXKQHBBHNPAC-SFHVURJKSA-N 1 1 362.477 3.924 50 0 FHAAMO O=C(N[C@H]1CCOc2ccccc21)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000058423468 221118696 /nfs/dbraw/zinc/11/86/96/221118696.db2.gz LHSJRDOYLDHFDF-XLIONFOSSA-N 1 1 368.452 3.678 50 0 FHAAMO O=C(NCCc1ccc(F)cc1)Nc1ccccc1C[NH+]1CCSCC1 ZINC000061789547 221135663 /nfs/dbraw/zinc/13/56/63/221135663.db2.gz UUUNGJSPYTZSJJ-UHFFFAOYSA-N 1 1 373.497 3.739 50 0 FHAAMO CCn1cnnc1[C@H]1CCC[N@H+](Cc2ccc(Br)s2)C1 ZINC000065287723 221196007 /nfs/dbraw/zinc/19/60/07/221196007.db2.gz VGKMNCCKUWHQBK-NSHDSACASA-N 1 1 355.305 3.502 50 0 FHAAMO CCn1cnnc1[C@H]1CCC[N@@H+](Cc2ccc(Br)s2)C1 ZINC000065287723 221196012 /nfs/dbraw/zinc/19/60/12/221196012.db2.gz VGKMNCCKUWHQBK-NSHDSACASA-N 1 1 355.305 3.502 50 0 FHAAMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@@H]2c2cccnc2)c(OC)c1 ZINC000065375341 221206757 /nfs/dbraw/zinc/20/67/57/221206757.db2.gz LUQFYTGSVTULER-LJQANCHMSA-N 1 1 369.465 3.655 50 0 FHAAMO CN(C)CC(C)(C)C[N@@H+]1CC[C@H](c2ccnc(-c3cccc(O)c3)c2)C1 ZINC000065464046 221223030 /nfs/dbraw/zinc/22/30/30/221223030.db2.gz ANGDNBFSOMQAEQ-IBGZPJMESA-N 1 1 353.510 3.831 50 0 FHAAMO CN(C)CC(C)(C)C[N@H+]1CC[C@H](c2ccnc(-c3cccc(O)c3)c2)C1 ZINC000065464046 221223032 /nfs/dbraw/zinc/22/30/32/221223032.db2.gz ANGDNBFSOMQAEQ-IBGZPJMESA-N 1 1 353.510 3.831 50 0 FHAAMO Cc1ccsc1[C@@H]1CC[N@@H+](Cc2ccnn2-c2ccccc2)C[C@H]1O ZINC000065492361 221226247 /nfs/dbraw/zinc/22/62/47/221226247.db2.gz GINUIWUNJHVMFD-RTBURBONSA-N 1 1 353.491 3.593 50 0 FHAAMO Cc1c(C[N@@H+](C)Cc2cccc3ncccc23)c(=O)n(-c2ccccc2)n1C ZINC000065503204 221226863 /nfs/dbraw/zinc/22/68/63/221226863.db2.gz YLUOJWCYLNDJGC-UHFFFAOYSA-N 1 1 372.472 3.665 50 0 FHAAMO Cc1cccnc1-n1nc(C2CC2)nc1-c1cnc(C[NH+]2CCCC2)s1 ZINC000065505825 221228306 /nfs/dbraw/zinc/22/83/06/221228306.db2.gz HWLTYUJQWVXJTK-UHFFFAOYSA-N 1 1 366.494 3.567 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@](C)(CO)C3)c(C)o2)c(OC)c1C ZINC000067489961 221257605 /nfs/dbraw/zinc/25/76/05/221257605.db2.gz RBAAXKTVEXXYRL-NRFANRHFSA-N 1 1 374.481 3.570 50 0 FHAAMO O=C(Nc1ccc2ncsc2c1)c1cccc(C[N@@H+]2CCC[C@H](O)C2)c1 ZINC000067513556 221257653 /nfs/dbraw/zinc/25/76/53/221257653.db2.gz AMLSSGHUMBHLEU-KRWDZBQOSA-N 1 1 367.474 3.505 50 0 FHAAMO C[N@H+]1CCCC[C@@H]1CCNC(=O)c1ccc(-c2cccc3ncccc32)nc1 ZINC000067587592 221260331 /nfs/dbraw/zinc/26/03/31/221260331.db2.gz NCHVGJXNMDXZNY-GOSISDBHSA-N 1 1 374.488 3.901 50 0 FHAAMO Cc1ccc(NC(=O)c2cccc(C[N@@H+](C)[C@H](C)c3ccco3)c2)nn1 ZINC000067804345 221286811 /nfs/dbraw/zinc/28/68/11/221286811.db2.gz DSYBKXFMGKJSEM-OAHLLOKOSA-N 1 1 350.422 3.823 50 0 FHAAMO Cc1ccc(NC(=O)c2cccc(C[N@H+](C)[C@H](C)c3ccco3)c2)nn1 ZINC000067804345 221286813 /nfs/dbraw/zinc/28/68/13/221286813.db2.gz DSYBKXFMGKJSEM-OAHLLOKOSA-N 1 1 350.422 3.823 50 0 FHAAMO CN(C)C(=O)CC[N@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067883893 221300720 /nfs/dbraw/zinc/30/07/20/221300720.db2.gz FWFRKNSJXIBIOF-UHFFFAOYSA-N 1 1 374.488 3.580 50 0 FHAAMO O[C@@H]1CCCC[C@H]1n1cc(C2=CC[N@@H+](CCc3ccccc3)CC2)cn1 ZINC000067894705 221303220 /nfs/dbraw/zinc/30/32/20/221303220.db2.gz CSLZXJQYFVAXSV-FGZHOGPDSA-N 1 1 351.494 3.691 50 0 FHAAMO COC(=O)CCC[N@@H+]1CCOc2c(O)cc(-c3ccc(C)cc3)cc2C1 ZINC000067908640 221303968 /nfs/dbraw/zinc/30/39/68/221303968.db2.gz VBPNJGDRRJLDFJ-UHFFFAOYSA-N 1 1 355.434 3.515 50 0 FHAAMO COC(=O)CCC[N@H+]1CCOc2c(O)cc(-c3ccc(C)cc3)cc2C1 ZINC000067908640 221303969 /nfs/dbraw/zinc/30/39/69/221303969.db2.gz VBPNJGDRRJLDFJ-UHFFFAOYSA-N 1 1 355.434 3.515 50 0 FHAAMO COc1cc(NC(=O)C[NH2+][C@H](C)c2nc3ccccc3[nH]2)ccc1Cl ZINC000067955274 221309376 /nfs/dbraw/zinc/30/93/76/221309376.db2.gz HWERDLMCOLFEPP-LLVKDONJSA-N 1 1 358.829 3.514 50 0 FHAAMO c1cc2c(nc[nH+]c2N2CCC[C@@H](c3n[nH]cc3Cc3ccccc3)C2)[nH]1 ZINC000067974246 221310192 /nfs/dbraw/zinc/31/01/92/221310192.db2.gz RGBULQSICCJZDY-MRXNPFEDSA-N 1 1 358.449 3.656 50 0 FHAAMO CCc1nnc(CN2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)o1 ZINC000071388767 221345526 /nfs/dbraw/zinc/34/55/26/221345526.db2.gz QSECLFMFMSIZFO-SFHVURJKSA-N 1 1 360.477 3.504 50 0 FHAAMO CC(C)(C[N@H+]1CCC[C@H](CCc2ccc(F)c(F)c2)C1)N1CCOCC1 ZINC000071439746 221349233 /nfs/dbraw/zinc/34/92/33/221349233.db2.gz ZGJYJMDZZKLFMC-GOSISDBHSA-N 1 1 366.496 3.720 50 0 FHAAMO Cc1ccc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 ZINC000071730494 221356862 /nfs/dbraw/zinc/35/68/62/221356862.db2.gz KMEBPTFJWXIEKY-OAQYLSRUSA-N 1 1 369.484 3.902 50 0 FHAAMO c1cnn(-c2cccc([C@H]3c4[nH]cnc4CC[N@@H+]3CCc3ccccc3)c2)c1 ZINC000071738867 221357947 /nfs/dbraw/zinc/35/79/47/221357947.db2.gz UOJWKUQQRSXTFJ-QHCPKHFHSA-N 1 1 369.472 3.786 50 0 FHAAMO CC(C)c1nc(Cn2cc[nH+]c2[C@@H](C)Cc2ccc3c(c2)OCO3)no1 ZINC000071761960 221368978 /nfs/dbraw/zinc/36/89/78/221368978.db2.gz ISWIBIZKNVUWGT-ZDUSSCGKSA-N 1 1 354.410 3.513 50 0 FHAAMO COC(=O)CCCC[N@H+]1CCO[C@H](c2ccc3cc(OC)ccc3c2)C1 ZINC000071749726 221361028 /nfs/dbraw/zinc/36/10/28/221361028.db2.gz TZCYKAYFUHHMBR-FQEVSTJZSA-N 1 1 357.450 3.565 50 0 FHAAMO CCc1ncc(CN2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 ZINC000071750671 221361808 /nfs/dbraw/zinc/36/18/08/221361808.db2.gz IZDNGWHMVTXUDD-NRFANRHFSA-N 1 1 370.516 3.911 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2cncc(F)c2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071750431 221362579 /nfs/dbraw/zinc/36/25/79/221362579.db2.gz NSQUWYBTLXTBSN-HXUWFJFHSA-N 1 1 373.447 3.733 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2cccc3c2ccn3C)CCC[N@H+]1CC1CC1 ZINC000071752069 221364220 /nfs/dbraw/zinc/36/42/20/221364220.db2.gz MZFZCADNGWVWTJ-OAQYLSRUSA-N 1 1 353.510 3.761 50 0 FHAAMO COc1ccc(F)c(-c2nc(C[N@H+](C)CCC3(O)CCCC3)c(C)o2)c1 ZINC000071756784 221365418 /nfs/dbraw/zinc/36/54/18/221365418.db2.gz BMBLYKJIIKRTFO-UHFFFAOYSA-N 1 1 362.445 3.925 50 0 FHAAMO COc1ccc(F)c(-c2nc(C[N@@H+](C)CCC3(O)CCCC3)c(C)o2)c1 ZINC000071756784 221365421 /nfs/dbraw/zinc/36/54/21/221365421.db2.gz BMBLYKJIIKRTFO-UHFFFAOYSA-N 1 1 362.445 3.925 50 0 FHAAMO COCc1ncc(C[N@H+]2CCC[C@H](CCc3c(F)cccc3F)C2)cn1 ZINC000071760833 221368271 /nfs/dbraw/zinc/36/82/71/221368271.db2.gz ZZDVXYNJDJYDBV-OAHLLOKOSA-N 1 1 361.436 3.746 50 0 FHAAMO CC(C)[N@@H+](C)Cc1c(C(=O)N(C)CCc2ccccc2)nc2sccn21 ZINC000071714742 221354666 /nfs/dbraw/zinc/35/46/66/221354666.db2.gz GWVRITRGQFGPCD-UHFFFAOYSA-N 1 1 370.522 3.551 50 0 FHAAMO CCCCC[N@@H+](CC(=O)N(C)CC(=O)Nc1ccccc1Cl)C(C)C ZINC000071802076 221377213 /nfs/dbraw/zinc/37/72/13/221377213.db2.gz AWFBUCIOTPBDFP-UHFFFAOYSA-N 1 1 367.921 3.638 50 0 FHAAMO Cc1ccn2cc(C[N@@H+]3C[C@H](c4ccccc4)[C@@H]4[C@H]3C3CCN4CC3)nc2c1 ZINC000072148419 221426388 /nfs/dbraw/zinc/42/63/88/221426388.db2.gz DRCQWKYCULTKSE-GMKZXUHWSA-N 1 1 372.516 3.705 50 0 FHAAMO Cc1ccn2cc(C[N@H+]3C[C@H](c4ccccc4)[C@@H]4[C@H]3C3CCN4CC3)nc2c1 ZINC000072148419 221426391 /nfs/dbraw/zinc/42/63/91/221426391.db2.gz DRCQWKYCULTKSE-GMKZXUHWSA-N 1 1 372.516 3.705 50 0 FHAAMO COc1cccc(CCC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3C)C2)c1 ZINC000299759388 533451321 /nfs/dbraw/zinc/45/13/21/533451321.db2.gz GYKDOLVZGTTXKX-HXUWFJFHSA-N 1 1 366.505 3.575 50 0 FHAAMO COc1cccc(C[NH2+]Cc2cc3ccc(C)cc3nc2N(C)C)c1OC ZINC000299759840 533513443 /nfs/dbraw/zinc/51/34/43/533513443.db2.gz NYZXYELRGWFUQY-UHFFFAOYSA-N 1 1 365.477 3.916 50 0 FHAAMO COc1cccc(N2CCC([N@H+]3CCc4[nH]nc(C5CCC5)c4C3)CC2)c1 ZINC000082039362 132193444 /nfs/dbraw/zinc/19/34/44/132193444.db2.gz OSMCSWNTDUWUMQ-UHFFFAOYSA-N 1 1 366.509 3.713 50 0 FHAAMO COc1cccc(N2CCC([N@@H+]3CCc4n[nH]c(C5CCC5)c4C3)CC2)c1 ZINC000082039362 132193446 /nfs/dbraw/zinc/19/34/46/132193446.db2.gz OSMCSWNTDUWUMQ-UHFFFAOYSA-N 1 1 366.509 3.713 50 0 FHAAMO COc1cccc(N2CCC([N@H+]3CCc4n[nH]c(C5CCC5)c4C3)CC2)c1 ZINC000082039362 132193449 /nfs/dbraw/zinc/19/34/49/132193449.db2.gz OSMCSWNTDUWUMQ-UHFFFAOYSA-N 1 1 366.509 3.713 50 0 FHAAMO Cc1[nH+]ccn1CCCN1CCN(c2ccccc2-c2ccccc2)C(=O)C1 ZINC000091320994 132200685 /nfs/dbraw/zinc/20/06/85/132200685.db2.gz VGFYDTCFAIQURF-UHFFFAOYSA-N 1 1 374.488 3.597 50 0 FHAAMO c1cn(Cc2ccncc2)c(C2CCN(c3ccc4c([nH+]3)CCCC4)CC2)n1 ZINC000095505520 132212641 /nfs/dbraw/zinc/21/26/41/132212641.db2.gz MSRDTXFPRCAETC-UHFFFAOYSA-N 1 1 373.504 3.984 50 0 FHAAMO O=C(c1cccs1)N1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000004324256 132386784 /nfs/dbraw/zinc/38/67/84/132386784.db2.gz VDOKGDMLRMELRV-UHFFFAOYSA-N 1 1 357.866 3.912 50 0 FHAAMO CC[C@H]1CN(c2ccc(-c3nc(-c4ccccc4C)no3)cn2)CC[N@H+]1C ZINC000039442649 136119074 /nfs/dbraw/zinc/11/90/74/136119074.db2.gz YRSQPIRQQWVQOL-KRWDZBQOSA-N 1 1 363.465 3.637 50 0 FHAAMO O[C@@H]1CCC[N@H+](C2CCN(c3ccc(-c4cccc(F)c4)cc3)CC2)C1 ZINC000063855448 136133061 /nfs/dbraw/zinc/13/30/61/136133061.db2.gz ZCIGLGHKSMUABA-JOCHJYFZSA-N 1 1 354.469 3.918 50 0 FHAAMO c1ccc(CCC[N@H+]2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)cc1 ZINC000023374896 136152847 /nfs/dbraw/zinc/15/28/47/136152847.db2.gz XQZRTEJEVOZIHQ-DEOSSOPVSA-N 1 1 363.549 3.906 50 0 FHAAMO Cc1ccc(NC(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)c(C)n1 ZINC000096140750 222044135 /nfs/dbraw/zinc/04/41/35/222044135.db2.gz VUCFJVXVWWJTRL-QGZVFWFLSA-N 1 1 356.445 3.624 50 0 FHAAMO Cc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)c(C)n1 ZINC000096140750 222044139 /nfs/dbraw/zinc/04/41/39/222044139.db2.gz VUCFJVXVWWJTRL-QGZVFWFLSA-N 1 1 356.445 3.624 50 0 FHAAMO Cc1ccc(NC(=O)N2CC[N@H+](CC(C)C)[C@@H](CCO)C2)cc1C(C)C ZINC000096167196 222066661 /nfs/dbraw/zinc/06/66/61/222066661.db2.gz DOLWBWVHLMPNGN-IBGZPJMESA-N 1 1 361.530 3.675 50 0 FHAAMO CN(C)c1ccc(C(=O)Nc2c[nH+]ccc2Nc2ccc(F)cc2)cn1 ZINC000097033707 222153356 /nfs/dbraw/zinc/15/33/56/222153356.db2.gz YOLYQGLGDFIDLI-UHFFFAOYSA-N 1 1 351.385 3.678 50 0 FHAAMO CCn1nc(C)c(C(=O)NC[C@H](c2ccc(F)cc2)[NH+]2CCCCC2)c1C ZINC000097076562 222157437 /nfs/dbraw/zinc/15/74/37/222157437.db2.gz OCEYBLMRJMOWBY-LJQANCHMSA-N 1 1 372.488 3.616 50 0 FHAAMO Fc1ccc(-c2nc3c([nH]2)C[N@@H+](C2CSCCSC2)CC3)c(F)c1 ZINC000097213123 222168802 /nfs/dbraw/zinc/16/88/02/222168802.db2.gz YXOASKPXZFJBAR-UHFFFAOYSA-N 1 1 367.490 3.562 50 0 FHAAMO Fc1ccc(-c2nc3c([nH]2)C[N@H+](C2CSCCSC2)CC3)c(F)c1 ZINC000097213123 222168803 /nfs/dbraw/zinc/16/88/03/222168803.db2.gz YXOASKPXZFJBAR-UHFFFAOYSA-N 1 1 367.490 3.562 50 0 FHAAMO COc1ccc(NC(=O)N[C@H]2CCC[N@H+](Cc3cccnc3)C2)cc1Cl ZINC000097294973 222173630 /nfs/dbraw/zinc/17/36/30/222173630.db2.gz SGVYLRBYERRPSJ-INIZCTEOSA-N 1 1 374.872 3.530 50 0 FHAAMO COc1ccc(NC(=O)N[C@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1Cl ZINC000097294973 222173635 /nfs/dbraw/zinc/17/36/35/222173635.db2.gz SGVYLRBYERRPSJ-INIZCTEOSA-N 1 1 374.872 3.530 50 0 FHAAMO CC[N@H+]1CCC[C@@H](C(=O)NCC2CCC(c3nc4ccccc4[nH]3)CC2)C1 ZINC000097307598 222174170 /nfs/dbraw/zinc/17/41/70/222174170.db2.gz AOOBWJPFQMJJKA-DAWZGUTISA-N 1 1 368.525 3.685 50 0 FHAAMO 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FHAAMO C[C@H]1CCC[N@@H+](CCCNc2ncnc3onc(-c4ccc(F)cc4)c32)C1 ZINC000020574496 220333337 /nfs/dbraw/zinc/33/33/37/220333337.db2.gz QCHKNGXTAQQTIT-AWEZNQCLSA-N 1 1 369.444 3.958 50 0 FHAAMO O=C(c1cc2ccc3cccnc3c2[nH]1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020575413 220334875 /nfs/dbraw/zinc/33/48/75/220334875.db2.gz VJXBEGQPHCNPAP-UHFFFAOYSA-N 1 1 370.456 3.674 50 0 FHAAMO CCOc1cc2c(cc1OCC)[C@H](c1coc3ccccc3c1=O)[NH2+]CC2 ZINC000020494366 220329137 /nfs/dbraw/zinc/32/91/37/220329137.db2.gz BRNMQWNJLZTXNN-OAQYLSRUSA-N 1 1 365.429 3.826 50 0 FHAAMO Fc1cccc(-c2n[nH]c3c2C[N@H+](Cc2cccc4c2OCO4)CC3)c1 ZINC000020778218 220342058 /nfs/dbraw/zinc/34/20/58/220342058.db2.gz WLKHHOVSQAYKRF-UHFFFAOYSA-N 1 1 351.381 3.503 50 0 FHAAMO Fc1cccc(-c2n[nH]c3c2C[N@@H+](Cc2cccc4c2OCO4)CC3)c1 ZINC000020778218 220342060 /nfs/dbraw/zinc/34/20/60/220342060.db2.gz WLKHHOVSQAYKRF-UHFFFAOYSA-N 1 1 351.381 3.503 50 0 FHAAMO CC(=O)c1cc(CN2CCC[C@@H]([N@H+]3CCc4ccccc4C3)C2)cs1 ZINC000020786065 220342133 /nfs/dbraw/zinc/34/21/33/220342133.db2.gz ZYKXNPIOFSQGGD-HXUWFJFHSA-N 1 1 354.519 3.973 50 0 FHAAMO COc1ccc(CN2CCC[C@H]([N@@H+](C)CCc3ccccc3)C2)cc1O ZINC000020999171 220348309 /nfs/dbraw/zinc/34/83/09/220348309.db2.gz LGJJOGVULOYWJH-FQEVSTJZSA-N 1 1 354.494 3.540 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2cc(Cl)ccc2Cl)CC1 ZINC000022028245 220374517 /nfs/dbraw/zinc/37/45/17/220374517.db2.gz PGYXSCHPVLANDS-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO C[NH+]1CCN(Cc2ccccc2C(=O)c2ccccc2C(F)(F)F)CC1 ZINC000022028222 220374813 /nfs/dbraw/zinc/37/48/13/220374813.db2.gz LBCHWGCIMIQCMU-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO C[NH+]1CCN(Cc2ccc(C(=O)c3ccc(Cl)cc3Cl)cc2)CC1 ZINC000022027948 220374142 /nfs/dbraw/zinc/37/41/42/220374142.db2.gz ZOTHBWCNULBBAN-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO Cc1ccccc1C[NH+]1CCN(C(=O)NCC2(c3ccccc3)CC2)CC1 ZINC000022427015 220385505 /nfs/dbraw/zinc/38/55/05/220385505.db2.gz HRRCKAPPPCWTLB-UHFFFAOYSA-N 1 1 363.505 3.554 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@@H+]1CCC[C@@H]1c1cc(OC)ccc1OC ZINC000048287058 221004973 /nfs/dbraw/zinc/00/49/73/221004973.db2.gz ZGNHXDCCDSCPFJ-QFBILLFUSA-N 1 1 360.498 3.632 50 0 FHAAMO CC[C@H]1CCCCN1C(=O)C[N@H+]1CCC[C@@H]1c1cc(OC)ccc1OC ZINC000048287058 221004976 /nfs/dbraw/zinc/00/49/76/221004976.db2.gz ZGNHXDCCDSCPFJ-QFBILLFUSA-N 1 1 360.498 3.632 50 0 FHAAMO Cc1ccsc1C(=O)NCc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000048358479 221009747 /nfs/dbraw/zinc/00/97/47/221009747.db2.gz HAVQKAJMTOLAMJ-HZPDHXFCSA-N 1 1 358.507 3.596 50 0 FHAAMO COc1ccc(OC)c(NC(=O)C[N@H+](Cc2ccco2)C2CCCC2)c1 ZINC000048367615 221010856 /nfs/dbraw/zinc/01/08/56/221010856.db2.gz WOQBKILPVYCDHB-UHFFFAOYSA-N 1 1 358.438 3.680 50 0 FHAAMO COc1ccc(OC)c(NC(=O)C[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000048367615 221010858 /nfs/dbraw/zinc/01/08/58/221010858.db2.gz WOQBKILPVYCDHB-UHFFFAOYSA-N 1 1 358.438 3.680 50 0 FHAAMO CN(C)c1ncc(C[N@H+]2CCC[C@H](Nc3ccc(F)c(F)c3)C2)s1 ZINC000055061015 221057678 /nfs/dbraw/zinc/05/76/78/221057678.db2.gz JTECSAOVHCGNNT-ZDUSSCGKSA-N 1 1 352.454 3.564 50 0 FHAAMO Cc1ccc(C[N@@H+](CCCO)Cc2ccc(-c3cncnc3)cc2)s1 ZINC000055060500 221057769 /nfs/dbraw/zinc/05/77/69/221057769.db2.gz SYGIDFYNTHNMBL-UHFFFAOYSA-N 1 1 353.491 3.898 50 0 FHAAMO CC(C)(CN1CCC(n2cc(C3CCCC3)nn2)CC1)C[NH+]1CCCC1 ZINC000055109180 221058420 /nfs/dbraw/zinc/05/84/20/221058420.db2.gz INVCQCNLMSEXJG-UHFFFAOYSA-N 1 1 359.562 3.695 50 0 FHAAMO COc1cccc(C[N@H+](C)[C@H](C)c2cccnc2)c1OCCn1ccnc1 ZINC000055073052 221058840 /nfs/dbraw/zinc/05/88/40/221058840.db2.gz XZZNDNXUPIUMCM-QGZVFWFLSA-N 1 1 366.465 3.559 50 0 FHAAMO COc1cccc(C[N@@H+](C)[C@H](C)c2cccnc2)c1OCCn1ccnc1 ZINC000055073052 221058845 /nfs/dbraw/zinc/05/88/45/221058845.db2.gz XZZNDNXUPIUMCM-QGZVFWFLSA-N 1 1 366.465 3.559 50 0 FHAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)N[C@@H]2CCOc3c(Cl)cccc32)C1 ZINC000056805548 221081664 /nfs/dbraw/zinc/08/16/64/221081664.db2.gz OOFAAMJQGUBCBW-RHSMWYFYSA-N 1 1 365.905 3.585 50 0 FHAAMO C[NH+](C)[C@@H](CNC(=S)Nc1cccc(C(F)(F)F)c1)c1cccnc1 ZINC000057011224 221083161 /nfs/dbraw/zinc/08/31/61/221083161.db2.gz LAOPLDNXHRHHSU-HNNXBMFYSA-N 1 1 368.428 3.690 50 0 FHAAMO C[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1c[nH]nc1-c1ccc(F)cc1 ZINC000055342061 221067321 /nfs/dbraw/zinc/06/73/21/221067321.db2.gz AEHHYMSNYGSKJP-UHFFFAOYSA-N 1 1 351.385 3.831 50 0 FHAAMO O=C(NCCOc1cccc(Cl)c1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000058173176 221102408 /nfs/dbraw/zinc/10/24/08/221102408.db2.gz AORKSWVWUYNTSG-SFHVURJKSA-N 1 1 372.896 3.747 50 0 FHAAMO O=c1[nH]c2ccccc2n1C1CC[NH+](Cc2ccc(OC(F)F)cc2)CC1 ZINC000060466166 221132703 /nfs/dbraw/zinc/13/27/03/221132703.db2.gz NYYHVQXBBQTZAX-UHFFFAOYSA-N 1 1 373.403 3.768 50 0 FHAAMO Cn1ccnc1CCNC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000058316819 221115000 /nfs/dbraw/zinc/11/50/00/221115000.db2.gz YYPFUMMDLHHMIG-UHFFFAOYSA-N 1 1 369.513 3.549 50 0 FHAAMO CCC[N@@H+](Cc1cccc(OC2(C(=O)[O-])CC[NH2+]CC2)c1)[C@H](C)C(C)C ZINC000063869073 221143904 /nfs/dbraw/zinc/14/39/04/221143904.db2.gz SZDSZBXASPPAOE-QGZVFWFLSA-N 1 1 362.514 3.529 50 0 FHAAMO O=C(NCc1ccccc1Cl)C1=CC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000064818099 221152208 /nfs/dbraw/zinc/15/22/08/221152208.db2.gz SRUUHTDQZPMDGQ-UHFFFAOYSA-N 1 1 358.844 3.928 50 0 FHAAMO Cc1[nH+]c2cc3c(cc2n1CC(=O)Nc1c(C)cc(C)cc1C)OCCO3 ZINC000064794941 221152549 /nfs/dbraw/zinc/15/25/49/221152549.db2.gz CWOXMCGHGHBNSA-UHFFFAOYSA-N 1 1 365.433 3.680 50 0 FHAAMO COc1ccc(NC(=O)C2=CC[N@@H+](Cc3ccc(F)cc3)CC2)cc1F ZINC000064818053 221152977 /nfs/dbraw/zinc/15/29/77/221152977.db2.gz UFUFNDPTBSXNSY-UHFFFAOYSA-N 1 1 358.388 3.744 50 0 FHAAMO c1cc(-c2cc([C@H]3CC[N@H+](Cc4ccc5c(c4)OCCO5)C3)ccn2)ccn1 ZINC000065371318 221203995 /nfs/dbraw/zinc/20/39/95/221203995.db2.gz IARXCVNQRSYLTH-FQEVSTJZSA-N 1 1 373.456 3.904 50 0 FHAAMO C[N@H+]1CCC[C@H]1CCN1CC=C(c2cnn(Cc3ccccc3)c2)CC1 ZINC000065408552 221214357 /nfs/dbraw/zinc/21/43/57/221214357.db2.gz DNYATKYHTMRHPU-QFIPXVFZSA-N 1 1 350.510 3.505 50 0 FHAAMO Cc1cnn(C)c1NC(=O)c1ccc(C[N@H+](C)[C@H](C)c2ccccn2)cc1 ZINC000065492322 221225798 /nfs/dbraw/zinc/22/57/98/221225798.db2.gz CHYJBEYQADVUPK-MRXNPFEDSA-N 1 1 363.465 3.569 50 0 FHAAMO COc1cc(-c2ccc(C)s2)cc2c1OCCN(c1cc(N)[nH+]cn1)C2 ZINC000067787519 221286253 /nfs/dbraw/zinc/28/62/53/221286253.db2.gz VLIOJHITNBWYJT-UHFFFAOYSA-N 1 1 368.462 3.503 50 0 FHAAMO C[C@H]1CCCC[N@H+]1CCN(C)Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067885750 221301473 /nfs/dbraw/zinc/30/14/73/221301473.db2.gz LHXXLOGOZUNZDL-SFHVURJKSA-N 1 1 363.509 3.703 50 0 FHAAMO CCc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2cc(OC)ccc2-n2cccn2)C1 ZINC000067909345 221304350 /nfs/dbraw/zinc/30/43/50/221304350.db2.gz CTNCOPSEZQFCMY-KRWDZBQOSA-N 1 1 365.481 3.546 50 0 FHAAMO CC[C@@H](c1cccnc1)[N@@H+](C)Cc1cccc(C(=O)Nc2cnn(C)c2)c1 ZINC000071278665 221337286 /nfs/dbraw/zinc/33/72/86/221337286.db2.gz WHQPLJXNFMCRQQ-FQEVSTJZSA-N 1 1 363.465 3.651 50 0 FHAAMO O=C(N[C@@H]1CCCC[C@@H]1C(F)(F)F)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000070036509 221330805 /nfs/dbraw/zinc/33/08/05/221330805.db2.gz IPVKQAFLSHPNNC-YESZJQIVSA-N 1 1 369.431 3.531 50 0 FHAAMO Cc1ccc(-c2cc(C(=O)N3CCC[N@@H+](CC4CC4)[C@@H](C(C)C)C3)[nH]n2)o1 ZINC000071416041 221345893 /nfs/dbraw/zinc/34/58/93/221345893.db2.gz FCMUJBUZASOUDD-LJQANCHMSA-N 1 1 370.497 3.561 50 0 FHAAMO CC(C)[N@@H+](C)CCC(=O)N1CCC[C@@H](CCc2ccc(F)c(F)c2)C1 ZINC000071415520 221346291 /nfs/dbraw/zinc/34/62/91/221346291.db2.gz BUYUQNNJLGEWKR-KRWDZBQOSA-N 1 1 352.469 3.866 50 0 FHAAMO Cc1cccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 ZINC000071707734 221353393 /nfs/dbraw/zinc/35/33/93/221353393.db2.gz CUTWYGZQKILSSZ-OAQYLSRUSA-N 1 1 369.484 3.788 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2ccncc2F)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071439380 221349284 /nfs/dbraw/zinc/34/92/84/221349284.db2.gz NJXOQDZWAQVUPJ-FQEVSTJZSA-N 1 1 373.447 3.733 50 0 FHAAMO CC(C)[C@H]1C[N@H+](Cc2cncn2C2CCCCC2)CCC(=O)N1CC1CC1 ZINC000071524562 221350429 /nfs/dbraw/zinc/35/04/29/221350429.db2.gz VNRHBPCIIMKWTK-OAQYLSRUSA-N 1 1 372.557 3.857 50 0 FHAAMO CC(C)[C@H]1C[N@@H+](Cc2cncn2C2CCCCC2)CCC(=O)N1CC1CC1 ZINC000071524562 221350432 /nfs/dbraw/zinc/35/04/32/221350432.db2.gz VNRHBPCIIMKWTK-OAQYLSRUSA-N 1 1 372.557 3.857 50 0 FHAAMO CCOc1ccc2ccccc2c1C[N@H+]1CCC[C@H](N2CCCC2=O)C1 ZINC000071748112 221359381 /nfs/dbraw/zinc/35/93/81/221359381.db2.gz YXENDDBWBOALOC-SFHVURJKSA-N 1 1 352.478 3.825 50 0 FHAAMO CC(C)c1cc(C[N@H+]2CCC[C@H](c3nc(-c4cccnc4)no3)C2)on1 ZINC000071758849 221367164 /nfs/dbraw/zinc/36/71/64/221367164.db2.gz SVGDZPXLGWTPHF-HNNXBMFYSA-N 1 1 353.426 3.623 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)Cc2cccnc2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071681829 221354403 /nfs/dbraw/zinc/35/44/03/221354403.db2.gz ZVYCTQCROGTOFO-OAQYLSRUSA-N 1 1 369.484 3.522 50 0 FHAAMO Cc1c[nH]c(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1 ZINC000071715311 221355645 /nfs/dbraw/zinc/35/56/45/221355645.db2.gz UJHGLWGYEBYOQF-FQEVSTJZSA-N 1 1 357.473 3.835 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccc3)no2)CCC[N@H+]1CC1CC1 ZINC000071763803 221371217 /nfs/dbraw/zinc/37/12/17/221371217.db2.gz VEIHIAITNNWJRD-HXUWFJFHSA-N 1 1 367.493 3.924 50 0 FHAAMO COc1ccc(CCNC(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)cc1 ZINC000299777866 533493607 /nfs/dbraw/zinc/49/36/07/533493607.db2.gz NZMCTJCWVFOQPK-BDTNDASRSA-N 1 1 364.489 3.580 50 0 FHAAMO c1cn(Cc2ccccc2)c([C@H]2CCCN(c3ncnc4c3CCC4)C2)[nH+]1 ZINC000082096290 132194259 /nfs/dbraw/zinc/19/42/59/132194259.db2.gz UVYDGSLBCZYBES-SFHVURJKSA-N 1 1 359.477 3.594 50 0 FHAAMO CC(C)c1[nH+]ccn1[C@@H](C)C(=O)NCCCN1CCCc2ccccc21 ZINC000095392785 132210786 /nfs/dbraw/zinc/21/07/86/132210786.db2.gz CEBNBLDRMJILPE-KRWDZBQOSA-N 1 1 354.498 3.527 50 0 FHAAMO Cc1ccc(N2CC[NH+]([C@H](C)C(=O)N[C@H](C)c3ccccc3)CC2)cc1C ZINC000096490403 132225186 /nfs/dbraw/zinc/22/51/86/132225186.db2.gz NJWXCPKDKBVBGU-WOJBJXKFSA-N 1 1 365.521 3.691 50 0 FHAAMO O=C(NC1CC1)c1cccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)c1 ZINC000034684588 136117871 /nfs/dbraw/zinc/11/78/71/136117871.db2.gz VYEDMCHOKMVUEP-UHFFFAOYSA-N 1 1 369.896 3.554 50 0 FHAAMO Cc1[nH+]ccn1CCC1CCN(c2nccc(CCC(F)(F)F)n2)CC1 ZINC000071750330 136140118 /nfs/dbraw/zinc/14/01/18/136140118.db2.gz WPYKUXHAIRTQJX-UHFFFAOYSA-N 1 1 367.419 3.783 50 0 FHAAMO Cc1cccc(N2CCC3(CCC[N@@H+]3Cc3cnc(C(C)C)nc3)CC2)n1 ZINC000072431611 136147035 /nfs/dbraw/zinc/14/70/35/136147035.db2.gz BRSODSCXTVJISP-UHFFFAOYSA-N 1 1 365.525 3.938 50 0 FHAAMO Cc1[nH+]ccn1CC1CCN(C(=O)c2cc3c(s2)CC[C@H](C)C3)CC1 ZINC000091780990 221796937 /nfs/dbraw/zinc/79/69/37/221796937.db2.gz GSLNDCPVKIKTLY-AWEZNQCLSA-N 1 1 357.523 3.930 50 0 FHAAMO Cc1nc(C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)n(C2CCCCC2)n1 ZINC000096132929 222038157 /nfs/dbraw/zinc/03/81/57/222038157.db2.gz OTZDDQAUZQZYKH-HXUWFJFHSA-N 1 1 354.498 3.535 50 0 FHAAMO Cc1nc(C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)n(C2CCCCC2)n1 ZINC000096132929 222038159 /nfs/dbraw/zinc/03/81/59/222038159.db2.gz OTZDDQAUZQZYKH-HXUWFJFHSA-N 1 1 354.498 3.535 50 0 FHAAMO CC[N@H+]1C[C@H](NC(=O)Nc2ccccc2Oc2cccc(C)c2)[C@@H](OC)C1 ZINC000096153615 222054516 /nfs/dbraw/zinc/05/45/16/222054516.db2.gz OREDLWKPUKDKTB-ICSRJNTNSA-N 1 1 369.465 3.628 50 0 FHAAMO Cc1nn(C)c2nc(NC3CC[NH+](Cc4ccccc4F)CC3)sc12 ZINC000096160358 222059958 /nfs/dbraw/zinc/05/99/58/222059958.db2.gz UUMXPMDOTXOMNN-UHFFFAOYSA-N 1 1 359.474 3.554 50 0 FHAAMO C[N@H+]1C[C@@H](c2ccccc2)CC12CCN(C(=O)c1ccc(Cl)cn1)CC2 ZINC000096162073 222061648 /nfs/dbraw/zinc/06/16/48/222061648.db2.gz ZTWDCKLQZYHHCD-KRWDZBQOSA-N 1 1 369.896 3.829 50 0 FHAAMO Cc1ccc[nH+]c1NCCNC(=O)Nc1ccc2[nH]c(C(C)C)nc2c1 ZINC000096164006 222063624 /nfs/dbraw/zinc/06/36/24/222063624.db2.gz PRZAFJNOPIYYTG-UHFFFAOYSA-N 1 1 352.442 3.623 50 0 FHAAMO C[NH+](C)[C@@H](C(=O)Cn1c2ccccc2nc1[C@H]1CCCO1)c1ccccc1 ZINC000096835507 222132191 /nfs/dbraw/zinc/13/21/91/222132191.db2.gz GEVQUAPAKMIDAX-NHCUHLMSSA-N 1 1 363.461 3.760 50 0 FHAAMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)Nc1cccc(OCCF)c1 ZINC000097164743 222166596 /nfs/dbraw/zinc/16/65/96/222166596.db2.gz GHOOWZMHDTUXTP-KRWDZBQOSA-N 1 1 351.466 3.667 50 0 FHAAMO C[C@@H]1C[C@@H](Nc2ccc(-c3ncn(C)n3)cc2)CC[N@H+]1Cc1ccccc1 ZINC000097371267 222178091 /nfs/dbraw/zinc/17/80/91/222178091.db2.gz TXSSJMGUOVZIRN-UTKZUKDTSA-N 1 1 361.493 3.947 50 0 FHAAMO COCC1(C(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+]2CCCCC2)CCC1 ZINC000097733015 222209061 /nfs/dbraw/zinc/20/90/61/222209061.db2.gz XHDYXXFXONAVOZ-SFHVURJKSA-N 1 1 364.917 3.800 50 0 FHAAMO CCCn1ncc(C[N@H+]2CCC[C@@](CO)(CCc3ccccc3)C2)c1C ZINC000011954158 263369307 /nfs/dbraw/zinc/36/93/07/263369307.db2.gz OORXXAWRURJWON-JOCHJYFZSA-N 1 1 355.526 3.809 50 0 FHAAMO CC(=O)c1ccc(F)c(-c2ccc(C(=O)NC[C@H]3CCCC[N@@H+]3C)cc2)c1 ZINC000426662233 263653237 /nfs/dbraw/zinc/65/32/37/263653237.db2.gz NFJAHBOGXGGYNI-LJQANCHMSA-N 1 1 368.452 3.909 50 0 FHAAMO CC(C)C[C@@H](C(=O)Nc1ccc(C2CCCC2)cc1)N1CC[NH+](C)CC1 ZINC000019802269 519770104 /nfs/dbraw/zinc/77/01/04/519770104.db2.gz PTDIHRDFLWQSHR-NRFANRHFSA-N 1 1 357.542 3.945 50 0 FHAAMO CCCOc1c(C[NH2+]Cc2ccncc2)cc(Br)cc1OC ZINC000020934411 520292913 /nfs/dbraw/zinc/29/29/13/520292913.db2.gz ALDMPPYRJAMVKC-UHFFFAOYSA-N 1 1 365.271 3.931 50 0 FHAAMO CCC(=O)N[C@@H](C)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288395 521175167 /nfs/dbraw/zinc/17/51/67/521175167.db2.gz IVCGEFQTGJPGLD-OXJNMPFZSA-N 1 1 357.523 3.526 50 0 FHAAMO CCCc1cc(C(=O)NC[C@H](c2ccc(Cl)cc2)[NH+]2CCCC2)[nH]n1 ZINC000091351074 521359093 /nfs/dbraw/zinc/35/90/93/521359093.db2.gz JHMXPYQVQPDPCF-GOSISDBHSA-N 1 1 360.889 3.583 50 0 FHAAMO CCCc1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccncc2)C3)cs1 ZINC000091706918 521359985 /nfs/dbraw/zinc/35/99/85/521359985.db2.gz YLPGKIWKEGOYRA-PKOBYXMFSA-N 1 1 369.534 3.832 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNCc1cccc(OC)c1OCc1ccc(F)cc1 ZINC000019872213 521640662 /nfs/dbraw/zinc/64/06/62/521640662.db2.gz IMWQFZGWFFEPOO-HXUWFJFHSA-N 1 1 372.484 3.987 50 0 FHAAMO CCN1CCC[C@@H]1C[NH2+]Cc1cccc(OC)c1OCc1ccc(F)cc1 ZINC000019872213 521640666 /nfs/dbraw/zinc/64/06/66/521640666.db2.gz IMWQFZGWFFEPOO-HXUWFJFHSA-N 1 1 372.484 3.987 50 0 FHAAMO CC[NH+]1CCN(CCCCOc2c(C)cc(C)cc2Br)CC1 ZINC000020389780 521680230 /nfs/dbraw/zinc/68/02/30/521680230.db2.gz GCPBSDVQEVOCCA-UHFFFAOYSA-N 1 1 369.347 3.862 50 0 FHAAMO CC[C@H](CO)[N@@H+](Cc1cccnc1)Cc1cc(F)c(OC)c(Cl)c1 ZINC000055100183 522206966 /nfs/dbraw/zinc/20/69/66/522206966.db2.gz SUMHIWBSAXZTJG-OAHLLOKOSA-N 1 1 352.837 3.656 50 0 FHAAMO O=C(Cc1ccc(O)c(Cl)c1)N[C@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000299800386 534699107 /nfs/dbraw/zinc/69/91/07/534699107.db2.gz VGCOUUPEEXAXCS-HNNXBMFYSA-N 1 1 350.890 3.501 50 0 FHAAMO Cc1ncc(-c2nc([C@H]3C[C@@H](c4ccccc4)[N@H+]4CCC[C@H]34)no2)c(C)n1 ZINC000299755541 534721968 /nfs/dbraw/zinc/72/19/68/534721968.db2.gz BHLOXNNWGAPAMT-UHOSZYNNSA-N 1 1 361.449 3.836 50 0 FHAAMO COCCN(Cc1cccc2ccccc21)C(=O)C[C@@H]1CCCC[N@H+]1C ZINC000216494279 523753852 /nfs/dbraw/zinc/75/38/52/523753852.db2.gz TYAYEEYUPUXZTA-FQEVSTJZSA-N 1 1 354.494 3.689 50 0 FHAAMO C[C@@H](CCSc1ccccc1)[NH+]1CCN(C(=O)c2ccccc2O)CC1 ZINC000079109650 524518795 /nfs/dbraw/zinc/51/87/95/524518795.db2.gz RLIOQODTZHKTNA-KRWDZBQOSA-N 1 1 370.518 3.721 50 0 FHAAMO Cc1csc(CN(C)C(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)n1 ZINC000299762797 534804728 /nfs/dbraw/zinc/80/47/28/534804728.db2.gz YFPDHGVALOGGHM-KSZLIROESA-N 1 1 355.507 3.636 50 0 FHAAMO Cc1cccc([C@H](C(=O)NCc2cc(-c3cccc(F)c3)no2)[NH+](C)C)c1 ZINC000091493162 524857923 /nfs/dbraw/zinc/85/79/23/524857923.db2.gz NVMREPBEZYUBLL-HXUWFJFHSA-N 1 1 367.424 3.708 50 0 FHAAMO Cc1cc(Cl)ccc1O[C@H](C)C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000019832004 524908462 /nfs/dbraw/zinc/90/84/62/524908462.db2.gz LOCZSUXWXNWQOA-QGZVFWFLSA-N 1 1 372.896 3.760 50 0 FHAAMO C[C@@H]1C[NH+](CCOCCOc2ccc(Cl)c3ccccc23)C[C@@H](C)O1 ZINC000020167705 524958609 /nfs/dbraw/zinc/95/86/09/524958609.db2.gz ITSSPFJCYGVZAX-HZPDHXFCSA-N 1 1 363.885 3.998 50 0 FHAAMO O=C(CCc1ccc(F)c(F)c1)N[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000012586202 526586700 /nfs/dbraw/zinc/58/67/00/526586700.db2.gz YMHLIVLYQAYVQZ-IBGZPJMESA-N 1 1 372.459 3.721 50 0 FHAAMO Cn1cc(CCCC(=O)NC[C@@H]2CCC[N@H+]3CCCC[C@H]23)c2ccccc21 ZINC000079193445 527186525 /nfs/dbraw/zinc/18/65/25/527186525.db2.gz WRUDAQKEONPNRI-GHTZIAJQSA-N 1 1 367.537 3.882 50 0 FHAAMO CCCc1cc(N2CCC[C@H](C(=O)c3ccc4c(c3)OCO4)C2)nc(C)[nH+]1 ZINC000071774458 535397927 /nfs/dbraw/zinc/39/79/27/535397927.db2.gz NRBJTTBVHADXST-INIZCTEOSA-N 1 1 367.449 3.566 50 0 FHAAMO O=C(OC[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cccc(Br)c1 ZINC000004984609 560200346 /nfs/dbraw/zinc/20/03/46/560200346.db2.gz AGZJPXXQAWUYDC-GDBMZVCRSA-N 1 1 352.272 3.870 50 0 biogenic,in-vitro FHAAMO COc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000012284548 568028285 /nfs/dbraw/zinc/02/82/85/568028285.db2.gz CFTXNFVHKWQGFY-SFHVURJKSA-N 1 1 366.461 3.749 50 0 FHAAMO COc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000012284548 568028286 /nfs/dbraw/zinc/02/82/86/568028286.db2.gz CFTXNFVHKWQGFY-SFHVURJKSA-N 1 1 366.461 3.749 50 0 FHAAMO CC(C)c1noc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3-n3cccn3)C2)n1 ZINC000214954556 568034389 /nfs/dbraw/zinc/03/43/89/568034389.db2.gz MFLMHXLYDIPBIZ-OAHLLOKOSA-N 1 1 369.444 3.897 50 0 FHAAMO CC[C@H]1CN(Cc2ccccc2OCc2cccc(OC)c2)CC[N@H+]1C ZINC000215164725 568055285 /nfs/dbraw/zinc/05/52/85/568055285.db2.gz NSFQCCFGCXLDEL-FQEVSTJZSA-N 1 1 354.494 3.800 50 0 FHAAMO CC[C@@H](C)Sc1ncc(C[NH+]2CCC(c3ncncc3C)CC2)cn1 ZINC000215209619 568057944 /nfs/dbraw/zinc/05/79/44/568057944.db2.gz ZDTAESDQDBHTBX-OAHLLOKOSA-N 1 1 357.527 3.845 50 0 FHAAMO CCCc1ncncc1C(=O)NC[C@@H](c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC000215214116 568058189 /nfs/dbraw/zinc/05/81/89/568058189.db2.gz HETLQPYSOXFTCR-IBGZPJMESA-N 1 1 372.900 3.649 50 0 FHAAMO CCCc1nc(C(=O)NCC[N@H+]2CCC[C@@H](c3ccccc3)C2)cs1 ZINC000215511688 568074333 /nfs/dbraw/zinc/07/43/33/568074333.db2.gz PXEPCEATXGXYMB-QGZVFWFLSA-N 1 1 357.523 3.705 50 0 FHAAMO NC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC000215512299 568074340 /nfs/dbraw/zinc/07/43/40/568074340.db2.gz OWMSQITZMKIBMN-KRWDZBQOSA-N 1 1 362.832 3.680 50 0 FHAAMO NC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC000215512299 568074341 /nfs/dbraw/zinc/07/43/41/568074341.db2.gz OWMSQITZMKIBMN-KRWDZBQOSA-N 1 1 362.832 3.680 50 0 FHAAMO CCc1nn(C)c(Cl)c1C[NH+]1CCC([C@@H](O)c2cccs2)CC1 ZINC000215999415 568099929 /nfs/dbraw/zinc/09/99/29/568099929.db2.gz LNNAGQXZEXEGPD-MRXNPFEDSA-N 1 1 353.919 3.643 50 0 FHAAMO C[C@H](Cc1ccccn1)[N@@H+](C)Cc1c(-c2ccccc2)nc2ncccn12 ZINC000216272555 568115840 /nfs/dbraw/zinc/11/58/40/568115840.db2.gz KWATTZABBPTWHH-QGZVFWFLSA-N 1 1 357.461 3.854 50 0 FHAAMO CC[NH+](CC)Cc1cc(C(=O)NCc2ccc3nc(C)[nH]c3c2)c(C)o1 ZINC000221428321 568405765 /nfs/dbraw/zinc/40/57/65/568405765.db2.gz GBBMEJHKUSIXCX-UHFFFAOYSA-N 1 1 354.454 3.545 50 0 FHAAMO Cc1cc(Cl)ccc1C(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccncc1)C2 ZINC000091906908 570442016 /nfs/dbraw/zinc/44/20/16/570442016.db2.gz LCBNAMJEALTBRH-PKOBYXMFSA-N 1 1 369.896 3.780 50 0 FHAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3cccn3C)CC2)C1 ZINC000092036845 570445656 /nfs/dbraw/zinc/44/56/56/570445656.db2.gz YRQZNCUSENYTBK-HXUWFJFHSA-N 1 1 365.521 3.757 50 0 FHAAMO COc1c(C)cnc(CN2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)c1C ZINC000092061654 570446171 /nfs/dbraw/zinc/44/61/71/570446171.db2.gz KLUOMXXYZJWKCS-LEWJYISDSA-N 1 1 365.521 3.803 50 0 FHAAMO O=C1CCC2(CC[NH+](Cc3cc(F)c(F)cc3F)CC2)CN1CC1CC1 ZINC000092066836 570446570 /nfs/dbraw/zinc/44/65/70/570446570.db2.gz GVOKHGPXNOEKKX-UHFFFAOYSA-N 1 1 366.427 3.719 50 0 FHAAMO CSc1ccccc1C(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1cccnc1)C2 ZINC000092078739 570446960 /nfs/dbraw/zinc/44/69/60/570446960.db2.gz SEQXEMAQYMKRTM-ZWKOTPCHSA-N 1 1 367.518 3.540 50 0 FHAAMO COc1ccc(C[N@H+]2CC[C@@]3(C2)CCCN(C2CCCCC2)C3=O)cc1O ZINC000092107435 570447619 /nfs/dbraw/zinc/44/76/19/570447619.db2.gz KEAQZQYDTYYCEU-JOCHJYFZSA-N 1 1 372.509 3.548 50 0 FHAAMO COc1ccc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(C(=O)c2cccc(C)c2)C3)cc1 ZINC000095357427 570453404 /nfs/dbraw/zinc/45/34/04/570453404.db2.gz RCJUNVHVPUWQKS-PZJWPPBQSA-N 1 1 364.489 3.740 50 0 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CSCc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](CCc3ccccc3)C2)o1 ZINC000012386364 570741271 /nfs/dbraw/zinc/74/12/71/570741271.db2.gz CHSSTRKGVUVPGY-GOSISDBHSA-N 1 1 372.534 3.922 50 0 FHAAMO Cc1ncsc1C(=O)N(C)C[C@@H]1CCC[N@@H+](CCc2ccccc2C)C1 ZINC000012433210 570744735 /nfs/dbraw/zinc/74/47/35/570744735.db2.gz SSNNMJMYKKZCTO-SFHVURJKSA-N 1 1 371.550 3.787 50 0 FHAAMO CCOC(=O)[C@]1(Cc2ccccc2F)CCC[N@@H+](Cc2cccc(C)n2)C1 ZINC000012432619 570744842 /nfs/dbraw/zinc/74/48/42/570744842.db2.gz LHLXRCOQOGAKRS-QFIPXVFZSA-N 1 1 370.468 3.917 50 0 FHAAMO CC(=O)c1cc(CC(=O)N[C@H]2CCC[N@H+](C3CCCCCC3)C2)cs1 ZINC000012474963 570748512 /nfs/dbraw/zinc/74/85/12/570748512.db2.gz XZPLOBQWYAWQPG-KRWDZBQOSA-N 1 1 362.539 3.797 50 0 FHAAMO COc1cccc(C[N@@H+](Cc2ccco2)C[C@@H](O)COc2ccccc2)c1 ZINC000032622454 570758652 /nfs/dbraw/zinc/75/86/52/570758652.db2.gz RYFOCPACPXUFLM-LJQANCHMSA-N 1 1 367.445 3.730 50 0 FHAAMO COc1cccc(C[N@H+](Cc2ccco2)C[C@@H](O)COc2ccccc2)c1 ZINC000032622454 570758656 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/nfs/dbraw/zinc/96/42/22/570964222.db2.gz AAYGRTBBEGXHTF-OAQYLSRUSA-N 1 1 361.493 3.508 50 0 FHAAMO CCOC(=O)c1cnc2c(-c3ccc(F)cc3)c(C)nn2c1/C=C/[NH+](C)C ZINC000049771004 570965959 /nfs/dbraw/zinc/96/59/59/570965959.db2.gz WAKAIGZGGJIMOL-ZHACJKMWSA-N 1 1 368.412 3.553 50 0 FHAAMO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000023668268 570966543 /nfs/dbraw/zinc/96/65/43/570966543.db2.gz JLPKQZXURMRELX-LLVKDONJSA-N 1 1 363.795 3.819 50 0 FHAAMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000023668268 570966548 /nfs/dbraw/zinc/96/65/48/570966548.db2.gz JLPKQZXURMRELX-LLVKDONJSA-N 1 1 363.795 3.819 50 0 FHAAMO C[C@H]([NH2+]Cc1nc(=O)c2c3c(sc2[nH]1)CCC3)c1ccc(F)c(F)c1 ZINC000023762647 570967508 /nfs/dbraw/zinc/96/75/08/570967508.db2.gz ZWWQEZXLGBFIQA-VIFPVBQESA-N 1 1 361.417 3.602 50 0 FHAAMO O=C(/C=C\c1cccc(Cl)c1)OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000212080294 570969148 /nfs/dbraw/zinc/96/91/48/570969148.db2.gz QEXIMWDOVDITEM-QJRAZLAKSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(/C=C\c1cccc(Cl)c1)OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000212080294 570969150 /nfs/dbraw/zinc/96/91/50/570969150.db2.gz QEXIMWDOVDITEM-QJRAZLAKSA-N 1 1 371.864 3.797 50 0 FHAAMO O=C(NCCC[NH+]1CCOCC1)c1cc2sc3ccccc3c2s1 ZINC000025326472 570993832 /nfs/dbraw/zinc/99/38/32/570993832.db2.gz UCJFYAPLCODZQW-UHFFFAOYSA-N 1 1 360.504 3.568 50 0 FHAAMO CCC[N@@H+](Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C[C@@H](O)c1ccccc1 ZINC000025662123 570998696 /nfs/dbraw/zinc/99/86/96/570998696.db2.gz VXZCKYLJYQVILR-GOSISDBHSA-N 1 1 371.868 3.522 50 0 FHAAMO CCC[N@H+](Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C[C@@H](O)c1ccccc1 ZINC000025662123 570998700 /nfs/dbraw/zinc/99/87/00/570998700.db2.gz VXZCKYLJYQVILR-GOSISDBHSA-N 1 1 371.868 3.522 50 0 FHAAMO CCCOc1ccccc1C(=O)NC[C@@H](c1ccccc1OC)[NH+](C)C ZINC000027794988 571021497 /nfs/dbraw/zinc/02/14/97/571021497.db2.gz FPHNJZMEPKKSCR-SFHVURJKSA-N 1 1 356.466 3.517 50 0 FHAAMO CCCOc1ccccc1C(=O)NC[C@H](c1ccccc1OC)[NH+](C)C ZINC000027794987 571021682 /nfs/dbraw/zinc/02/16/82/571021682.db2.gz FPHNJZMEPKKSCR-GOSISDBHSA-N 1 1 356.466 3.517 50 0 FHAAMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2)cc1F ZINC000008308755 571039034 /nfs/dbraw/zinc/03/90/34/571039034.db2.gz GHSCVZHLUHWUFN-LBPRGKRZSA-N 1 1 350.821 3.947 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2)cc1F ZINC000008308755 571039037 /nfs/dbraw/zinc/03/90/37/571039037.db2.gz GHSCVZHLUHWUFN-LBPRGKRZSA-N 1 1 350.821 3.947 50 0 FHAAMO Cc1sc2nc(C[NH+]3CCCC3)nc(-n3nnc4ccccc43)c2c1C ZINC000008325628 571040394 /nfs/dbraw/zinc/04/03/94/571040394.db2.gz CQDHVDXKSVQIHM-UHFFFAOYSA-N 1 1 364.478 3.638 50 0 FHAAMO c1ccc(-c2nsc(NCc3ccccc3C[NH+]3CCOCC3)n2)cc1 ZINC000225524193 571042689 /nfs/dbraw/zinc/04/26/89/571042689.db2.gz UYVHOWRKGDSPBG-UHFFFAOYSA-N 1 1 366.490 3.649 50 0 FHAAMO COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)Cn2cc[nH+]c2C)cc1 ZINC000030696211 571048757 /nfs/dbraw/zinc/04/87/57/571048757.db2.gz YQKJYBOVJJKKQN-NRFANRHFSA-N 1 1 374.444 3.578 50 0 FHAAMO CCn1c2ccccc2c2cc(NC(=O)[C@H](C)[N@@H+]3CCC[C@H](O)C3)ccc21 ZINC000034884315 571075037 /nfs/dbraw/zinc/07/50/37/571075037.db2.gz BUICEAFQOSKHBB-RDJZCZTQSA-N 1 1 365.477 3.598 50 0 FHAAMO CCn1c2ccccc2c2cc(NC(=O)[C@H](C)[N@H+]3CCC[C@H](O)C3)ccc21 ZINC000034884315 571075038 /nfs/dbraw/zinc/07/50/38/571075038.db2.gz BUICEAFQOSKHBB-RDJZCZTQSA-N 1 1 365.477 3.598 50 0 FHAAMO CCC[N@@H+](CC(=O)NCc1cccs1)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000229746600 571095349 /nfs/dbraw/zinc/09/53/49/571095349.db2.gz ZKWOVTREISEHSD-ZWKOTPCHSA-N 1 1 364.555 3.814 50 0 FHAAMO CCc1oc2ccccc2c1C[N@H+](C)[C@H](C)C(=O)Nc1c(C)nn(C)c1C ZINC000009388849 571107796 /nfs/dbraw/zinc/10/77/96/571107796.db2.gz ULXFJQVARBUMDK-OAHLLOKOSA-N 1 1 368.481 3.805 50 0 FHAAMO CCc1oc2ccccc2c1C[N@@H+](C)[C@H](C)C(=O)Nc1c(C)nn(C)c1C ZINC000009388849 571107797 /nfs/dbraw/zinc/10/77/97/571107797.db2.gz ULXFJQVARBUMDK-OAHLLOKOSA-N 1 1 368.481 3.805 50 0 FHAAMO O=c1[nH]c2ccccc2c(-c2ccc(Cl)cc2)c1C[NH+]1CCOCC1 ZINC000072314642 571109130 /nfs/dbraw/zinc/10/91/30/571109130.db2.gz YSVWDNXIUQGHRC-UHFFFAOYSA-N 1 1 354.837 3.681 50 0 FHAAMO CC(C)c1noc([C@H]2CCC[N@H+](Cc3nccn3Cc3ccccc3)C2)n1 ZINC000244626809 571113833 /nfs/dbraw/zinc/11/38/33/571113833.db2.gz FTCRRDFBBCBQIW-SFHVURJKSA-N 1 1 365.481 3.817 50 0 FHAAMO CC(C)c1noc([C@H]2CCC[N@@H+](Cc3nccn3Cc3ccccc3)C2)n1 ZINC000244626809 571113838 /nfs/dbraw/zinc/11/38/38/571113838.db2.gz FTCRRDFBBCBQIW-SFHVURJKSA-N 1 1 365.481 3.817 50 0 FHAAMO COc1cccc(-c2nc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)c(C)o2)c1 ZINC000244659698 571114138 /nfs/dbraw/zinc/11/41/38/571114138.db2.gz HHJZIIATGRBVSL-INIZCTEOSA-N 1 1 352.438 3.761 50 0 FHAAMO C[C@@H](OC[C@H](O)CNCCC[NH+]1CCCCCC1)c1ccc(Cl)cc1 ZINC000006051593 571114778 /nfs/dbraw/zinc/11/47/78/571114778.db2.gz DNXUXQKZKCFGGZ-YLJYHZDGSA-N 1 1 368.949 3.634 50 0 FHAAMO COc1ccccc1CNC(=O)CC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000244741896 571115866 /nfs/dbraw/zinc/11/58/66/571115866.db2.gz NYPBJLKOHXNDQM-HXUWFJFHSA-N 1 1 352.478 3.581 50 0 FHAAMO COc1ccc(OC)c(NC(=O)CC[N@H+]2CCCC[C@@H]2c2ccccn2)c1 ZINC000244748575 571115901 /nfs/dbraw/zinc/11/59/01/571115901.db2.gz OJXSKJDFORYLLC-LJQANCHMSA-N 1 1 369.465 3.655 50 0 FHAAMO CCC(=O)N(c1ccccc1)C1CC[NH+](Cc2cncn2CC(C)C)CC1 ZINC000244724729 571115920 /nfs/dbraw/zinc/11/59/20/571115920.db2.gz MZSJTDQPKJVSRN-UHFFFAOYSA-N 1 1 368.525 3.947 50 0 FHAAMO COc1cccc2c1OCCC[N@@H+](CCC(=O)N[C@@H](C)c1ccccc1)C2 ZINC000244763988 571116193 /nfs/dbraw/zinc/11/61/93/571116193.db2.gz OZFNQZHHEWRZEA-KRWDZBQOSA-N 1 1 368.477 3.547 50 0 FHAAMO Cn1cccc1[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1C(F)(F)F ZINC000009690460 571117016 /nfs/dbraw/zinc/11/70/16/571117016.db2.gz LTZAPTALPBUTDO-INIZCTEOSA-N 1 1 351.372 3.820 50 0 FHAAMO Cn1cccc1[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1C(F)(F)F ZINC000009690460 571117017 /nfs/dbraw/zinc/11/70/17/571117017.db2.gz LTZAPTALPBUTDO-INIZCTEOSA-N 1 1 351.372 3.820 50 0 FHAAMO Cc1ccc(CNC(=O)CC[N@H+]2CCCC[C@H]2CCc2ccccn2)cc1 ZINC000244816923 571117806 /nfs/dbraw/zinc/11/78/06/571117806.db2.gz SRBSANNJISUUOK-QFIPXVFZSA-N 1 1 365.521 3.884 50 0 FHAAMO O=C(CC[N@@H+]1CCC[C@H]1c1nc(C2CC2)no1)Nc1ccc2c(c1)CCC2 ZINC000244873088 571118260 /nfs/dbraw/zinc/11/82/60/571118260.db2.gz WJXRMLOOEASDLQ-SFHVURJKSA-N 1 1 366.465 3.601 50 0 FHAAMO O=C(CC[N@H+]1CCC[C@H]1c1nc(C2CC2)no1)Nc1ccc2c(c1)CCC2 ZINC000244873088 571118261 /nfs/dbraw/zinc/11/82/61/571118261.db2.gz WJXRMLOOEASDLQ-SFHVURJKSA-N 1 1 366.465 3.601 50 0 FHAAMO Cc1cccc(N2CCN(C(=O)C[N@H+]3CCC[C@H]3c3cccs3)CC2)c1 ZINC000010055652 571122348 /nfs/dbraw/zinc/12/23/48/571122348.db2.gz JMUUDBFRJZZYLF-IBGZPJMESA-N 1 1 369.534 3.542 50 0 FHAAMO COc1cccc([C@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccc(F)cc2)c1 ZINC000010227376 571124152 /nfs/dbraw/zinc/12/41/52/571124152.db2.gz JWDGLKJAHHKIRI-MGPUTAFESA-N 1 1 356.441 3.849 50 0 FHAAMO CCCN(C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1)C(C)C ZINC000247964267 571126717 /nfs/dbraw/zinc/12/67/17/571126717.db2.gz AUNRYUXFACSKMV-GOSISDBHSA-N 1 1 370.541 3.915 50 0 FHAAMO CCCCN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000248121831 571127921 /nfs/dbraw/zinc/12/79/21/571127921.db2.gz NFPQMROPKGGTQV-QGZVFWFLSA-N 1 1 356.514 3.527 50 0 FHAAMO CCCCN(CC)C(=O)C1CC[NH+](Cc2nc3ccccc3n2CC)CC1 ZINC000248248055 571128746 /nfs/dbraw/zinc/12/87/46/571128746.db2.gz REDHHWPRUYNJEZ-UHFFFAOYSA-N 1 1 370.541 3.917 50 0 FHAAMO O=C(CC[N@H+]1CCCC[C@H]1CCn1cccn1)Nc1ccccc1Cl ZINC000252499110 571133381 /nfs/dbraw/zinc/13/33/81/571133381.db2.gz RVPBXYMPPKXQJB-INIZCTEOSA-N 1 1 360.889 3.810 50 0 FHAAMO COc1cccc(NC(=O)C[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000012917520 571145142 /nfs/dbraw/zinc/14/51/42/571145142.db2.gz SVWQSAAZZQSNKE-UHFFFAOYSA-N 1 1 361.445 3.904 50 0 FHAAMO COc1cccc(NC(=O)C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000012917520 571145144 /nfs/dbraw/zinc/14/51/44/571145144.db2.gz SVWQSAAZZQSNKE-UHFFFAOYSA-N 1 1 361.445 3.904 50 0 FHAAMO CC[C@@H](NC(=O)N[C@H]1CCC[N@@H+](CC)C1)c1ccccc1OC(F)F ZINC000052526924 571146252 /nfs/dbraw/zinc/14/62/52/571146252.db2.gz WAAUDJCZRCGXOQ-DZGCQCFKSA-N 1 1 355.429 3.523 50 0 FHAAMO C[C@@H]1CC[N@@H+](CCN2CCC[C@@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)C1 ZINC000075109082 571155883 /nfs/dbraw/zinc/15/58/83/571155883.db2.gz ZNHZFVOVQUKJKH-CXAGYDPISA-N 1 1 370.324 3.738 50 0 FHAAMO NC(=O)COc1ccc(C[N@H+]2CCC[C@H](CCc3ccc(F)cc3)C2)cc1 ZINC000071755198 571165315 /nfs/dbraw/zinc/16/53/15/571165315.db2.gz QNSHEFIRIVVQTI-GOSISDBHSA-N 1 1 370.468 3.535 50 0 FHAAMO Cc1cc(C)n([C@H]2CC[N@@H+](Cc3ccc(OCc4ccccn4)cc3)C2)n1 ZINC000072120650 571170131 /nfs/dbraw/zinc/17/01/31/571170131.db2.gz RMLMGHLHMVPQHK-NRFANRHFSA-N 1 1 362.477 3.921 50 0 FHAAMO Oc1ccc(C[N@H+]2C[C@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)cc1 ZINC000072125665 571170326 /nfs/dbraw/zinc/17/03/26/571170326.db2.gz RTZDGFHNCBTXCI-YPAWHYETSA-N 1 1 352.453 3.594 50 0 FHAAMO CN(Cc1nc2ccc(Cl)cc2[nH]1)C(=O)c1ccccc1[C@@H]1CC[NH2+]C1 ZINC000072129029 571170626 /nfs/dbraw/zinc/17/06/26/571170626.db2.gz XUYBCUHNZXYHIG-CYBMUJFWSA-N 1 1 368.868 3.565 50 0 FHAAMO Clc1nc(N2CCCC2)sc1C[N@H+]1CCC[C@@H](Cn2ccnc2)C1 ZINC000072130949 571170976 /nfs/dbraw/zinc/17/09/76/571170976.db2.gz GYSYTPRKIQYNNH-CQSZACIVSA-N 1 1 365.934 3.505 50 0 FHAAMO Cc1cc(C(=O)CCC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c(C)s1 ZINC000055402240 571172195 /nfs/dbraw/zinc/17/21/95/571172195.db2.gz JKMTWKBQYOIJFP-UONOGXRCSA-N 1 1 350.528 3.564 50 0 FHAAMO C[NH+](C)[C@@H](CNS(=O)(=O)/C=C/c1ccccc1)c1cc2ccccc2o1 ZINC000575620310 571172659 /nfs/dbraw/zinc/17/26/59/571172659.db2.gz JKERZUFFBVMBCK-HHNLSAEISA-N 1 1 370.474 3.626 50 0 FHAAMO c1c(C[N@@H+]2CCCC[C@@H]2CCN2CCOCC2)onc1C1CCCCC1 ZINC000072147750 571173636 /nfs/dbraw/zinc/17/36/36/571173636.db2.gz REKKAECUARAAPH-LJQANCHMSA-N 1 1 361.530 3.799 50 0 FHAAMO CC(C)c1nccc(CN2CCC[N@@H+](CCCc3ccccc3)CC2)n1 ZINC000072157889 571175405 /nfs/dbraw/zinc/17/54/05/571175405.db2.gz KSIOQJHSHQPRQB-UHFFFAOYSA-N 1 1 352.526 3.741 50 0 FHAAMO CCN(C)C(=O)C[N@H+]1CCC[C@H](CCc2ccccc2C(F)(F)F)C1 ZINC000072163236 571176015 /nfs/dbraw/zinc/17/60/15/571176015.db2.gz OQHXHHUDINQYBA-OAHLLOKOSA-N 1 1 356.432 3.828 50 0 FHAAMO Cc1nc([C@@H](C)[N@H+](C)Cc2cccc(CN3CCOCC3)c2)c(C)s1 ZINC000072167233 571176784 /nfs/dbraw/zinc/17/67/84/571176784.db2.gz MQSNEFGIYFNMBO-OAHLLOKOSA-N 1 1 359.539 3.785 50 0 FHAAMO Cc1nc([C@@H](C)[N@@H+](C)Cc2cccc(CN3CCOCC3)c2)c(C)s1 ZINC000072167233 571176786 /nfs/dbraw/zinc/17/67/86/571176786.db2.gz MQSNEFGIYFNMBO-OAHLLOKOSA-N 1 1 359.539 3.785 50 0 FHAAMO CN(C)c1ncc(C[N@H+]2CCC[C@H](Cc3nc4ccccc4[nH]3)C2)s1 ZINC000072170549 571177310 /nfs/dbraw/zinc/17/73/10/571177310.db2.gz RMBDQUKKIGJAAQ-CQSZACIVSA-N 1 1 355.511 3.540 50 0 FHAAMO CC[C@H](C(=O)Nc1cc(C)on1)[N@@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000229545798 571178099 /nfs/dbraw/zinc/17/80/99/571178099.db2.gz UCSIKQXPCRUQOI-GDBMZVCRSA-N 1 1 368.437 3.721 50 0 FHAAMO CC[C@H](C(=O)Nc1cc(C)on1)[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000229545798 571178100 /nfs/dbraw/zinc/17/81/00/571178100.db2.gz UCSIKQXPCRUQOI-GDBMZVCRSA-N 1 1 368.437 3.721 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@H](C)N1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000229979410 571178357 /nfs/dbraw/zinc/17/83/57/571178357.db2.gz RFASCRIVTJIPDV-DOTOQJQBSA-N 1 1 363.933 3.639 50 0 FHAAMO Cc1cccc(NC2CCN(C(=O)c3c[nH]c4cccc(F)c34)CC2)[nH+]1 ZINC000090634298 571180918 /nfs/dbraw/zinc/18/09/18/571180918.db2.gz DVTGFOSULROCJM-UHFFFAOYSA-N 1 1 352.413 3.727 50 0 FHAAMO Clc1ccc(-n2nnnc2C2([NH2+]Cc3ccccc3)CCCC2)cc1 ZINC000035622726 571183695 /nfs/dbraw/zinc/18/36/95/571183695.db2.gz GVXUEMCFDDLVNA-UHFFFAOYSA-N 1 1 353.857 3.875 50 0 FHAAMO C[N@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccccc1N1CCCCC1 ZINC000012587709 571187346 /nfs/dbraw/zinc/18/73/46/571187346.db2.gz HCJOYRCIGHPVKI-UHFFFAOYSA-N 1 1 355.457 3.887 50 0 FHAAMO C[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccccc1N1CCCCC1 ZINC000012587709 571187348 /nfs/dbraw/zinc/18/73/48/571187348.db2.gz HCJOYRCIGHPVKI-UHFFFAOYSA-N 1 1 355.457 3.887 50 0 FHAAMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](N[C@@H](CO)c2cc(F)c(F)c(F)c2)C1 ZINC000090812897 571189628 /nfs/dbraw/zinc/18/96/28/571189628.db2.gz MYGPGIAZWSVKRK-AZOIQLNYSA-N 1 1 364.411 3.562 50 0 FHAAMO C[C@H](c1ccccc1)N1CC[C@H]([NH2+][C@@H](CO)c2cc(F)c(F)c(F)c2)C1 ZINC000090812897 571189630 /nfs/dbraw/zinc/18/96/30/571189630.db2.gz MYGPGIAZWSVKRK-AZOIQLNYSA-N 1 1 364.411 3.562 50 0 FHAAMO Fc1cccc(CN2CCC[N@@H+](Cc3cnc(N4CCCC4)s3)CC2)c1 ZINC000072409170 571191400 /nfs/dbraw/zinc/19/14/00/571191400.db2.gz BRFCZONLUXTVDO-UHFFFAOYSA-N 1 1 374.529 3.590 50 0 FHAAMO Fc1cccc(C[N@@H+]2CCCN(Cc3cnc(N4CCCC4)s3)CC2)c1 ZINC000072409170 571191403 /nfs/dbraw/zinc/19/14/03/571191403.db2.gz BRFCZONLUXTVDO-UHFFFAOYSA-N 1 1 374.529 3.590 50 0 FHAAMO Fc1cccc(C[N@H+]2CCCN(Cc3cnc(N4CCCC4)s3)CC2)c1 ZINC000072409170 571191405 /nfs/dbraw/zinc/19/14/05/571191405.db2.gz BRFCZONLUXTVDO-UHFFFAOYSA-N 1 1 374.529 3.590 50 0 FHAAMO COc1c(F)cccc1C(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC000072410700 571192120 /nfs/dbraw/zinc/19/21/20/571192120.db2.gz ZEXLRJHFAPBDPU-MRXNPFEDSA-N 1 1 374.431 3.710 50 0 FHAAMO COc1c(F)cccc1C(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC000072410700 571192121 /nfs/dbraw/zinc/19/21/21/571192121.db2.gz ZEXLRJHFAPBDPU-MRXNPFEDSA-N 1 1 374.431 3.710 50 0 FHAAMO C[N@H+]1CCC[C@@H]1CCNc1ccc(-c2nc(-c3ccccc3F)no2)cn1 ZINC000072426539 571194475 /nfs/dbraw/zinc/19/44/75/571194475.db2.gz ODOBMYVFFSMXMD-OAHLLOKOSA-N 1 1 367.428 3.834 50 0 FHAAMO Cc1ncsc1CC[N@H+](C)Cc1c(-c2ccccc2)nc2ncccn12 ZINC000072462618 571197839 /nfs/dbraw/zinc/19/78/39/571197839.db2.gz QKNRDJUTLUGUJJ-UHFFFAOYSA-N 1 1 363.490 3.836 50 0 FHAAMO CCc1cc(N[C@H]2CCC[N@@H+](Cc3ccc(F)cc3)C2)n2nccc2n1 ZINC000072458956 571197965 /nfs/dbraw/zinc/19/79/65/571197965.db2.gz XCCMMZVVCPUIMN-SFHVURJKSA-N 1 1 353.445 3.507 50 0 FHAAMO CC(=O)c1cc(C(=O)N2CCC([N@H+]3CCc4ccccc4C3)CC2)cs1 ZINC000072477555 571199254 /nfs/dbraw/zinc/19/92/54/571199254.db2.gz CVRYKUQZEQTHAG-UHFFFAOYSA-N 1 1 368.502 3.614 50 0 FHAAMO CCCC[N@@H+](CC)CCNc1ncnc2onc(-c3ccc(F)cc3)c21 ZINC000033269097 571204259 /nfs/dbraw/zinc/20/42/59/571204259.db2.gz QVTIATWHHIHJNC-UHFFFAOYSA-N 1 1 357.433 3.958 50 0 FHAAMO CC(C)(C)c1cc(-c2nccn2[C@H]2CCC[N@@H+](Cc3cccnc3)C2)n[nH]1 ZINC000077380386 571209668 /nfs/dbraw/zinc/20/96/68/571209668.db2.gz VDGWZIAKTSORCK-KRWDZBQOSA-N 1 1 364.497 3.803 50 0 FHAAMO COc1cccc2c1OCC(C[N@H+](C)Cc1cc(-c3cccnc3)no1)=C2 ZINC000077407236 571210500 /nfs/dbraw/zinc/21/05/00/571210500.db2.gz HFBRLLQJIDAVKK-UHFFFAOYSA-N 1 1 363.417 3.653 50 0 FHAAMO COc1cccc2c1OCC(C[N@@H+](C)Cc1cc(-c3cccnc3)no1)=C2 ZINC000077407236 571210501 /nfs/dbraw/zinc/21/05/01/571210501.db2.gz HFBRLLQJIDAVKK-UHFFFAOYSA-N 1 1 363.417 3.653 50 0 FHAAMO Cn1ccnc1CC[C@H]1CCCC[N@H+]1Cc1cccc(Cn2cccn2)c1 ZINC000077419709 571210752 /nfs/dbraw/zinc/21/07/52/571210752.db2.gz HNESFBNWKXGQHM-OAQYLSRUSA-N 1 1 363.509 3.652 50 0 FHAAMO C[C@H](C(=O)N(C)Cc1cccc2cnccc21)[N@H+]1CCc2ccccc2C1 ZINC000077458763 571212197 /nfs/dbraw/zinc/21/21/97/571212197.db2.gz YOALMHSVVZZWBF-QGZVFWFLSA-N 1 1 359.473 3.640 50 0 FHAAMO CCCCN1C[C@@]2(CCC[N@@H+](Cc3c(C)nn(CC)c3C)C2)CCC1=O ZINC000077456853 571212325 /nfs/dbraw/zinc/21/23/25/571212325.db2.gz CKCQUPPCJKRVCF-NRFANRHFSA-N 1 1 360.546 3.525 50 0 FHAAMO CCn1ccnc1C[NH+]1CCC(c2n[nH]cc2-c2cccc(F)c2)CC1 ZINC000077522294 571214659 /nfs/dbraw/zinc/21/46/59/571214659.db2.gz NFNQHNDCDACEEX-UHFFFAOYSA-N 1 1 353.445 3.812 50 0 FHAAMO CC(C)CCC[N@H+]1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 ZINC000077540797 571215177 /nfs/dbraw/zinc/21/51/77/571215177.db2.gz VBFVYNLOMRLOBD-QFIPXVFZSA-N 1 1 357.542 3.765 50 0 FHAAMO CCCN(Cc1ccco1)C(=O)N[C@@H]1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000426381725 571217384 /nfs/dbraw/zinc/21/73/84/571217384.db2.gz QQOUMTHYVRKZAZ-PZJWPPBQSA-N 1 1 369.509 3.764 50 0 FHAAMO COc1ccc(NC(=O)NCC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000426382838 571217664 /nfs/dbraw/zinc/21/76/64/571217664.db2.gz ZGJJTEMHPMVXJH-KRWDZBQOSA-N 1 1 371.456 3.868 50 0 FHAAMO Cc1[nH+]cn(CCNC(=O)c2ccc(-c3ccc([C@@H](C)O)cc3)cc2)c1C ZINC000426387020 571218086 /nfs/dbraw/zinc/21/80/86/571218086.db2.gz CZYSJAWTTXQJCI-QGZVFWFLSA-N 1 1 363.461 3.650 50 0 FHAAMO C[N@@H+](Cc1ccccc1NC(=O)NCCCc1ncc[nH]1)C1CCCCC1 ZINC000426438807 571225239 /nfs/dbraw/zinc/22/52/39/571225239.db2.gz HMCATPJVPFUZRT-UHFFFAOYSA-N 1 1 369.513 3.929 50 0 FHAAMO CCc1[nH+]ccn1CCCNC(=O)[C@@]1(c2ccccc2)CC12CCCC2 ZINC000426440279 571225360 /nfs/dbraw/zinc/22/53/60/571225360.db2.gz MGJOODZAICCVAI-QFIPXVFZSA-N 1 1 351.494 3.854 50 0 FHAAMO Cn1c2ccccc2nc1-c1ccc(C[N@H+]2Cc3ccccc3[C@@H](O)C2)o1 ZINC000082138653 571229059 /nfs/dbraw/zinc/22/90/59/571229059.db2.gz LLMYOYPASCMWNG-FQEVSTJZSA-N 1 1 359.429 3.883 50 0 FHAAMO Cn1c2ccccc2nc1-c1ccc(C[N@@H+]2Cc3ccccc3[C@@H](O)C2)o1 ZINC000082138653 571229061 /nfs/dbraw/zinc/22/90/61/571229061.db2.gz LLMYOYPASCMWNG-FQEVSTJZSA-N 1 1 359.429 3.883 50 0 FHAAMO Cc1nc(C)c(-c2ccc(C(=O)N3CC[C@@H]4CC[C@H](C3)[N@H+]4C)cc2)s1 ZINC000426534435 571230733 /nfs/dbraw/zinc/23/07/33/571230733.db2.gz JCWQCVDEARUNLA-ZWKOTPCHSA-N 1 1 355.507 3.736 50 0 FHAAMO CO[C@@H]1CC[C@@]2(OC)CC[N@@H+](Cc3cccc(-n4nc(C)cc4C)c3)[C@H]2C1 ZINC000426549932 571231446 /nfs/dbraw/zinc/23/14/46/571231446.db2.gz MIGGXIWGOJIDLJ-BHIFYINESA-N 1 1 369.509 3.648 50 0 FHAAMO CC[N@@H+](C)C[C@H](C)CNC(=O)c1ccc(-c2ccc3[nH]cnc3c2)cc1 ZINC000426604566 571233052 /nfs/dbraw/zinc/23/30/52/571233052.db2.gz QINPQBSQRYRNBQ-OAHLLOKOSA-N 1 1 350.466 3.548 50 0 FHAAMO CC[N@H+](C)C[C@H](C)CNC(=O)c1ccc(-c2ccc3nc[nH]c3c2)cc1 ZINC000426604566 571233053 /nfs/dbraw/zinc/23/30/53/571233053.db2.gz QINPQBSQRYRNBQ-OAHLLOKOSA-N 1 1 350.466 3.548 50 0 FHAAMO CC[N@@H+](C)C[C@H](C)CNC(=O)c1ccc(-c2ccc3nc[nH]c3c2)cc1 ZINC000426604566 571233054 /nfs/dbraw/zinc/23/30/54/571233054.db2.gz QINPQBSQRYRNBQ-OAHLLOKOSA-N 1 1 350.466 3.548 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3cc(F)ccc3F)[C@H]1C[C@H](OCC1CC1)CC2 ZINC000426615347 571233296 /nfs/dbraw/zinc/23/32/96/571233296.db2.gz BFXWETQRCFSCDW-YZGWKJHDSA-N 1 1 351.437 3.903 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3cn4cccc(C)c4n3)[C@H]1C[C@@H](OCC1CC1)CC2 ZINC000426618052 571233313 /nfs/dbraw/zinc/23/33/13/571233313.db2.gz BUWQLBGXTBIOJW-JAXLGGSGSA-N 1 1 369.509 3.581 50 0 FHAAMO CCOc1ccc(NC(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cc1-n1cccc1 ZINC000426612532 571233327 /nfs/dbraw/zinc/23/33/27/571233327.db2.gz FYPYYIAWQBDJKX-MSOLQXFVSA-N 1 1 368.481 3.576 50 0 FHAAMO O=C(NCCC[N@@H+]1CCC[C@H](O)C1)c1ccc(-c2ccccc2Cl)cc1 ZINC000426678210 571234800 /nfs/dbraw/zinc/23/48/00/571234800.db2.gz WGYYAADUAIOMSX-SFHVURJKSA-N 1 1 372.896 3.584 50 0 FHAAMO COc1cccc(C[N@H+]2CC[C@]3(OC)CC[C@H](Oc4ccccn4)C[C@H]23)c1 ZINC000426683921 571234963 /nfs/dbraw/zinc/23/49/63/571234963.db2.gz QMYBGKLEZQOXRI-JAXLGGSGSA-N 1 1 368.477 3.681 50 0 FHAAMO O=C(c1ccc(-c2ccc3ocnc3c2)cc1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000426697605 571235574 /nfs/dbraw/zinc/23/55/74/571235574.db2.gz WVANPKWCISMKLR-IBGZPJMESA-N 1 1 361.445 3.805 50 0 FHAAMO CC(C)c1cc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)no1 ZINC000158178866 571236604 /nfs/dbraw/zinc/23/66/04/571236604.db2.gz BFTGHGPKNRVJGT-LPHOPBHVSA-N 1 1 355.482 3.781 50 0 FHAAMO O=C(c1ccc(-c2cc(Cl)ccc2O)cc1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000426746083 571236912 /nfs/dbraw/zinc/23/69/12/571236912.db2.gz LBZNMQKKLNXONN-KRWDZBQOSA-N 1 1 356.853 3.633 50 0 FHAAMO O=C(c1ccncc1)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccc3occc3c2)C1 ZINC000091547360 571240604 /nfs/dbraw/zinc/24/06/04/571240604.db2.gz ZXMVBAKPTGQLTG-YLJYHZDGSA-N 1 1 361.445 3.564 50 0 FHAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3ccc[nH]3)CC2)C1 ZINC000091624667 571241241 /nfs/dbraw/zinc/24/12/41/571241241.db2.gz VQBRRUOLYVYYAI-IBGZPJMESA-N 1 1 351.494 3.747 50 0 FHAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccc(C)cc2C)C2CC2)cc1 ZINC000036098964 571241401 /nfs/dbraw/zinc/24/14/01/571241401.db2.gz OCLIQBGMQHKJIJ-HXUWFJFHSA-N 1 1 355.478 3.716 50 0 FHAAMO COc1ccccc1C[N@H+](Cc1ccccc1)C[C@@H](O)COC(C)(C)C ZINC000036102799 571241813 /nfs/dbraw/zinc/24/18/13/571241813.db2.gz MEAYWFXQNUWTAZ-HXUWFJFHSA-N 1 1 357.494 3.873 50 0 FHAAMO O[C@@H](COCc1ccccc1)C[N@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000036104245 571242247 /nfs/dbraw/zinc/24/22/47/571242247.db2.gz YTTMFWAIPDJWEK-OAQYLSRUSA-N 1 1 369.436 3.999 50 0 FHAAMO O[C@@H](COCc1ccccc1)C[N@@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000036104245 571242249 /nfs/dbraw/zinc/24/22/49/571242249.db2.gz YTTMFWAIPDJWEK-OAQYLSRUSA-N 1 1 369.436 3.999 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000036104252 571242277 /nfs/dbraw/zinc/24/22/77/571242277.db2.gz QVCHKOXDEMDRBZ-SFHVURJKSA-N 1 1 359.397 3.592 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000036104252 571242278 /nfs/dbraw/zinc/24/22/78/571242278.db2.gz QVCHKOXDEMDRBZ-SFHVURJKSA-N 1 1 359.397 3.592 50 0 FHAAMO O=C(c1ccc(Cl)s1)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccncc1)C2 ZINC000091690738 571242375 /nfs/dbraw/zinc/24/23/75/571242375.db2.gz XJOLSRWPFRYYAD-LSDHHAIUSA-N 1 1 361.898 3.533 50 0 FHAAMO O=C(c1ccc(Cl)s1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccncc1)C2 ZINC000091690738 571242376 /nfs/dbraw/zinc/24/23/76/571242376.db2.gz XJOLSRWPFRYYAD-LSDHHAIUSA-N 1 1 361.898 3.533 50 0 FHAAMO O=C(CCc1ccccc1)NCCCC[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000036700069 571261298 /nfs/dbraw/zinc/26/12/98/571261298.db2.gz PDUIRHSMEPTQDK-QFIPXVFZSA-N 1 1 366.505 3.589 50 0 FHAAMO O=C(CCc1ccccc1)NCCCC[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000036700069 571261299 /nfs/dbraw/zinc/26/12/99/571261299.db2.gz PDUIRHSMEPTQDK-QFIPXVFZSA-N 1 1 366.505 3.589 50 0 FHAAMO C[C@H](NC(=O)C[N@H+](C)Cc1ccc(Br)cc1)c1cccs1 ZINC000007443564 571265707 /nfs/dbraw/zinc/26/57/07/571265707.db2.gz ITNSNKCYIFUVNK-LBPRGKRZSA-N 1 1 367.312 3.820 50 0 FHAAMO C[C@H](NC(=O)C[N@@H+](C)Cc1ccc(Br)cc1)c1cccs1 ZINC000007443564 571265709 /nfs/dbraw/zinc/26/57/09/571265709.db2.gz ITNSNKCYIFUVNK-LBPRGKRZSA-N 1 1 367.312 3.820 50 0 FHAAMO C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]Cc1noc(C(C)(C)C)n1 ZINC000170597563 571266640 /nfs/dbraw/zinc/26/66/40/571266640.db2.gz MGTHBTKJCIBYJO-ZIAGYGMSSA-N 1 1 366.506 3.635 50 0 FHAAMO 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COc1ccc(-c2nc(C[N@H+]3CCC[C@H](OC)C3)c(C)o2)c(OC)c1C ZINC000067804962 221288356 /nfs/dbraw/zinc/28/83/56/221288356.db2.gz ALNKVQKSYVMQDI-HNNXBMFYSA-N 1 1 360.454 3.586 50 0 FHAAMO COc1ccc(-c2nc(C[N@@H+]3CCC[C@H](OC)C3)c(C)o2)c(OC)c1C ZINC000067804962 221288358 /nfs/dbraw/zinc/28/83/58/221288358.db2.gz ALNKVQKSYVMQDI-HNNXBMFYSA-N 1 1 360.454 3.586 50 0 FHAAMO c1[nH]nc(-c2ccccc2)c1C[N@@H+]1CCC[C@H]1c1nc(-c2ccncc2)no1 ZINC000067818553 221289620 /nfs/dbraw/zinc/28/96/20/221289620.db2.gz KVWOKOPYOIQISM-SFHVURJKSA-N 1 1 372.432 3.859 50 0 FHAAMO c1[nH]nc(-c2ccccc2)c1C[N@H+]1CCC[C@H]1c1nc(-c2ccncc2)no1 ZINC000067818553 221289621 /nfs/dbraw/zinc/28/96/21/221289621.db2.gz KVWOKOPYOIQISM-SFHVURJKSA-N 1 1 372.432 3.859 50 0 FHAAMO Cc1cc(C)n([C@H]2CC[N@@H+](Cc3c(-c4ccccc4)nc4ncccn34)C2)n1 ZINC000067771799 221282699 /nfs/dbraw/zinc/28/26/99/221282699.db2.gz POQKUBZWLBFZCI-IBGZPJMESA-N 1 1 372.476 3.657 50 0 FHAAMO Cc1ccc(NC(=O)C[NH2+]CCc2nc3ccc(C)c(C)c3[nH]2)c(C)c1 ZINC000067770652 221282766 /nfs/dbraw/zinc/28/27/66/221282766.db2.gz ZZFFGWWXOWGOPP-UHFFFAOYSA-N 1 1 350.466 3.567 50 0 FHAAMO Cc1cc(C(F)(F)F)nc(CC[NH2+]Cc2nc3ccc(C)c(C)c3[nH]2)n1 ZINC000067847513 221293575 /nfs/dbraw/zinc/29/35/75/221293575.db2.gz CYPIUIVKKHXTTL-UHFFFAOYSA-N 1 1 363.387 3.629 50 0 FHAAMO CC[N@H+](Cc1cnc2c(-c3ccccc3)cnn2c1)CC1CCOCC1 ZINC000067872755 221297837 /nfs/dbraw/zinc/29/78/37/221297837.db2.gz BWOVGVONXRHAMX-UHFFFAOYSA-N 1 1 350.466 3.645 50 0 FHAAMO O[C@H](CC[N@H+]1CCc2onc(-c3cccc(F)c3)c2C1)c1ccccc1 ZINC000067869243 221298835 /nfs/dbraw/zinc/29/88/35/221298835.db2.gz DIWIKKLBAFFBLI-LJQANCHMSA-N 1 1 352.409 3.963 50 0 FHAAMO CCCCc1ncc(C[N@@H+]2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)[nH]1 ZINC000071419072 221347672 /nfs/dbraw/zinc/34/76/72/221347672.db2.gz VBYKRDWDJSHXPZ-HXUWFJFHSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1ncc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)[nH]1 ZINC000071419072 221347676 /nfs/dbraw/zinc/34/76/76/221347676.db2.gz VBYKRDWDJSHXPZ-HXUWFJFHSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1nc(C[N@@H+]2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)c[nH]1 ZINC000071419072 221347680 /nfs/dbraw/zinc/34/76/80/221347680.db2.gz VBYKRDWDJSHXPZ-HXUWFJFHSA-N 1 1 368.525 3.765 50 0 FHAAMO CCCCc1nc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)c[nH]1 ZINC000071419072 221347682 /nfs/dbraw/zinc/34/76/82/221347682.db2.gz VBYKRDWDJSHXPZ-HXUWFJFHSA-N 1 1 368.525 3.765 50 0 FHAAMO Cc1cc(-n2cccn2)ccc1C[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000071736348 221356802 /nfs/dbraw/zinc/35/68/02/221356802.db2.gz KUMWFNNHQPIFJH-OAQYLSRUSA-N 1 1 351.425 3.893 50 0 FHAAMO Cc1cc(-n2cccn2)ccc1C[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000071736348 221356806 /nfs/dbraw/zinc/35/68/06/221356806.db2.gz KUMWFNNHQPIFJH-OAQYLSRUSA-N 1 1 351.425 3.893 50 0 FHAAMO NC(=O)COc1cccc(C[N@H+]2CCC[C@@H](CCc3ccc(F)cc3)C2)c1 ZINC000071738522 221357495 /nfs/dbraw/zinc/35/74/95/221357495.db2.gz WTPLQLLNFMZXSR-SFHVURJKSA-N 1 1 370.468 3.535 50 0 FHAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@H](CCc2ccc(F)cc2F)C1 ZINC000071753651 221363444 /nfs/dbraw/zinc/36/34/44/221363444.db2.gz QHWOAERFUJZTKH-OAHLLOKOSA-N 1 1 361.436 3.595 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2nccc3ccccc32)CCC[N@H+]1CC1CC1 ZINC000071759646 221366611 /nfs/dbraw/zinc/36/66/11/221366611.db2.gz NPZYHIZGSINSCA-FQEVSTJZSA-N 1 1 351.494 3.817 50 0 FHAAMO O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cccc(Br)c1 ZINC000071769338 221374028 /nfs/dbraw/zinc/37/40/28/221374028.db2.gz GSRVTVHBVZTHNU-HNNXBMFYSA-N 1 1 351.288 3.586 50 0 FHAAMO COc1cccc(O[C@@H]2CC[N@@H+](CCCC(=O)c3ccc(F)cc3)C2)c1 ZINC000071769303 221374253 /nfs/dbraw/zinc/37/42/53/221374253.db2.gz BOYHRGVIIMUTCP-HXUWFJFHSA-N 1 1 357.425 3.951 50 0 FHAAMO COc1ccc(C[N@@H+](C)Cc2cccc3ncccc23)cc1Cn1cncn1 ZINC000072127432 221412708 /nfs/dbraw/zinc/41/27/08/221412708.db2.gz SCXAOPRWOQASFM-UHFFFAOYSA-N 1 1 373.460 3.515 50 0 FHAAMO O=Cc1c(Br)cccc1N1CC[NH+](Cc2ccccc2)CC1 ZINC000095080978 132206629 /nfs/dbraw/zinc/20/66/29/132206629.db2.gz MXLOYLVWYQWCPP-UHFFFAOYSA-N 1 1 359.267 3.584 50 0 FHAAMO CCCO[C@@H]1CCC[N@H+](C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000095388951 132210410 /nfs/dbraw/zinc/21/04/10/132210410.db2.gz WZPBSEHXXPINGQ-QGZVFWFLSA-N 1 1 371.447 3.960 50 0 FHAAMO CC(C)c1[nH+]ccn1[C@H](C)C(=O)NCCCN1CCCc2ccccc21 ZINC000095392786 132210733 /nfs/dbraw/zinc/21/07/33/132210733.db2.gz CEBNBLDRMJILPE-QGZVFWFLSA-N 1 1 354.498 3.527 50 0 FHAAMO Cc1nc2cc(NC(=O)N3CCN(c4[nH+]cccc4C)CC3)ccc2s1 ZINC000095505971 132212662 /nfs/dbraw/zinc/21/26/62/132212662.db2.gz AFPZZVIGJAARGI-UHFFFAOYSA-N 1 1 367.478 3.662 50 0 FHAAMO O=C1C[C@H](Nc2ccc([NH+]3CCCCC3)cc2)C(=O)N1c1ccc(F)cc1 ZINC000101129540 132233339 /nfs/dbraw/zinc/23/33/39/132233339.db2.gz RJGSNPDMMUYTQS-IBGZPJMESA-N 1 1 367.424 3.560 50 0 FHAAMO Cc1ccc2oc(=O)cc(C[NH+]3CCN(c4ccc(F)cc4)CC3)c2c1 ZINC000054105872 132376096 /nfs/dbraw/zinc/37/60/96/132376096.db2.gz SKUQZIWFTPZQOO-UHFFFAOYSA-N 1 1 352.409 3.563 50 0 FHAAMO Fc1ccc(N2CC[NH+](C3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000000757706 132378351 /nfs/dbraw/zinc/37/83/51/132378351.db2.gz WDNFAICCVIDWKS-UHFFFAOYSA-N 1 1 353.485 3.612 50 0 FHAAMO CCOc1ccc(C[NH+]2CCN(c3nc4ccccc4nc3C)CC2)cc1 ZINC000030003819 132921228 /nfs/dbraw/zinc/92/12/28/132921228.db2.gz DJWDVKLQNBABFG-UHFFFAOYSA-N 1 1 362.477 3.659 50 0 FHAAMO OCc1ccc(C[C@H]2CC[N@@H+](Cc3c[nH]nc3-c3ccc(F)cc3)C2)cc1 ZINC000091966138 221819611 /nfs/dbraw/zinc/81/96/11/221819611.db2.gz YDDZBARJRLBLRK-GOSISDBHSA-N 1 1 365.452 3.773 50 0 FHAAMO Cc1ccccc1[C@@H]1CC[N@@H+](CCNc2nccc(-c3ccncc3)n2)C1 ZINC000096132812 222038547 /nfs/dbraw/zinc/03/85/47/222038547.db2.gz OOBHDYMJXWJCNK-LJQANCHMSA-N 1 1 359.477 3.748 50 0 FHAAMO Cc1cc(C(=O)N2CCC3(C[C@H](c4ccccc4)C[N@@H+]3C)CC2)ccc1O ZINC000096150253 222052277 /nfs/dbraw/zinc/05/22/77/222052277.db2.gz VAWFNXXHARZGNZ-FQEVSTJZSA-N 1 1 364.489 3.795 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000096791704 222130387 /nfs/dbraw/zinc/13/03/87/222130387.db2.gz GKRHOMATCHHPOV-ZDUSSCGKSA-N 1 1 368.403 3.942 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000096791704 222130389 /nfs/dbraw/zinc/13/03/89/222130389.db2.gz GKRHOMATCHHPOV-ZDUSSCGKSA-N 1 1 368.403 3.942 50 0 FHAAMO C[NH+](C)[C@H](C(=O)Cn1c2ccccc2nc1[C@@H]1CCCO1)c1ccccc1 ZINC000096835504 222131995 /nfs/dbraw/zinc/13/19/95/222131995.db2.gz GEVQUAPAKMIDAX-SFTDATJTSA-N 1 1 363.461 3.760 50 0 FHAAMO O=C(C[NH+]1CCCC1)N1N=C(c2ccco2)C[C@@H]1c1cccc(Cl)c1 ZINC000097165245 222165664 /nfs/dbraw/zinc/16/56/64/222165664.db2.gz NSAKXFRAHZRORK-QGZVFWFLSA-N 1 1 357.841 3.707 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)NCc1cccc(Cl)c1)c1nc2c(s1)CCCC2 ZINC000097165645 222165784 /nfs/dbraw/zinc/16/57/84/222165784.db2.gz FYLVPKCJTWWIAX-GFCCVEGCSA-N 1 1 363.914 3.642 50 0 FHAAMO OCc1ccccc1C[NH+]1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000097480549 222184832 /nfs/dbraw/zinc/18/48/32/222184832.db2.gz CXZLCRPBEJRUPP-UHFFFAOYSA-N 1 1 365.304 3.804 50 0 FHAAMO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(C)no2)cc1Cn1cccn1 ZINC000097527206 222188524 /nfs/dbraw/zinc/18/85/24/222188524.db2.gz YDSDRNQVWYRRSJ-SFHVURJKSA-N 1 1 352.438 3.574 50 0 FHAAMO COc1ccc(-n2cccn2)c(C[N@H+]2CCC[C@@H]2c2c(C)noc2C)c1 ZINC000097618931 222200074 /nfs/dbraw/zinc/20/00/74/222200074.db2.gz WVXSZZYTYNLOQM-LJQANCHMSA-N 1 1 352.438 3.823 50 0 FHAAMO O=C(NC[C@H](c1ccc(Cl)cc1)[NH+]1CCCC1)c1cc(C2CC2)n[nH]1 ZINC000097551458 222191649 /nfs/dbraw/zinc/19/16/49/222191649.db2.gz HHTCHNLJKHJPSC-GOSISDBHSA-N 1 1 358.873 3.507 50 0 FHAAMO Cc1nc(CC(=O)N(Cc2ccccc2)[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cs1 ZINC000101883079 222286104 /nfs/dbraw/zinc/28/61/04/222286104.db2.gz KVQILJYECNUZIH-PMOLBWCYSA-N 1 1 369.534 3.648 50 0 FHAAMO C[N@@H+]1CCN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccccc1 ZINC000104458678 222358260 /nfs/dbraw/zinc/35/82/60/222358260.db2.gz MOUOUQRHZNXDQP-SFHVURJKSA-N 1 1 368.868 3.879 50 0 FHAAMO C[N@H+]1CCN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccccc1 ZINC000104458678 222358265 /nfs/dbraw/zinc/35/82/65/222358265.db2.gz MOUOUQRHZNXDQP-SFHVURJKSA-N 1 1 368.868 3.879 50 0 FHAAMO COc1ccc(OC)c([C@@H](C)NC(=O)C[N@H+](C)[C@H](C)c2cccs2)c1 ZINC000106546593 222386909 /nfs/dbraw/zinc/38/69/09/222386909.db2.gz NRNDIIDAOMAEFD-ZIAGYGMSSA-N 1 1 362.495 3.636 50 0 FHAAMO COc1ccc(OC)c([C@@H](C)NC(=O)C[N@@H+](C)[C@H](C)c2cccs2)c1 ZINC000106546593 222386910 /nfs/dbraw/zinc/38/69/10/222386910.db2.gz NRNDIIDAOMAEFD-ZIAGYGMSSA-N 1 1 362.495 3.636 50 0 FHAAMO CN(Cc1cc(C2CC2)on1)C(=O)NCC[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000426434462 263589927 /nfs/dbraw/zinc/58/99/27/263589927.db2.gz MMPSBHPMEWUZEU-LJQANCHMSA-N 1 1 374.529 3.881 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1Cc1cccc(NC(=O)NCCNc2cccnc2)c1 ZINC000299800572 534162526 /nfs/dbraw/zinc/16/25/26/534162526.db2.gz WZAMANCOXFRFMO-QGZVFWFLSA-N 1 1 367.497 3.690 50 0 FHAAMO CC(C)c1nnc(C[N@@H+]2CCC[C@@H](c3nccn3Cc3ccccc3)C2)o1 ZINC000082155978 519886445 /nfs/dbraw/zinc/88/64/45/519886445.db2.gz ZVRMVNDVQPITCB-GOSISDBHSA-N 1 1 365.481 3.817 50 0 FHAAMO CC(C)c1nnc(C[N@H+]2CCC[C@@H](c3nccn3Cc3ccccc3)C2)o1 ZINC000082155978 519886448 /nfs/dbraw/zinc/88/64/48/519886448.db2.gz ZVRMVNDVQPITCB-GOSISDBHSA-N 1 1 365.481 3.817 50 0 FHAAMO CCOCc1cc(C[N@@H+]2CCC[C@H]2c2ccc(C(N)=O)s2)ccc1OC ZINC000020119352 520186911 /nfs/dbraw/zinc/18/69/11/520186911.db2.gz CCUUWRZRICHTOC-INIZCTEOSA-N 1 1 374.506 3.729 50 0 FHAAMO CCOCc1cc(C[N@H+]2CCC[C@H]2c2ccc(C(N)=O)s2)ccc1OC ZINC000020119352 520186916 /nfs/dbraw/zinc/18/69/16/520186916.db2.gz CCUUWRZRICHTOC-INIZCTEOSA-N 1 1 374.506 3.729 50 0 FHAAMO CCCOc1c(C[NH2+]Cc2ccccn2)cc(Br)cc1OC ZINC000020934405 520292625 /nfs/dbraw/zinc/29/26/25/520292625.db2.gz XZWYCVIOHSALEZ-UHFFFAOYSA-N 1 1 365.271 3.931 50 0 FHAAMO CCCOc1ccc([C@@H](O)[C@@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000020790166 520418673 /nfs/dbraw/zinc/41/86/73/520418673.db2.gz TVWLDXUMIAMJBJ-FCHUYYIVSA-N 1 1 355.478 3.625 50 0 FHAAMO CCCOc1ccc([C@H](O)[C@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000020790178 520430543 /nfs/dbraw/zinc/43/05/43/520430543.db2.gz TVWLDXUMIAMJBJ-YADHBBJMSA-N 1 1 355.478 3.625 50 0 FHAAMO CCOc1ccc(CN2CC[NH+](Cc3ccc(OCC)cc3)CC2)cc1 ZINC000019842255 520976045 /nfs/dbraw/zinc/97/60/45/520976045.db2.gz GEURQSOXMLYJMW-UHFFFAOYSA-N 1 1 354.494 3.802 50 0 FHAAMO COC[C@H]1CCC[N@@H+](Cc2nc(-c3cccc(OC)c3OC)oc2C)C1 ZINC000020909470 522832381 /nfs/dbraw/zinc/83/23/81/522832381.db2.gz XKZAYSMKRQSTGN-HNNXBMFYSA-N 1 1 360.454 3.526 50 0 FHAAMO CCn1ccc2cc(C[N@H+]3CC[C@@]4(C3)CCCN(CC3CC3)C4=O)ccc21 ZINC000091677659 523494944 /nfs/dbraw/zinc/49/49/44/523494944.db2.gz QBAUONANDVEPOR-HSZRJFAPSA-N 1 1 365.521 3.886 50 0 FHAAMO COc1ccc(C[N@@H+](C)[C@@H]2CCCN(Cc3ccccc3F)C2)cc1O ZINC000020166680 524010311 /nfs/dbraw/zinc/01/03/11/524010311.db2.gz ZAXLLBZMOFFLTH-GOSISDBHSA-N 1 1 358.457 3.636 50 0 FHAAMO COc1ccc(CN(C)[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)cc1O ZINC000020166680 524010314 /nfs/dbraw/zinc/01/03/14/524010314.db2.gz ZAXLLBZMOFFLTH-GOSISDBHSA-N 1 1 358.457 3.636 50 0 FHAAMO COc1ccc(CN(C)[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)cc1O ZINC000020166680 524010316 /nfs/dbraw/zinc/01/03/16/524010316.db2.gz 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O=C(CC[C@H]1CCC[N@H+](Cc2ccccc2C(F)(F)F)C1)NC1CC1 ZINC000011873638 570710471 /nfs/dbraw/zinc/71/04/71/570710471.db2.gz HTRZERBANPAQNW-CQSZACIVSA-N 1 1 354.416 3.976 50 0 FHAAMO O=C(CCc1ccsc1)N[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000011999596 570714144 /nfs/dbraw/zinc/71/41/44/570714144.db2.gz OKKDYZBSTAYNQZ-FQEVSTJZSA-N 1 1 356.535 3.894 50 0 FHAAMO O=C(NC[C@@H]1CCC[N@H+](Cc2nccs2)C1)c1cccc2ccccc21 ZINC000012074372 570716662 /nfs/dbraw/zinc/71/66/62/570716662.db2.gz WHPFLNOTDGMLEW-INIZCTEOSA-N 1 1 365.502 3.938 50 0 FHAAMO O=C(NC[C@@H]1CCC[N@@H+](Cc2nccs2)C1)c1cccc2ccccc21 ZINC000012074372 570716667 /nfs/dbraw/zinc/71/66/67/570716667.db2.gz WHPFLNOTDGMLEW-INIZCTEOSA-N 1 1 365.502 3.938 50 0 FHAAMO CC(=O)Nc1ccc(C[N@H+](Cc2ccc(F)cc2)C[C@@H]2CCCO2)cc1 ZINC000012187042 570724780 /nfs/dbraw/zinc/72/47/80/570724780.db2.gz CLARXHXWAWNVFQ-NRFANRHFSA-N 1 1 356.441 3.965 50 0 FHAAMO CSc1ncc(C[N@@H+]2CCC[C@@](CO)(CCCc3ccccc3)C2)cn1 ZINC000012298683 570733202 /nfs/dbraw/zinc/73/32/02/570733202.db2.gz YELBZFPAXJMXKP-NRFANRHFSA-N 1 1 371.550 3.796 50 0 FHAAMO CSc1ncc(C[N@H+]2CCC[C@@](CO)(CCCc3ccccc3)C2)cn1 ZINC000012298683 570733204 /nfs/dbraw/zinc/73/32/04/570733204.db2.gz YELBZFPAXJMXKP-NRFANRHFSA-N 1 1 371.550 3.796 50 0 FHAAMO CCOC(=O)N1CCC([N@H+]2CCC[C@H](Nc3ccc(C)c(C)c3)C2)CC1 ZINC000012300435 570733932 /nfs/dbraw/zinc/73/39/32/570733932.db2.gz XQNDPEQECZGNPN-IBGZPJMESA-N 1 1 359.514 3.801 50 0 FHAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@H]1CCC[N@H+]1CCCC(F)(F)F ZINC000012313783 570735698 /nfs/dbraw/zinc/73/56/98/570735698.db2.gz HKNQJYSUXMFOHR-MRXNPFEDSA-N 1 1 366.387 3.618 50 0 FHAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@H]1CCC[N@@H+]1CCCC(F)(F)F ZINC000012313783 570735701 /nfs/dbraw/zinc/73/57/01/570735701.db2.gz HKNQJYSUXMFOHR-MRXNPFEDSA-N 1 1 366.387 3.618 50 0 FHAAMO COc1ccc(C(=O)[C@H]2CCC[N@H+](Cc3cccc(C)n3)C2)c(OC)c1 ZINC000012309040 570735818 /nfs/dbraw/zinc/73/58/18/570735818.db2.gz NQUJDGYMGQUXCC-INIZCTEOSA-N 1 1 354.450 3.502 50 0 FHAAMO COc1ccc(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(C)n3)C2)c(OC)c1 ZINC000012309040 570735822 /nfs/dbraw/zinc/73/58/22/570735822.db2.gz NQUJDGYMGQUXCC-INIZCTEOSA-N 1 1 354.450 3.502 50 0 FHAAMO O=C(N[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1)c1ccc2cc[nH]c2c1 ZINC000012387229 570741309 /nfs/dbraw/zinc/74/13/09/570741309.db2.gz KMWHFCLEAARUCL-OAQYLSRUSA-N 1 1 361.489 3.995 50 0 FHAAMO Cc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)s1 ZINC000012432872 570744699 /nfs/dbraw/zinc/74/46/99/570744699.db2.gz IIPRGMWCASNTEF-SFHVURJKSA-N 1 1 354.519 3.760 50 0 FHAAMO Cc1ncc(C[NH2+][C@@H](C)c2cnc(N3CCCCCCC3)nc2C)cn1 ZINC000012455469 570747064 /nfs/dbraw/zinc/74/70/64/570747064.db2.gz PJGDCJAWTPMEOD-HNNXBMFYSA-N 1 1 354.502 3.505 50 0 FHAAMO C[C@@H]1CCC[N@H+]([C@H](C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2)C1 ZINC000004436860 570782867 /nfs/dbraw/zinc/78/28/67/570782867.db2.gz ZPVUAOURUGLWNO-IERDGZPVSA-N 1 1 366.461 3.870 50 0 FHAAMO COc1cccc([C@@H]2Nc3sc4c(c3C(=O)N2)CC[N@@H+](C(C)C)C4)c1 ZINC000004554074 570833577 /nfs/dbraw/zinc/83/35/77/570833577.db2.gz JOQRXJFDUAKZNY-KRWDZBQOSA-N 1 1 357.479 3.952 50 0 FHAAMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2ccc(F)cc2Br)C1 ZINC000046991396 570877975 /nfs/dbraw/zinc/87/79/75/570877975.db2.gz JNYISLPIQDXVMT-ZDUSSCGKSA-N 1 1 371.294 3.830 50 0 FHAAMO C[C@@H]1C(=O)N(C[N@@H+](C2CC2)C2CCCC2)C(=O)N1c1ccc(Cl)cc1 ZINC000032923205 570862868 /nfs/dbraw/zinc/86/28/68/570862868.db2.gz JOYRTJKDGIHDSE-CYBMUJFWSA-N 1 1 361.873 3.862 50 0 FHAAMO COc1ccccc1OCC(=O)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000046934247 570877549 /nfs/dbraw/zinc/87/75/49/570877549.db2.gz NUYDWTNOEDLVJG-KRWDZBQOSA-N 1 1 368.477 3.945 50 0 FHAAMO CCc1sc(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1C ZINC000046933815 570877609 /nfs/dbraw/zinc/87/76/09/570877609.db2.gz MFFSTTIRWWULGU-UHFFFAOYSA-N 1 1 357.523 3.619 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc(F)ccc2Br)C1 ZINC000047415637 570887983 /nfs/dbraw/zinc/88/79/83/570887983.db2.gz YLTGEQKHQFLOPE-BETUJISGSA-N 1 1 371.294 3.686 50 0 FHAAMO Fc1cccc(C[N@@H+]2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)c1 ZINC000019595240 570895786 /nfs/dbraw/zinc/89/57/86/570895786.db2.gz AMRIRKXCTVNVBP-QFIPXVFZSA-N 1 1 353.485 3.612 50 0 FHAAMO Fc1cccc(C[N@H+]2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)c1 ZINC000019595240 570895787 /nfs/dbraw/zinc/89/57/87/570895787.db2.gz AMRIRKXCTVNVBP-QFIPXVFZSA-N 1 1 353.485 3.612 50 0 FHAAMO FC(F)(F)c1cccc(N2CCN([C@H]3CCC[N@@H+](CC4CC4)C3)CC2)c1 ZINC000019595187 570895831 /nfs/dbraw/zinc/89/58/31/570895831.db2.gz KFWDOEGWRPCTGI-IBGZPJMESA-N 1 1 367.459 3.702 50 0 FHAAMO COc1ccc(COC[C@H](O)C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)cc1 ZINC000108922247 570909699 /nfs/dbraw/zinc/90/96/99/570909699.db2.gz WDTSVCNVMNPGFD-XMSQKQJNSA-N 1 1 369.505 3.873 50 0 FHAAMO CN1CCN(CCC[NH2+]Cc2c3ccccc3[nH]c2-c2ccccc2)CC1 ZINC000022814665 570950289 /nfs/dbraw/zinc/95/02/89/570950289.db2.gz NDLRUPCEBRSYFM-UHFFFAOYSA-N 1 1 362.521 3.562 50 0 FHAAMO CCC(CC)[C@H](CNC(=O)c1cccc(Cl)c1Cl)[NH+]1CCOCC1 ZINC000022898662 570952782 /nfs/dbraw/zinc/95/27/82/570952782.db2.gz XTRORTXQVHWHHV-INIZCTEOSA-N 1 1 373.324 3.860 50 0 FHAAMO COc1ccc(CN(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)cc1F ZINC000023374146 570962780 /nfs/dbraw/zinc/96/27/80/570962780.db2.gz YIOIOZJLSNZVHD-FQEVSTJZSA-N 1 1 356.485 3.973 50 0 FHAAMO OCC[C@H]1CN(Cc2cc3ccccc3[nH]2)CC[N@H+]1CC1CCCCC1 ZINC000023374809 570962827 /nfs/dbraw/zinc/96/28/27/570962827.db2.gz LKTDSPVXGFTFGZ-NRFANRHFSA-N 1 1 355.526 3.617 50 0 FHAAMO NC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2ccc(-c3csnn3)cc2)s1 ZINC000023478399 570964208 /nfs/dbraw/zinc/96/42/08/570964208.db2.gz ICXLACZDOCPUTD-OAHLLOKOSA-N 1 1 370.503 3.703 50 0 FHAAMO Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C(=O)Nc3ccccc3)CC2)c1 ZINC000024855700 570984213 /nfs/dbraw/zinc/98/42/13/570984213.db2.gz GPENWUZEDJZFEC-KRWDZBQOSA-N 1 1 365.477 3.673 50 0 FHAAMO O=c1nc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)[nH]c2sc3c(c21)CCC3 ZINC000025440145 570995957 /nfs/dbraw/zinc/99/59/57/570995957.db2.gz UTIZTGYTLNHIPN-HNNXBMFYSA-N 1 1 365.502 3.680 50 0 FHAAMO O=c1nc(C[N@H+]2CCC[C@H]2Cc2ccccc2)[nH]c2sc3c(c21)CCC3 ZINC000025440145 570995959 /nfs/dbraw/zinc/99/59/59/570995959.db2.gz UTIZTGYTLNHIPN-HNNXBMFYSA-N 1 1 365.502 3.680 50 0 FHAAMO Cc1c2cc(F)ccc2oc1C(=O)N1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000069950633 571003657 /nfs/dbraw/zinc/00/36/57/571003657.db2.gz WVINQSZSEABRHI-JKIFEVAISA-N 1 1 374.456 3.594 50 0 FHAAMO Cc1c2cc(F)ccc2oc1C(=O)N1CCC[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000069950633 571003658 /nfs/dbraw/zinc/00/36/58/571003658.db2.gz WVINQSZSEABRHI-JKIFEVAISA-N 1 1 374.456 3.594 50 0 FHAAMO Cc1ccc(-c2noc([C@@H](C)N3CC[NH+](Cc4ccccc4)CC3)n2)cc1 ZINC000026597641 571006706 /nfs/dbraw/zinc/00/67/06/571006706.db2.gz UMEJITVUHDJHPA-GOSISDBHSA-N 1 1 362.477 3.924 50 0 FHAAMO CC(C)c1ccc(C[NH+]2CCN(C[C@@H](O)c3ccccc3F)CC2)cc1 ZINC000026904520 571008515 /nfs/dbraw/zinc/00/85/15/571008515.db2.gz WDZCBGGQBDLGOU-JOCHJYFZSA-N 1 1 356.485 3.800 50 0 FHAAMO Cc1noc([C@H](C)N2CC[NH+](Cc3ccc(-c4ccccc4)s3)CC2)n1 ZINC000027268691 571011397 /nfs/dbraw/zinc/01/13/97/571011397.db2.gz FGBYWZAKNCKQJW-HNNXBMFYSA-N 1 1 368.506 3.985 50 0 FHAAMO CCN1CC[NH+](Cc2ccc(NC(=O)CCc3ccccc3F)cc2)CC1 ZINC000040107961 571022094 /nfs/dbraw/zinc/02/20/94/571022094.db2.gz IEOCYHFCJFYZBR-UHFFFAOYSA-N 1 1 369.484 3.535 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cn1)[N@H+](C)CCOc1ccccc1Cl ZINC000029154080 571036969 /nfs/dbraw/zinc/03/69/69/571036969.db2.gz PANFDOGQMFTXDC-LBPRGKRZSA-N 1 1 368.264 3.726 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cn1)[N@@H+](C)CCOc1ccccc1Cl ZINC000029154080 571036972 /nfs/dbraw/zinc/03/69/72/571036972.db2.gz PANFDOGQMFTXDC-LBPRGKRZSA-N 1 1 368.264 3.726 50 0 FHAAMO Cc1ccccc1NC(=O)C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000008310282 571039136 /nfs/dbraw/zinc/03/91/36/571039136.db2.gz DTATYOIEPYFIFK-LJQANCHMSA-N 1 1 366.461 3.932 50 0 FHAAMO Cc1ccccc1NC(=O)C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000008310282 571039140 /nfs/dbraw/zinc/03/91/40/571039140.db2.gz DTATYOIEPYFIFK-LJQANCHMSA-N 1 1 366.461 3.932 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(-n2ccnc2)cc1)c1ccccc1Cl ZINC000029402782 571039496 /nfs/dbraw/zinc/03/94/96/571039496.db2.gz STMSVCOCNUJVLQ-LJQANCHMSA-N 1 1 368.868 3.558 50 0 FHAAMO C[NH+]1CCN(C(=S)c2cn(Cc3ccc(F)cc3)c3ccccc23)CC1 ZINC000004140366 571049992 /nfs/dbraw/zinc/04/99/92/571049992.db2.gz NKUVQDPCXUNMAB-UHFFFAOYSA-N 1 1 367.493 3.752 50 0 FHAAMO Cc1ccc(C)c(NC(=S)N2CCC([N@@H+](C)C[C@@H]3CCCO3)CC2)c1 ZINC000008579791 571051048 /nfs/dbraw/zinc/05/10/48/571051048.db2.gz CPABGGWIKPVTAR-SFHVURJKSA-N 1 1 361.555 3.575 50 0 FHAAMO C[C@H]1CCSCC[N@@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000225667486 571053950 /nfs/dbraw/zinc/05/39/50/571053950.db2.gz NCKMOGQKMWDUTR-NSHDSACASA-N 1 1 368.300 3.827 50 0 FHAAMO C[C@H]1CCSCC[N@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000225667486 571053952 /nfs/dbraw/zinc/05/39/52/571053952.db2.gz NCKMOGQKMWDUTR-NSHDSACASA-N 1 1 368.300 3.827 50 0 FHAAMO Cc1sc(NC(=O)C[N@H+](C)CCOc2cccc(F)c2)c(C)c1C ZINC000072304865 571060704 /nfs/dbraw/zinc/06/07/04/571060704.db2.gz 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COc1cccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccc(OC)c(O)c3)C2)c1 ZINC000012757386 220026010 /nfs/dbraw/zinc/02/60/10/220026010.db2.gz SZLNMGZIWFEMNU-QGZVFWFLSA-N 1 1 355.434 3.504 50 0 FHAAMO CC(=O)c1ccc(C(=O)N(C)[C@H]2CCC[N@H+](CCc3ccccc3)C2)s1 ZINC000012836781 220034310 /nfs/dbraw/zinc/03/43/10/220034310.db2.gz QEMCUFPCWURJQB-SFHVURJKSA-N 1 1 370.518 3.730 50 0 FHAAMO CC(=O)c1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)s1 ZINC000012836781 220034315 /nfs/dbraw/zinc/03/43/15/220034315.db2.gz QEMCUFPCWURJQB-SFHVURJKSA-N 1 1 370.518 3.730 50 0 FHAAMO CCN(C(=O)C[N@@H+]1CCC[C@@H]1c1cc(OC)ccc1OC)c1ccccc1 ZINC000012789427 220030643 /nfs/dbraw/zinc/03/06/43/220030643.db2.gz WFVDKTAYHQOTCJ-HXUWFJFHSA-N 1 1 368.477 3.894 50 0 FHAAMO CCN(C(=O)C[N@H+]1CCC[C@@H]1c1cc(OC)ccc1OC)c1ccccc1 ZINC000012789427 220030646 /nfs/dbraw/zinc/03/06/46/220030646.db2.gz WFVDKTAYHQOTCJ-HXUWFJFHSA-N 1 1 368.477 3.894 50 0 FHAAMO O=C(C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1)Nc1cccc(F)c1 ZINC000012873507 220037742 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C[N@@H+](Cc1ccc(Br)cc1)[C@H](C(=O)NC1CC1)c1ccccc1 ZINC000012998957 220050809 /nfs/dbraw/zinc/05/08/09/220050809.db2.gz WXHQCSIXYRZXIN-SFHVURJKSA-N 1 1 373.294 3.901 50 0 FHAAMO O=C(CCc1nc2ccccc2s1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000014085472 220105140 /nfs/dbraw/zinc/10/51/40/220105140.db2.gz RYCAPUIZQNMDFN-KRWDZBQOSA-N 1 1 365.502 3.620 50 0 FHAAMO COc1ccccc1[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1)[NH+](C)C ZINC000014163078 220112463 /nfs/dbraw/zinc/11/24/63/220112463.db2.gz UNUGODZJUQFFCT-MRXNPFEDSA-N 1 1 366.383 3.747 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cc1csc(-c2ccccc2)n1 ZINC000014226236 220116917 /nfs/dbraw/zinc/11/69/17/220116917.db2.gz ZMUXQFHYJODAIZ-MRXNPFEDSA-N 1 1 357.523 3.733 50 0 FHAAMO OC[C@]1(CCc2ccccc2)CCC[N@@H+](Cc2ccc3c(c2)CCO3)C1 ZINC000014962952 220136923 /nfs/dbraw/zinc/13/69/23/220136923.db2.gz GXTMWEUWAIPZDY-QHCPKHFHSA-N 1 1 351.490 3.829 50 0 FHAAMO Cc1cc(C(=O)N(C)[C@@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)c(C)o1 ZINC000014962155 220137205 /nfs/dbraw/zinc/13/72/05/220137205.db2.gz GENBASIXHACESF-LJQANCHMSA-N 1 1 352.478 3.600 50 0 FHAAMO Cc1cc(C(=O)N(C)[C@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)c(C)o1 ZINC000014962159 220137624 /nfs/dbraw/zinc/13/76/24/220137624.db2.gz GENBASIXHACESF-IBGZPJMESA-N 1 1 352.478 3.600 50 0 FHAAMO C[N@H+]1CCCN(c2ccc(-c3nc(-c4cccc(Cl)c4)no3)cn2)CC1 ZINC000015076203 220147600 /nfs/dbraw/zinc/14/76/00/220147600.db2.gz NZKYWYLTZSUQDV-UHFFFAOYSA-N 1 1 369.856 3.594 50 0 FHAAMO CCc1ncc(C[NH2+][C@H](C)c2cnc(N(C)C3CCCCC3)nc2C)cn1 ZINC000015062955 220143826 /nfs/dbraw/zinc/14/38/26/220143826.db2.gz DRVZOBLQMIAMEN-OAHLLOKOSA-N 1 1 368.529 3.757 50 0 FHAAMO Cc1ccc(C[N@H+]2CC[C@@]3(C2)CCCN(Cc2cccc(C)c2)C3=O)o1 ZINC000015063295 220144213 /nfs/dbraw/zinc/14/42/13/220144213.db2.gz RFDMDYAKANBURM-JOCHJYFZSA-N 1 1 352.478 3.911 50 0 FHAAMO CCOc1c(Cl)cc(C[NH2+][C@@H](C)c2nnc3ccccn32)cc1OC ZINC000015594209 220157005 /nfs/dbraw/zinc/15/70/05/220157005.db2.gz HCXRPSDMBIWQNV-LBPRGKRZSA-N 1 1 360.845 3.641 50 0 FHAAMO Cc1ccc(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1C ZINC000015831721 220166012 /nfs/dbraw/zinc/16/60/12/220166012.db2.gz SYAQIVGQXPNNHM-HXUWFJFHSA-N 1 1 351.494 3.990 50 0 FHAAMO Cc1ccc([C@@H](CNC(=O)c2cc(-c3ccc(C)cc3)on2)[NH+](C)C)o1 ZINC000015860402 220169115 /nfs/dbraw/zinc/16/91/15/220169115.db2.gz XVFDRHXPSPVEKM-QGZVFWFLSA-N 1 1 353.422 3.584 50 0 FHAAMO C[C@@H](NC(=O)[C@H](C)[N@H+](C)CCOc1cccc(Cl)c1)c1ccccc1 ZINC000016421809 220183894 /nfs/dbraw/zinc/18/38/94/220183894.db2.gz RAHNBVHFJRJVJM-CVEARBPZSA-N 1 1 360.885 3.917 50 0 FHAAMO C[C@@H](NC(=O)[C@H](C)[N@@H+](C)CCOc1cccc(Cl)c1)c1ccccc1 ZINC000016421809 220183897 /nfs/dbraw/zinc/18/38/97/220183897.db2.gz RAHNBVHFJRJVJM-CVEARBPZSA-N 1 1 360.885 3.917 50 0 FHAAMO COc1ccc(CN2CC[NH+](Cc3ccc(SC)cc3)CC2)c(OC)c1 ZINC000019360125 220253485 /nfs/dbraw/zinc/25/34/85/220253485.db2.gz XTBXBZWORVITLO-UHFFFAOYSA-N 1 1 372.534 3.744 50 0 FHAAMO Cc1ccc(C[N@H+]2CCN(Cc3ccccc3Cl)C[C@@H]2CCO)cc1 ZINC000019741854 220292479 /nfs/dbraw/zinc/29/24/79/220292479.db2.gz SKLRDKHSBUJWLC-FQEVSTJZSA-N 1 1 358.913 3.717 50 0 FHAAMO Cc1c2cc(C)ccc2oc1C(=O)N1CCC[N@H+](Cc2ccncc2)CC1 ZINC000020255346 220319554 /nfs/dbraw/zinc/31/95/54/220319554.db2.gz CWLWNCKDZIQPHN-UHFFFAOYSA-N 1 1 363.461 3.793 50 0 FHAAMO Cc1c2cc(C)ccc2oc1C(=O)N1CCC[N@@H+](Cc2ccncc2)CC1 ZINC000020255346 220319560 /nfs/dbraw/zinc/31/95/60/220319560.db2.gz CWLWNCKDZIQPHN-UHFFFAOYSA-N 1 1 363.461 3.793 50 0 FHAAMO O=C(Nc1ccc(Br)cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020522524 220330897 /nfs/dbraw/zinc/33/08/97/220330897.db2.gz CVLDFZUJYJVHMW-UHFFFAOYSA-N 1 1 374.282 3.799 50 0 FHAAMO CC[N@@H+](Cc1ccccc1)[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccccc1 ZINC000020867691 220343436 /nfs/dbraw/zinc/34/34/36/220343436.db2.gz IZROUTVHUSDGCV-SFTDATJTSA-N 1 1 372.534 3.798 50 0 FHAAMO C[N@@H+](CCCNC(=O)c1cccc2c1SCCC2=O)C1CCCCC1 ZINC000021103296 220350661 /nfs/dbraw/zinc/35/06/61/220350661.db2.gz GTZOJGNASOHYLI-UHFFFAOYSA-N 1 1 360.523 3.750 50 0 FHAAMO Cc1ccc([C@H](CNC(=O)c2cc(-c3ccccc3)on2)[NH+]2CCCC2)o1 ZINC000021659792 220362419 /nfs/dbraw/zinc/36/24/19/220362419.db2.gz UHBOXDMDWVHDCH-SFHVURJKSA-N 1 1 365.433 3.810 50 0 FHAAMO CCCC[N@@H+](CC)CCNc1ncnc2onc(-c3ccccc3OC)c21 ZINC000021715015 220365041 /nfs/dbraw/zinc/36/50/41/220365041.db2.gz FWJBLRCCFDSVOR-UHFFFAOYSA-N 1 1 369.469 3.827 50 0 FHAAMO C[NH+]1CCN(Cc2ccc(C(=O)c3cc(Cl)cc(Cl)c3)cc2)CC1 ZINC000022027953 220374479 /nfs/dbraw/zinc/37/44/79/220374479.db2.gz MZSJTZAGIVVAOO-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO C[NH+]1CCN(Cc2cccc(C(=O)c3cccc(Cl)c3Cl)c2)CC1 ZINC000022028063 220373543 /nfs/dbraw/zinc/37/35/43/220373543.db2.gz UEGCGOULNAUDQG-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO Cc1cccc(C2=NN(C(=O)C[NH+]3CCCC3)[C@H](c3ccccc3F)C2)c1 ZINC000036345440 220811191 /nfs/dbraw/zinc/81/11/91/220811191.db2.gz QWMIRUMINBANOO-NRFANRHFSA-N 1 1 365.452 3.908 50 0 FHAAMO CC[N@@H+]1CCc2c(sc3nc(SC)n(-c4ccccc4)c(=O)c32)C1 ZINC000051330901 221036219 /nfs/dbraw/zinc/03/62/19/221036219.db2.gz UYRQVOANCROZDX-UHFFFAOYSA-N 1 1 357.504 3.547 50 0 FHAAMO CC[N@H+]1CCc2c(sc3nc(SC)n(-c4ccccc4)c(=O)c32)C1 ZINC000051330901 221036220 /nfs/dbraw/zinc/03/62/20/221036220.db2.gz UYRQVOANCROZDX-UHFFFAOYSA-N 1 1 357.504 3.547 50 0 FHAAMO Cc1ccnc(C[C@@H](C)[N@@H+](C)Cc2cnc(NCc3ccccc3)nc2)c1 ZINC000055195649 221061166 /nfs/dbraw/zinc/06/11/66/221061166.db2.gz AJPYLAULNMTQKL-GOSISDBHSA-N 1 1 361.493 3.855 50 0 FHAAMO COCC[N@@H+](Cc1cccs1)Cc1cccc(Oc2ncccn2)c1 ZINC000055165861 221061670 /nfs/dbraw/zinc/06/16/70/221061670.db2.gz FOMZPZCYQOSZDO-UHFFFAOYSA-N 1 1 355.463 3.979 50 0 FHAAMO CN(C)c1nc(Cl)c(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)s1 ZINC000055244178 221063129 /nfs/dbraw/zinc/06/31/29/221063129.db2.gz QZSQFERLPVCSBM-CQSZACIVSA-N 1 1 350.919 3.939 50 0 FHAAMO CN(C)c1nc(Cl)c(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)s1 ZINC000055244178 221063132 /nfs/dbraw/zinc/06/31/32/221063132.db2.gz QZSQFERLPVCSBM-CQSZACIVSA-N 1 1 350.919 3.939 50 0 FHAAMO Cc1cc(NC(=O)C[NH2+][C@H](c2cccs2)c2ccc3c(c2)CCC3)no1 ZINC000053814203 221048585 /nfs/dbraw/zinc/04/85/85/221048585.db2.gz PEZNDCZIWWENKC-FQEVSTJZSA-N 1 1 367.474 3.851 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H](COCc2ccccc2)C1)Nc1ccc(F)cc1F ZINC000056908435 221081626 /nfs/dbraw/zinc/08/16/26/221081626.db2.gz ZBRZHIOBZFOIQT-KRWDZBQOSA-N 1 1 374.431 3.832 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H](COCc2ccccc2)C1)Nc1ccc(F)cc1F ZINC000056908435 221081630 /nfs/dbraw/zinc/08/16/30/221081630.db2.gz ZBRZHIOBZFOIQT-KRWDZBQOSA-N 1 1 374.431 3.832 50 0 FHAAMO Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)no1 ZINC000057154923 221084017 /nfs/dbraw/zinc/08/40/17/221084017.db2.gz MLWJYMKFAJQRJS-UYAOXDASSA-N 1 1 353.466 3.559 50 0 FHAAMO CC[C@H](CO)[N@H+](Cc1cnc(-c2cccc(C)c2)nc1)Cc1ccccn1 ZINC000055401253 221068451 /nfs/dbraw/zinc/06/84/51/221068451.db2.gz OCTWRNNQKNEQRJ-OAQYLSRUSA-N 1 1 362.477 3.620 50 0 FHAAMO CC[C@H](CO)[N@@H+](Cc1cnc(-c2cccc(C)c2)nc1)Cc1ccccn1 ZINC000055401253 221068454 /nfs/dbraw/zinc/06/84/54/221068454.db2.gz OCTWRNNQKNEQRJ-OAQYLSRUSA-N 1 1 362.477 3.620 50 0 FHAAMO COc1cc(C[N@@H+](CCO)Cc2ccc(SC)cc2)cc(Cl)c1O ZINC000055384167 221068458 /nfs/dbraw/zinc/06/84/58/221068458.db2.gz VOMMBSYJKOCWGF-UHFFFAOYSA-N 1 1 367.898 3.771 50 0 FHAAMO COc1ccccc1[C@H](C)[NH2+]Cc1nc2ccc(Cl)cc2n1CCO ZINC000057838565 221094203 /nfs/dbraw/zinc/09/42/03/221094203.db2.gz SOVRIRFPZUDHGT-ZDUSSCGKSA-N 1 1 359.857 3.541 50 0 FHAAMO OCCOc1cccc(C[N@H+]2CCCC[C@H]2CCc2ccc(O)cc2)c1 ZINC000063832872 221144202 /nfs/dbraw/zinc/14/42/02/221144202.db2.gz LAZKTHOBSBJHRQ-FQEVSTJZSA-N 1 1 355.478 3.751 50 0 FHAAMO CC(=O)Nc1ccc2nc(C[N@H+](Cc3cnn(C)c3)CC(C)C)ccc2c1 ZINC000063882813 221144328 /nfs/dbraw/zinc/14/43/28/221144328.db2.gz IQRPTQZGPCKXJC-UHFFFAOYSA-N 1 1 365.481 3.585 50 0 FHAAMO Fc1ccccc1C[N@H+]1CCC[C@@H](c2nncn2Cc2ccccc2)C1 ZINC000065287800 221195594 /nfs/dbraw/zinc/19/55/94/221195594.db2.gz VULDMLYPOJMDRH-LJQANCHMSA-N 1 1 350.441 3.845 50 0 FHAAMO CCn1c2ccccc2nc1C[N@@H+]1CC[C@@H](c2sccc2C)[C@H](O)C1 ZINC000065406034 221213563 /nfs/dbraw/zinc/21/35/63/221213563.db2.gz VALZNKMQGAVYPC-CRAIPNDOSA-N 1 1 355.507 3.777 50 0 FHAAMO CCn1c2ccccc2nc1C[N@H+]1CC[C@@H](c2sccc2C)[C@H](O)C1 ZINC000065406034 221213565 /nfs/dbraw/zinc/21/35/65/221213565.db2.gz VALZNKMQGAVYPC-CRAIPNDOSA-N 1 1 355.507 3.777 50 0 FHAAMO Cc1c(CO)cccc1NC(=O)c1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000065403599 221214088 /nfs/dbraw/zinc/21/40/88/221214088.db2.gz ZRWRJIAWUOILFQ-MRXNPFEDSA-N 1 1 352.478 3.972 50 0 FHAAMO C[C@@H](C(=O)NC1CCCC1)[NH+]1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000065476116 221224139 /nfs/dbraw/zinc/22/41/39/221224139.db2.gz YWCPAEGZPYOVDC-AWEZNQCLSA-N 1 1 362.901 3.682 50 0 FHAAMO C[N@H+](Cc1cnc2ccccn12)Cc1ccc(C(=O)Nc2cccnc2)cc1 ZINC000065534853 221232397 /nfs/dbraw/zinc/23/23/97/221232397.db2.gz AYXJXZBKXDNKLT-UHFFFAOYSA-N 1 1 371.444 3.614 50 0 FHAAMO C[N@@H+](Cc1cnc2ccccn12)Cc1ccc(C(=O)Nc2cccnc2)cc1 ZINC000065534853 221232400 /nfs/dbraw/zinc/23/24/00/221232400.db2.gz AYXJXZBKXDNKLT-UHFFFAOYSA-N 1 1 371.444 3.614 50 0 FHAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)/C=C/c2cc(C)c(C)cc2C)cn1 ZINC000065728116 221235863 /nfs/dbraw/zinc/23/58/63/221235863.db2.gz HNOASDKNDXETRL-SOFGYWHQSA-N 1 1 360.461 3.831 50 0 FHAAMO O[C@@H]1C[N@@H+](Cc2ccc(-c3cc[nH]n3)s2)CC[C@H]1c1ccc(F)cc1 ZINC000067434954 221254113 /nfs/dbraw/zinc/25/41/13/221254113.db2.gz GXMDTLOUJREHCC-FUHWJXTLSA-N 1 1 357.454 3.628 50 0 FHAAMO Cc1cccn2c(Cn3cnc(-c4ccccc4)c3-c3ncc[nH]3)c[nH+]c12 ZINC000067447133 221254862 /nfs/dbraw/zinc/25/48/62/221254862.db2.gz HUICVWQPEQUYAR-UHFFFAOYSA-N 1 1 354.417 3.945 50 0 FHAAMO Fc1ccc2[nH]c(-c3cc4n(n3)CC[N@H+](C/C=C/c3ccco3)C4)nc2c1 ZINC000067654214 221267030 /nfs/dbraw/zinc/26/70/30/221267030.db2.gz DKZDPLDDOIOGHH-HNQUOIGGSA-N 1 1 363.396 3.688 50 0 FHAAMO Fc1ccc2[nH]c(-c3cc4n(n3)CC[N@@H+](C/C=C/c3ccco3)C4)nc2c1 ZINC000067654214 221267032 /nfs/dbraw/zinc/26/70/32/221267032.db2.gz DKZDPLDDOIOGHH-HNQUOIGGSA-N 1 1 363.396 3.688 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@@H](O)C3)c(C)o2)c2ccccc12 ZINC000067739700 221278711 /nfs/dbraw/zinc/27/87/11/221278711.db2.gz WQGQCWCOCVIRDR-OAHLLOKOSA-N 1 1 352.434 3.769 50 0 FHAAMO Cc1ccccc1-c1cc(O)c2c(c1)CN(C[C@H]1CCC[N@@H+]1C)CCO2 ZINC000067675846 221269214 /nfs/dbraw/zinc/26/92/14/221269214.db2.gz KLUUKGAXRNIZBO-LJQANCHMSA-N 1 1 352.478 3.656 50 0 FHAAMO c1[nH]nc(-c2ccccc2)c1C[N@@H+]1CCC[C@@H]1c1nc(-c2ccncc2)no1 ZINC000067818552 221290285 /nfs/dbraw/zinc/29/02/85/221290285.db2.gz KVWOKOPYOIQISM-GOSISDBHSA-N 1 1 372.432 3.859 50 0 FHAAMO c1[nH]nc(-c2ccccc2)c1C[N@H+]1CCC[C@@H]1c1nc(-c2ccncc2)no1 ZINC000067818552 221290287 /nfs/dbraw/zinc/29/02/87/221290287.db2.gz KVWOKOPYOIQISM-GOSISDBHSA-N 1 1 372.432 3.859 50 0 FHAAMO CCNC(=O)CC[N@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067755341 221281003 /nfs/dbraw/zinc/28/10/03/221281003.db2.gz NNIVGOPEMPNSMH-UHFFFAOYSA-N 1 1 374.488 3.628 50 0 FHAAMO CNC(=O)CC1CC[NH+](Cc2nc(-c3cccc(Cl)c3)oc2C)CC1 ZINC000067785689 221284216 /nfs/dbraw/zinc/28/42/16/221284216.db2.gz NZUQRXOCIOWNHP-UHFFFAOYSA-N 1 1 361.873 3.652 50 0 FHAAMO COCCCC1CCN(C(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)CC1 ZINC000299782565 533223666 /nfs/dbraw/zinc/22/36/66/533223666.db2.gz QANHGYDNLYRGTJ-BDTNDASRSA-N 1 1 370.537 3.877 50 0 FHAAMO COc1ccc(-c2nc(CN3CC[N@@H+](C)C(C)(C)C3)c(C)o2)c(OC)c1C ZINC000067803969 221287350 /nfs/dbraw/zinc/28/73/50/221287350.db2.gz JGRXIPVQNFUBCL-UHFFFAOYSA-N 1 1 373.497 3.502 50 0 FHAAMO O=C(c1ccc(-c2cccnc2)nc1)N1CCC[N@H+](C2CCCCC2)CC1 ZINC000067934979 221306151 /nfs/dbraw/zinc/30/61/51/221306151.db2.gz VTXJDFGKLAJSKF-UHFFFAOYSA-N 1 1 364.493 3.624 50 0 FHAAMO NC(=O)c1cccnc1Oc1ccc(Cl)c(C[NH+]2CCCC2)c1Cl ZINC000067947979 221307906 /nfs/dbraw/zinc/30/79/06/221307906.db2.gz OBLZCDBBDPBNMA-UHFFFAOYSA-N 1 1 366.248 3.875 50 0 FHAAMO COc1ccc(-c2nc(C[NH+]3CCC(O)CC3)c(C)o2)c2ccccc12 ZINC000067966239 221309672 /nfs/dbraw/zinc/30/96/72/221309672.db2.gz OTVVZJPCXYNION-UHFFFAOYSA-N 1 1 352.434 3.769 50 0 FHAAMO COc1cccc([C@@H]2CC[N@@H+](Cc3[nH]c4ccccc4c3C)C[C@H]2O)c1 ZINC000067983371 221313180 /nfs/dbraw/zinc/31/31/80/221313180.db2.gz OHYJVLUJCDSBBN-SIKLNZKXSA-N 1 1 350.462 3.835 50 0 FHAAMO CC(C)[C@@H]1C[N@@H+](Cc2ccnc3ccccc23)CCC(=O)N1CC1CC1 ZINC000071738831 221358357 /nfs/dbraw/zinc/35/83/57/221358357.db2.gz UAARONGOPYIPTI-NRFANRHFSA-N 1 1 351.494 3.704 50 0 FHAAMO CCn1nc(C(C)C)cc1C(=O)N1CCC[N@@H+](CC2CC2)[C@@H](C(C)C)C1 ZINC000071748602 221361034 /nfs/dbraw/zinc/36/10/34/221361034.db2.gz LWQLNRNYIOAERB-HXUWFJFHSA-N 1 1 360.546 3.609 50 0 FHAAMO COc1ccc2cc([C@@H]3CN(CC4CC[NH+](C)CC4)CCO3)ccc2c1 ZINC000071752643 221364342 /nfs/dbraw/zinc/36/43/42/221364342.db2.gz IPFLQESOGVYKIS-QFIPXVFZSA-N 1 1 354.494 3.564 50 0 FHAAMO CC(C)[C@H]1CN(Cc2cc(-c3ccccn3)no2)CCC[N@H+]1CC1CC1 ZINC000071755341 221365017 /nfs/dbraw/zinc/36/50/17/221365017.db2.gz USWHMWNSWNPAQC-OAQYLSRUSA-N 1 1 354.498 3.679 50 0 FHAAMO CCNC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc4ccccc4c3)oc2C)C1 ZINC000071759644 221367155 /nfs/dbraw/zinc/36/71/55/221367155.db2.gz PYYLVUVSEVUKDC-IBGZPJMESA-N 1 1 363.461 3.761 50 0 FHAAMO COc1ccc(C(C)(C)C)cc1NC(=O)N1CC[NH+](CCSC)CC1 ZINC000299779209 533361521 /nfs/dbraw/zinc/36/15/21/533361521.db2.gz DOMDHZOHPLESSQ-UHFFFAOYSA-N 1 1 365.543 3.505 50 0 FHAAMO Cc1ccc(N2CC[NH+]([C@H](C)C(=O)N[C@@H](C)c3ccccc3)CC2)cc1C ZINC000096490400 132225103 /nfs/dbraw/zinc/22/51/03/132225103.db2.gz NJWXCPKDKBVBGU-VQTJNVASSA-N 1 1 365.521 3.691 50 0 FHAAMO Cc1c2cc(Cl)ccc2[nH]c1C[NH+]1CCN(c2ncnc(C)c2C)CC1 ZINC000097813674 132231141 /nfs/dbraw/zinc/23/11/41/132231141.db2.gz GCTFNINGYVGJBX-UHFFFAOYSA-N 1 1 369.900 3.859 50 0 FHAAMO Cc1ccc(-c2cccc(C(=O)N3CCN(c4[nH+]cccc4C)CC3)c2)nc1 ZINC000299790527 132300249 /nfs/dbraw/zinc/30/02/49/132300249.db2.gz BRBWBEZGWKGICG-UHFFFAOYSA-N 1 1 372.472 3.723 50 0 FHAAMO Cc1ccc2c(C[NH+]3CCN(c4ccccc4F)CC3)cc(=O)oc2c1 ZINC000054105992 132376073 /nfs/dbraw/zinc/37/60/73/132376073.db2.gz IGUAWSGLFFKKMN-UHFFFAOYSA-N 1 1 352.409 3.563 50 0 FHAAMO O=c1cc(C[NH+]2CCN(c3ccccc3)CC2)c2cc3c(cc2o1)CCCC3 ZINC000054220020 132376277 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C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000012533897 571175465 /nfs/dbraw/zinc/17/54/65/571175465.db2.gz JSLVRTSJDMQJMU-PKOBYXMFSA-N 1 1 369.534 3.622 50 0 FHAAMO Cc1cccc2nc(C3CC[NH+](Cc4cccc(OCCO)c4)CC3)[nH]c21 ZINC000072162588 571176108 /nfs/dbraw/zinc/17/61/08/571176108.db2.gz BJDFJXQJNBMQHP-UHFFFAOYSA-N 1 1 365.477 3.622 50 0 FHAAMO CNC(=O)c1ccc(C[N@H+]2CCC[C@H](CCc3ccc(F)c(F)c3)C2)o1 ZINC000072165561 571176667 /nfs/dbraw/zinc/17/66/67/571176667.db2.gz HHHFASWKOHKWHZ-OAHLLOKOSA-N 1 1 362.420 3.762 50 0 FHAAMO Cc1nccn1C[C@@H]1CCC[N@@H+](Cc2cnc(-c3cccc(C)c3)nc2)C1 ZINC000072165572 571176769 /nfs/dbraw/zinc/17/67/69/571176769.db2.gz DZICXMBPGRYONK-LJQANCHMSA-N 1 1 361.493 3.869 50 0 FHAAMO CCc1ncc(C[NH+]2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)cn1 ZINC000072174269 571177646 /nfs/dbraw/zinc/17/76/46/571177646.db2.gz KQMFBRLHFVHDTI-UHFFFAOYSA-N 1 1 365.399 3.541 50 0 FHAAMO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000229735412 571178053 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CC(C)(O)CCc1ccc(C[N@H+]2CCC[C@H](OCc3ccccn3)C2)cc1 ZINC000072421492 571193223 /nfs/dbraw/zinc/19/32/23/571193223.db2.gz QGOMCDXXUCAVTP-QFIPXVFZSA-N 1 1 368.521 3.966 50 0 FHAAMO CCC(CC)C[N@H+]1CCc2nc[nH]c2[C@H]1c1cc2ccccc2n(C)c1=O ZINC000072422895 571193683 /nfs/dbraw/zinc/19/36/83/571193683.db2.gz YBVKSZBWBYSCKI-OAQYLSRUSA-N 1 1 364.493 3.645 50 0 FHAAMO CCN(C[C@H]1CC[N@@H+](C)C1)C(=O)c1cccc(-c2nc(C)c(C)s2)c1 ZINC000299764775 571194332 /nfs/dbraw/zinc/19/43/32/571194332.db2.gz FFJNKZMWPQCLST-INIZCTEOSA-N 1 1 357.523 3.841 50 0 FHAAMO Cc1ccc2cc(C[N@H+]3CCC[C@@](O)(CO)C3)c(-c3cccs3)nc2c1 ZINC000072428118 571194833 /nfs/dbraw/zinc/19/48/33/571194833.db2.gz OULMRGPQIROQQZ-NRFANRHFSA-N 1 1 368.502 3.591 50 0 FHAAMO Cn1ccnc1C[N@@H+]1CCCC12CCN(c1nc3ccccc3s1)CC2 ZINC000072432488 571195863 /nfs/dbraw/zinc/19/58/63/571195863.db2.gz HWFHVAXEHDJPLK-UHFFFAOYSA-N 1 1 367.522 3.665 50 0 FHAAMO Cn1ccnc1C[N@H+]1CCCC12CCN(c1nc3ccccc3s1)CC2 ZINC000072432488 571195864 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CCOC(=O)c1c(C)[nH]c(C(=O)C[N@@H+](C)Cc2ccc(CC)cc2)c1C ZINC000006507582 571205951 /nfs/dbraw/zinc/20/59/51/571205951.db2.gz YNYDCKOBSOIOLD-UHFFFAOYSA-N 1 1 356.466 3.685 50 0 FHAAMO Cn1cc(-c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)c2c1nc[nH+]c2N ZINC000077285111 571205996 /nfs/dbraw/zinc/20/59/96/571205996.db2.gz DIFBBWRLEUMXIH-UHFFFAOYSA-N 1 1 365.437 3.515 50 0 in-vitro FHAAMO O[C@@H]1COCC[N@@H+](Cc2cccc(Oc3cccc(C(F)(F)F)c3)c2)C1 ZINC000077301377 571207093 /nfs/dbraw/zinc/20/70/93/571207093.db2.gz VKIKIYMLKYTJHK-INIZCTEOSA-N 1 1 367.367 3.691 50 0 FHAAMO Cc1[nH+]ccn1CC[C@@H]1CCCCN1C(=O)NCCCc1ccccc1F ZINC000534653685 571207430 /nfs/dbraw/zinc/20/74/30/571207430.db2.gz QTZNUIXZHKZSFR-IBGZPJMESA-N 1 1 372.488 3.918 50 0 FHAAMO O=C(c1cccc2ncccc21)N1CCC[N@H+](C2Cc3ccccc3C2)CC1 ZINC000077343060 571208461 /nfs/dbraw/zinc/20/84/61/571208461.db2.gz CQOBCTDPMDREHV-UHFFFAOYSA-N 1 1 371.484 3.550 50 0 FHAAMO CC(C)n1ccnc1C[N@@H+]1CCC[C@]2(CCC(=O)N(C3CCCC3)C2)C1 ZINC000077436331 571211311 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CN(Cc1ccccc1C(F)(F)F)C(=O)NCC[C@@H]1CCCC[N@H+]1C ZINC000426373637 571216536 /nfs/dbraw/zinc/21/65/36/571216536.db2.gz ONVDGLFYPVEASP-HNNXBMFYSA-N 1 1 357.420 3.721 50 0 FHAAMO Cc1ncsc1CCN(C)C(=O)c1ccc(-c2c[nH+]c(N)cc2C)cc1 ZINC000426381810 571217443 /nfs/dbraw/zinc/21/74/43/571217443.db2.gz UXMJRYCRAVPIDJ-UHFFFAOYSA-N 1 1 366.490 3.549 50 0 FHAAMO CO[C@]12CC[N@@H+](Cc3cccc(Cl)c3Cl)[C@H]1C[C@@H](OCCO)CC2 ZINC000426381470 571217511 /nfs/dbraw/zinc/21/75/11/571217511.db2.gz PBBOZOZTMYEEFM-QILLFSRXSA-N 1 1 374.308 3.514 50 0 FHAAMO COc1ccc(-c2ccc(C(=O)N3CC[C@@H]4CC[C@H](C3)[N@H+]4C)cc2)c(C)c1 ZINC000426443024 571225758 /nfs/dbraw/zinc/22/57/58/571225758.db2.gz BDXWFMYCKXGTNT-VQTJNVASSA-N 1 1 364.489 3.979 50 0 FHAAMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c2cccc(C)c2n1 ZINC000082100271 571228355 /nfs/dbraw/zinc/22/83/55/571228355.db2.gz LHAJJWKCVWHNSB-OAQYLSRUSA-N 1 1 359.473 3.981 50 0 FHAAMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)c2cccc(C)c2n1 ZINC000082100271 571228356 /nfs/dbraw/zinc/22/83/56/571228356.db2.gz LHAJJWKCVWHNSB-OAQYLSRUSA-N 1 1 359.473 3.981 50 0 FHAAMO c1cnn(-c2ccccc2C[N@@H+]2CCC[C@H](c3nccn3CC3CC3)C2)c1 ZINC000082099812 571228417 /nfs/dbraw/zinc/22/84/17/571228417.db2.gz NCDYMMOTTIDWJJ-FQEVSTJZSA-N 1 1 361.493 3.858 50 0 FHAAMO COc1cccc([C@@H](C)NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000426563484 571231818 /nfs/dbraw/zinc/23/18/18/571231818.db2.gz PYNUXTGKQVCXTG-YLJYHZDGSA-N 1 1 367.493 3.672 50 0 FHAAMO O[C@H](C[NH+]1CCOCC1)c1ccc(-c2cccc(C(F)(F)F)c2)cc1 ZINC000426584091 571232423 /nfs/dbraw/zinc/23/24/23/571232423.db2.gz SHVLTDCFMFLFEZ-GOSISDBHSA-N 1 1 351.368 3.738 50 0 FHAAMO CC(=O)c1ccc(F)c(-c2ccc(C(=O)NC[C@@H]3CCCC[N@@H+]3C)cc2)c1 ZINC000426662230 571234543 /nfs/dbraw/zinc/23/45/43/571234543.db2.gz NFJAHBOGXGGYNI-IBGZPJMESA-N 1 1 368.452 3.909 50 0 FHAAMO CC[N@H+](CC(=O)Nc1ccc(C)cc1Cl)Cc1ccc2c(c1)OCO2 ZINC000011351650 571234978 /nfs/dbraw/zinc/23/49/78/571234978.db2.gz WNVHRKIJGQRNCJ-UHFFFAOYSA-N 1 1 360.841 3.838 50 0 FHAAMO CC[N@@H+](CC(=O)Nc1ccc(C)cc1Cl)Cc1ccc2c(c1)OCO2 ZINC000011351650 571234980 /nfs/dbraw/zinc/23/49/80/571234980.db2.gz WNVHRKIJGQRNCJ-UHFFFAOYSA-N 1 1 360.841 3.838 50 0 FHAAMO OCCn1ccc([C@@H]2CCC[N@@H+](Cc3cccc(-c4ccco4)c3)C2)n1 ZINC000426711121 571235999 /nfs/dbraw/zinc/23/59/99/571235999.db2.gz BOUGUIPGPNUXCQ-LJQANCHMSA-N 1 1 351.450 3.515 50 0 FHAAMO CC[N@H+]1CC[C@H](CNC(=O)N(Cc2ccc(C)s2)Cc2ccncc2)C1 ZINC000426739991 571236935 /nfs/dbraw/zinc/23/69/35/571236935.db2.gz ZKBGFINTEISBBB-GOSISDBHSA-N 1 1 372.538 3.505 50 0 FHAAMO Cc1[nH+]ccn1CC[C@H](NC(=O)c1cn2cc(C)ccc2n1)c1ccccc1 ZINC000091411472 571239414 /nfs/dbraw/zinc/23/94/14/571239414.db2.gz MJBSICRHEPPCIQ-IBGZPJMESA-N 1 1 373.460 3.709 50 0 FHAAMO COc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)COc2ccc(OC)cc2)cc1 ZINC000036095173 571240844 /nfs/dbraw/zinc/24/08/44/571240844.db2.gz BQEYTAHRBIMTCQ-LJQANCHMSA-N 1 1 373.493 3.602 50 0 FHAAMO CCC[N@H+](Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1ccccc1C ZINC000036095969 571241038 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C[C@@H](NC(=O)C[N@H+]1CCC[C@@H]1c1cccn1C)c1cc2ccccc2o1 ZINC000012812650 220033014 /nfs/dbraw/zinc/03/30/14/220033014.db2.gz QWZBFOWGJSWULM-CRAIPNDOSA-N 1 1 351.450 3.786 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)[N@H+](C)Cc1cccc(Cl)c1 ZINC000012848963 220035464 /nfs/dbraw/zinc/03/54/64/220035464.db2.gz SCSWYJOSSXYCJA-ZDUSSCGKSA-N 1 1 360.841 3.570 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000012848963 220035466 /nfs/dbraw/zinc/03/54/66/220035466.db2.gz SCSWYJOSSXYCJA-ZDUSSCGKSA-N 1 1 360.841 3.570 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)Cc2ccsc2)c(OC)c1 ZINC000012921914 220042587 /nfs/dbraw/zinc/04/25/87/220042587.db2.gz JJSFRDMXQIUARZ-SFHVURJKSA-N 1 1 374.506 3.561 50 0 FHAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N(C)Cc2ccsc2)c(OC)c1 ZINC000012921914 220042588 /nfs/dbraw/zinc/04/25/88/220042588.db2.gz JJSFRDMXQIUARZ-SFHVURJKSA-N 1 1 374.506 3.561 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012926933 220044469 /nfs/dbraw/zinc/04/44/69/220044469.db2.gz CATAXSCOTJTMED-CQSZACIVSA-N 1 1 374.868 3.879 50 0 FHAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012926933 220044471 /nfs/dbraw/zinc/04/44/71/220044471.db2.gz CATAXSCOTJTMED-CQSZACIVSA-N 1 1 374.868 3.879 50 0 FHAAMO Clc1ccc2c(c1)ncnc2NCc1ccccc1C[NH+]1CCOCC1 ZINC000012924932 220044337 /nfs/dbraw/zinc/04/43/37/220044337.db2.gz VBGPMBYBFYBDED-UHFFFAOYSA-N 1 1 368.868 3.728 50 0 FHAAMO COc1ccc2cc(C[N@@H+](C)[C@@H](C)C(=O)NCc3ccccc3)ccc2c1 ZINC000012999913 220051097 /nfs/dbraw/zinc/05/10/97/220051097.db2.gz GDQIDGKTQBKINW-KRWDZBQOSA-N 1 1 362.473 3.985 50 0 FHAAMO CCOC(=O)c1ccccc1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000013040166 220054888 /nfs/dbraw/zinc/05/48/88/220054888.db2.gz NIVCOWTUYHBEGM-CYBMUJFWSA-N 1 1 360.841 3.806 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)Nc1cccc(Cl)c1 ZINC000013061246 220056429 /nfs/dbraw/zinc/05/64/29/220056429.db2.gz RXPNVTAXUCGTBA-KRWDZBQOSA-N 1 1 372.852 3.887 50 0 FHAAMO O=C(C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)Nc1cccc(Cl)c1 ZINC000013061246 220056431 /nfs/dbraw/zinc/05/64/31/220056431.db2.gz RXPNVTAXUCGTBA-KRWDZBQOSA-N 1 1 372.852 3.887 50 0 FHAAMO CCc1cccc(CC)c1NC(=S)NC[C@@H](c1cccnc1)[NH+](C)C ZINC000013574460 220076569 /nfs/dbraw/zinc/07/65/69/220076569.db2.gz IEQCSRRODDDUFB-SFHVURJKSA-N 1 1 356.539 3.796 50 0 FHAAMO COc1ccccc1[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1)[NH+](C)C ZINC000014163082 220112677 /nfs/dbraw/zinc/11/26/77/220112677.db2.gz UNUGODZJUQFFCT-INIZCTEOSA-N 1 1 366.383 3.747 50 0 FHAAMO CC1CCC([N@@H+](C)CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)CC1 ZINC000014241987 220120122 /nfs/dbraw/zinc/12/01/22/220120122.db2.gz BGKUQJSGDPVIJJ-NKELODKYSA-N 1 1 372.509 3.632 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cc1F)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029517 220143000 /nfs/dbraw/zinc/14/30/00/220143000.db2.gz NXMYUJPJCOQZQA-NSHDSACASA-N 1 1 364.804 3.667 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cc1F)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000015029517 220143003 /nfs/dbraw/zinc/14/30/03/220143003.db2.gz NXMYUJPJCOQZQA-NSHDSACASA-N 1 1 364.804 3.667 50 0 FHAAMO CC[C@@H]1C[N@H+](Cc2ccc(OC)c(OC)c2)Cc2cc(OC)ccc2O1 ZINC000014962661 220137521 /nfs/dbraw/zinc/13/75/21/220137521.db2.gz GJUZIIYRHDBUBA-QGZVFWFLSA-N 1 1 357.450 3.886 50 0 FHAAMO CC[C@@H]1C[N@@H+](Cc2ccc(OC)c(OC)c2)Cc2cc(OC)ccc2O1 ZINC000014962661 220137523 /nfs/dbraw/zinc/13/75/23/220137523.db2.gz GJUZIIYRHDBUBA-QGZVFWFLSA-N 1 1 357.450 3.886 50 0 FHAAMO COc1ccccc1/C=C/C[N@@H+]1CCC(=O)N(Cc2ccccc2F)CC1 ZINC000014991806 220140454 /nfs/dbraw/zinc/14/04/54/220140454.db2.gz ZGJWBPIKJHNHHS-RMKNXTFCSA-N 1 1 368.452 3.582 50 0 FHAAMO CCOc1ccc(C[N@H+]2CCC[C@@H](Nc3ccc(F)cc3)C2)cc1CO ZINC000015075386 220146089 /nfs/dbraw/zinc/14/60/89/220146089.db2.gz XJWBYJYGRDTMLR-HXUWFJFHSA-N 1 1 358.457 3.793 50 0 FHAAMO COc1ccc(NC(=O)CC[C@H]2CCC[N@H+](C3CCOCC3)C2)c(C)c1 ZINC000015079243 220147163 /nfs/dbraw/zinc/14/71/63/220147163.db2.gz XBWIJHTZSYBBQH-QGZVFWFLSA-N 1 1 360.498 3.613 50 0 FHAAMO CC[C@@H](NC(=O)c1cc(Cn2cc[nH+]c2C(C)C)n[nH]1)c1cccs1 ZINC000015079183 220147549 /nfs/dbraw/zinc/14/75/49/220147549.db2.gz KCWXSRFNYUQJPN-CQSZACIVSA-N 1 1 357.483 3.721 50 0 FHAAMO COc1ccccc1/C=C/C[N@H+]1CC[C@]2(C1)CCCN(CC1CCC1)C2=O ZINC000015067508 220144079 /nfs/dbraw/zinc/14/40/79/220144079.db2.gz CWZIIIXMMFTAJJ-CRAXIPPQSA-N 1 1 368.521 3.823 50 0 FHAAMO COc1cccc(CN2CCC[C@@]3(CC[N@@H+](CC4CCCC4)C3)C2=O)c1 ZINC000015065792 220144385 /nfs/dbraw/zinc/14/43/85/220144385.db2.gz ZWBSJVHJZAXXGW-QFIPXVFZSA-N 1 1 356.510 3.700 50 0 FHAAMO CCC(CC)c1nn2c(nc(C[N@@H+](C)Cc3ccccc3)cc2=O)s1 ZINC000015731897 220163379 /nfs/dbraw/zinc/16/33/79/220163379.db2.gz MWGNKOHTHVVJEV-UHFFFAOYSA-N 1 1 356.495 3.687 50 0 FHAAMO COCC[N@H+](Cc1ccc(F)cc1)Cc1cc(=O)c2cc(C)ccc2[nH]1 ZINC000015862273 220169788 /nfs/dbraw/zinc/16/97/88/220169788.db2.gz IZJLWJCGGAGGMM-UHFFFAOYSA-N 1 1 354.425 3.624 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000016374095 220184258 /nfs/dbraw/zinc/18/42/58/220184258.db2.gz AYPZPXCOIDMIGV-MRXNPFEDSA-N 1 1 356.514 3.793 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000016374095 220184261 /nfs/dbraw/zinc/18/42/61/220184261.db2.gz AYPZPXCOIDMIGV-MRXNPFEDSA-N 1 1 356.514 3.793 50 0 FHAAMO CCOc1cc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)ccc1O ZINC000019358864 220252268 /nfs/dbraw/zinc/25/22/68/220252268.db2.gz NZTDMVKBKRCHGN-RMKNXTFCSA-N 1 1 352.478 3.622 50 0 FHAAMO CC(C)OCCCNC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1 ZINC000019450407 220257509 /nfs/dbraw/zinc/25/75/09/220257509.db2.gz ZSSMKULOPVHPSY-UHFFFAOYSA-N 1 1 366.505 3.790 50 0 FHAAMO CC(C)[N@H+]1CCN(Cc2ccc(-c3ccccc3Cl)o2)C[C@@H]1CCO ZINC000019536439 220268709 /nfs/dbraw/zinc/26/87/09/220268709.db2.gz CLDRRULDXOBKNW-INIZCTEOSA-N 1 1 362.901 3.877 50 0 FHAAMO CCCCOc1ccc(-c2n[nH]c3c2C[N@@H+](C[C@H]2CCOC2)CC3)cc1 ZINC000019731778 220292365 /nfs/dbraw/zinc/29/23/65/220292365.db2.gz RMNPYGOSDQYCQB-MRXNPFEDSA-N 1 1 355.482 3.650 50 0 FHAAMO CC(C)=CC(=O)NCC[N@H+]1Cc2ccccc2O[C@@H](c2ccccc2F)C1 ZINC000019741517 220292413 /nfs/dbraw/zinc/29/24/13/220292413.db2.gz PSKMJDLYEXHMJG-OAQYLSRUSA-N 1 1 368.452 3.844 50 0 FHAAMO CC(C)=CC(=O)NCC[N@@H+]1Cc2ccccc2O[C@@H](c2ccccc2F)C1 ZINC000019741517 220292416 /nfs/dbraw/zinc/29/24/16/220292416.db2.gz PSKMJDLYEXHMJG-OAQYLSRUSA-N 1 1 368.452 3.844 50 0 FHAAMO Cc1oc2cc(OC(=O)[C@@H]([NH3+])C(C)C)ccc2c(=O)c1-c1ccc(F)cc1 ZINC000019703095 220284996 /nfs/dbraw/zinc/28/49/96/220284996.db2.gz ZMHGLSBBKKOSMD-IBGZPJMESA-N 1 1 369.392 3.796 50 0 FHAAMO OCCN1CC[NH+]([C@@H]2CC[C@@H](c3ccc(F)cc3)c3ccc(F)cc32)CC1 ZINC000019801925 220299459 /nfs/dbraw/zinc/29/94/59/220299459.db2.gz RTZUVUZIGHAAAJ-SIKLNZKXSA-N 1 1 372.459 3.542 50 0 FHAAMO OCC[NH+]1CCN([C@@H]2CC[C@@H](c3ccc(F)cc3)c3ccc(F)cc32)CC1 ZINC000019801925 220299468 /nfs/dbraw/zinc/29/94/68/220299468.db2.gz RTZUVUZIGHAAAJ-SIKLNZKXSA-N 1 1 372.459 3.542 50 0 FHAAMO O=C(N1CCCCC1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019939292 220306222 /nfs/dbraw/zinc/30/62/22/220306222.db2.gz SUGUDTJGQZLJCX-UHFFFAOYSA-N 1 1 363.505 4.000 50 0 FHAAMO c1cc(CN[C@@H]2CCC[N@@H+](C3Cc4ccccc4C3)C2)n(-c2ccccn2)c1 ZINC000019938976 220307262 /nfs/dbraw/zinc/30/72/62/220307262.db2.gz CBYQKBVFMXBBEM-OAQYLSRUSA-N 1 1 372.516 3.594 50 0 FHAAMO c1cc(CN[C@@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)n(-c2ccccn2)c1 ZINC000019938976 220307264 /nfs/dbraw/zinc/30/72/64/220307264.db2.gz CBYQKBVFMXBBEM-OAQYLSRUSA-N 1 1 372.516 3.594 50 0 FHAAMO c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@H](N2CCOCC2)C1 ZINC000020201302 220317494 /nfs/dbraw/zinc/31/74/94/220317494.db2.gz INUVWAMJOCQIJL-SFHVURJKSA-N 1 1 350.462 3.883 50 0 FHAAMO c1nn(-c2ccccn2)c2c1[C@@H]([NH2+]Cc1nc3c(s1)CCCC3)CCC2 ZINC000020599529 220334863 /nfs/dbraw/zinc/33/48/63/220334863.db2.gz DCDSCZIDPKZXBB-HNNXBMFYSA-N 1 1 365.506 3.770 50 0 FHAAMO C[N@@H+](CCNC(=O)c1cc2ccc3cccnc3c2[nH]1)C1CCCCC1 ZINC000020575516 220335445 /nfs/dbraw/zinc/33/54/45/220335445.db2.gz OWIGYEQHUDXLEC-UHFFFAOYSA-N 1 1 350.466 3.710 50 0 FHAAMO Cc1cc(C(=O)NCCC[N@H+](C)C2CCCCC2)n(-c2ccccc2)n1 ZINC000020856311 220342395 /nfs/dbraw/zinc/34/23/95/220342395.db2.gz REWFPCANJUZVHO-UHFFFAOYSA-N 1 1 354.498 3.565 50 0 FHAAMO CC[N@@H+](Cc1ccccc1)[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccccc1 ZINC000020867689 220342521 /nfs/dbraw/zinc/34/25/21/220342521.db2.gz IZROUTVHUSDGCV-LEWJYISDSA-N 1 1 372.534 3.798 50 0 FHAAMO Cc1c(-c2n[nH]c3c2C[N@@H+](C[C@@H]2CCOC2)CC3)cccc1C(F)(F)F ZINC000020858701 220343011 /nfs/dbraw/zinc/34/30/11/220343011.db2.gz XQFGTEVTAVKQDV-ZDUSSCGKSA-N 1 1 365.399 3.799 50 0 FHAAMO c1ccc(C(C[N@H+]2CCC[C@H](N3CCOCC3)C2)c2ccccc2)cc1 ZINC000020995593 220347936 /nfs/dbraw/zinc/34/79/36/220347936.db2.gz MXKNLALVYCFROR-QFIPXVFZSA-N 1 1 350.506 3.615 50 0 FHAAMO COc1ccc2ccccc2c1CN1CC[N@@H+](CC(C)(C)C)[C@@H](CCO)C1 ZINC000020915850 220345858 /nfs/dbraw/zinc/34/58/58/220345858.db2.gz IDQPVBKDAXWWIO-IBGZPJMESA-N 1 1 370.537 3.763 50 0 FHAAMO COc1ccc(Cl)cc1NC(=O)NC[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000021175358 220354542 /nfs/dbraw/zinc/35/45/42/220354542.db2.gz AIVNYFDOGJYFBP-CYBMUJFWSA-N 1 1 351.878 3.735 50 0 FHAAMO CCc1c(C)sc2c1CC[N@@H+](CC(=O)NC1CC1)[C@@H]2c1ccccc1 ZINC000021045771 220349056 /nfs/dbraw/zinc/34/90/56/220349056.db2.gz BMNZMHVDCVTSEO-HXUWFJFHSA-N 1 1 354.519 3.845 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(-c2cccnc2)nc2ccccc21 ZINC000021934566 220371212 /nfs/dbraw/zinc/37/12/12/220371212.db2.gz HKWNLDKFLVWWNG-QGZVFWFLSA-N 1 1 374.488 3.901 50 0 FHAAMO O=C(c1ccccc1Cl)N1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000022515716 220388461 /nfs/dbraw/zinc/38/84/61/220388461.db2.gz RPGWPAKVUXJNCQ-UHFFFAOYSA-N 1 1 365.864 3.846 50 0 FHAAMO COc1ccccc1[C@@H](CNC(=O)c1ccc(Cl)s1)[NH+]1CCCC1 ZINC000022679775 220394483 /nfs/dbraw/zinc/39/44/83/220394483.db2.gz VSDTYHGJHJKXKX-CQSZACIVSA-N 1 1 364.898 3.977 50 0 FHAAMO C[NH+]1CCN(C(=O)c2cc3sccc3n2Cc2ccc(Cl)cc2)CC1 ZINC000044916406 220964979 /nfs/dbraw/zinc/96/49/79/220964979.db2.gz MFPOTGYJVFOWEX-UHFFFAOYSA-N 1 1 373.909 3.792 50 0 FHAAMO Cc1cc([C@H]2CCC[N@@H+]2CC(=O)N2CCC(Cc3ccccc3)CC2)on1 ZINC000048287866 221005172 /nfs/dbraw/zinc/00/51/72/221005172.db2.gz WNGPBWZNPXMZDA-HXUWFJFHSA-N 1 1 367.493 3.601 50 0 FHAAMO Cc1cc([C@H]2CCC[N@H+]2CC(=O)N2CCC(Cc3ccccc3)CC2)on1 ZINC000048287866 221005175 /nfs/dbraw/zinc/00/51/75/221005175.db2.gz WNGPBWZNPXMZDA-HXUWFJFHSA-N 1 1 367.493 3.601 50 0 FHAAMO Cc1cccc(NC(=O)c2ccccc2NC(=O)C[N@H+](C)[C@@H](C)C2CC2)c1 ZINC000048287734 221005945 /nfs/dbraw/zinc/00/59/45/221005945.db2.gz XBVRVWDZSKMZDI-INIZCTEOSA-N 1 1 365.477 3.916 50 0 FHAAMO CCCc1ccc(S(=O)(=O)NCc2ccc(C[N@@H+](C)C(C)C)cc2)cc1 ZINC000048310184 221006619 /nfs/dbraw/zinc/00/66/19/221006619.db2.gz PRZQXRSIOQKISH-UHFFFAOYSA-N 1 1 374.550 3.958 50 0 FHAAMO Cc1cccc(C(=O)NCc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000048333593 221009292 /nfs/dbraw/zinc/00/92/92/221009292.db2.gz OLPFMEGVIKVWEV-QZTJIDSGSA-N 1 1 352.478 3.534 50 0 FHAAMO C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)CCc2ccccc2)C[C@H](C)O1 ZINC000048358536 221009679 /nfs/dbraw/zinc/00/96/79/221009679.db2.gz PBKPTYQQBBPMDP-KDURUIRLSA-N 1 1 366.505 3.545 50 0 FHAAMO C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)CCc2ccccc2)C[C@H](C)O1 ZINC000048358536 221009681 /nfs/dbraw/zinc/00/96/81/221009681.db2.gz PBKPTYQQBBPMDP-KDURUIRLSA-N 1 1 366.505 3.545 50 0 FHAAMO C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+](C)CCCn1cncn1 ZINC000048374839 221012177 /nfs/dbraw/zinc/01/21/77/221012177.db2.gz BXXSBQVAIMNUNC-KRWDZBQOSA-N 1 1 363.465 3.614 50 0 FHAAMO Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000048711589 221014116 /nfs/dbraw/zinc/01/41/16/221014116.db2.gz HSBCNOKCIULSPZ-INIZCTEOSA-N 1 1 358.917 3.716 50 0 FHAAMO Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000048711589 221014119 /nfs/dbraw/zinc/01/41/19/221014119.db2.gz HSBCNOKCIULSPZ-INIZCTEOSA-N 1 1 358.917 3.716 50 0 FHAAMO Cc1cc(Nc2ccc(NC(=O)c3ccco3)cc2)nc(N2CCCC2)[nH+]1 ZINC000049028123 221017004 /nfs/dbraw/zinc/01/70/04/221017004.db2.gz MCOZXGHRRHWWQQ-UHFFFAOYSA-N 1 1 363.421 3.974 50 0 FHAAMO COc1cc(C[NH2+]Cc2cn3nc(C)sc3n2)ccc1OCC=C(C)C ZINC000055053918 221057670 /nfs/dbraw/zinc/05/76/70/221057670.db2.gz OVEFLDAKGMZOSN-UHFFFAOYSA-N 1 1 372.494 3.743 50 0 FHAAMO CC(C)Oc1ccc([C@@H](C(=O)[O-])[N@@H+](C)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000055182707 221061071 /nfs/dbraw/zinc/06/10/71/221061071.db2.gz VUDFQOCVLVKHAZ-SFHVURJKSA-N 1 1 362.514 3.841 50 0 FHAAMO Cc1ccnc(C[C@H](C)[N@@H+](C)Cc2cnc(NCc3ccccc3)nc2)c1 ZINC000055195654 221061103 /nfs/dbraw/zinc/06/11/03/221061103.db2.gz AJPYLAULNMTQKL-SFHVURJKSA-N 1 1 361.493 3.855 50 0 FHAAMO OCc1ccc(CN2CC[C@@]3(C2)CCC[N@@H+](CCCc2ccccc2)C3)o1 ZINC000055183174 221061365 /nfs/dbraw/zinc/06/13/65/221061365.db2.gz XGJLPRKKSIGYEW-QHCPKHFHSA-N 1 1 368.521 3.693 50 0 FHAAMO COc1ccc([C@@H]2[NH2+]Cc3ccccc3-n3cccc32)c(OC)c1OC ZINC000055211382 221061860 /nfs/dbraw/zinc/06/18/60/221061860.db2.gz UISRWWAGULAENF-IBGZPJMESA-N 1 1 350.418 3.696 50 0 FHAAMO Cc1ccnc(C[C@H](C)[N@@H+](C)Cc2cc(=O)n3c4c(cccc24)CCC3)c1 ZINC000055309513 221066184 /nfs/dbraw/zinc/06/61/84/221066184.db2.gz PSKJSJIBCDAJPT-KRWDZBQOSA-N 1 1 361.489 3.714 50 0 FHAAMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc(Br)o2)C1 ZINC000054226376 221051845 /nfs/dbraw/zinc/05/18/45/221051845.db2.gz YSMCVUZUDHAAQP-JSGCOSHPSA-N 1 1 363.255 3.607 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2OC)cc1 ZINC000054426306 221053290 /nfs/dbraw/zinc/05/32/90/221053290.db2.gz HTIZBCGRIYCNBG-LJQANCHMSA-N 1 1 354.450 3.870 50 0 FHAAMO C[N@@H+](CCNC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000054761773 221055254 /nfs/dbraw/zinc/05/52/54/221055254.db2.gz MWSPFSWORZCJRX-HOTGVXAUSA-N 1 1 357.420 3.539 50 0 FHAAMO CC[N@@H+](Cc1cc(=O)n2nc(C)sc2n1)[C@@H](C)c1cc2ccccc2o1 ZINC000058172418 221102592 /nfs/dbraw/zinc/10/25/92/221102592.db2.gz XSRHKEBVOKRNEK-LBPRGKRZSA-N 1 1 368.462 3.789 50 0 FHAAMO O=C(NCCOc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000058173178 221102831 /nfs/dbraw/zinc/10/28/31/221102831.db2.gz AORKSWVWUYNTSG-GOSISDBHSA-N 1 1 372.896 3.747 50 0 FHAAMO CCc1cc2c(C[N@@H+](C)CCOc3ccccc3)cc(=O)oc2cc1O ZINC000057438869 221088142 /nfs/dbraw/zinc/08/81/42/221088142.db2.gz MXBLDZAVPGPNBU-UHFFFAOYSA-N 1 1 353.418 3.572 50 0 FHAAMO Cc1noc(C)c1CSc1ccccc1C(=O)N1CC[NH+](C2CC2)CC1 ZINC000058005984 221096699 /nfs/dbraw/zinc/09/66/99/221096699.db2.gz JNMABDGPWIHHGX-UHFFFAOYSA-N 1 1 371.506 3.504 50 0 FHAAMO c1coc([C@@H](C[NH2+]Cc2csc(-c3ncccn3)n2)N2CCCCC2)c1 ZINC000058108188 221098299 /nfs/dbraw/zinc/09/82/99/221098299.db2.gz IUFGNBLNWONTIL-MRXNPFEDSA-N 1 1 369.494 3.510 50 0 FHAAMO CC(C)(CN1CCC(n2cc(C3CC3)nn2)CC1)C[NH+]1CCCCCC1 ZINC000063856223 221143623 /nfs/dbraw/zinc/14/36/23/221143623.db2.gz ZODXABRSCFHCQY-UHFFFAOYSA-N 1 1 359.562 3.695 50 0 FHAAMO Cc1cccc(C[N@@H+]2CC=C(C(=O)NCc3cc(F)ccc3F)CC2)c1 ZINC000064818022 221152898 /nfs/dbraw/zinc/15/28/98/221152898.db2.gz YXEIYYXTNRGQGY-UHFFFAOYSA-N 1 1 356.416 3.722 50 0 FHAAMO COc1cccc(C[N@@H+]2CC=C(C(=O)NCc3ccc(Cl)cc3)CC2)c1 ZINC000064817993 221152986 /nfs/dbraw/zinc/15/29/86/221152986.db2.gz DTFKVAWHXGMPIR-UHFFFAOYSA-N 1 1 370.880 3.797 50 0 FHAAMO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccncc3)no2)cc1 ZINC000065286339 221194293 /nfs/dbraw/zinc/19/42/93/221194293.db2.gz OMTPDQODPKVMPB-GOSISDBHSA-N 1 1 350.422 3.867 50 0 FHAAMO COc1ccc(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccncc3)no2)cc1 ZINC000065286339 221194294 /nfs/dbraw/zinc/19/42/94/221194294.db2.gz OMTPDQODPKVMPB-GOSISDBHSA-N 1 1 350.422 3.867 50 0 FHAAMO CC(=O)c1cccc(-c2cc([C@H]3CC[N@@H+](Cc4cncnc4)C3)ccn2)c1 ZINC000065403724 221213243 /nfs/dbraw/zinc/21/32/43/221213243.db2.gz RPRBGYBOSHRADV-NRFANRHFSA-N 1 1 358.445 3.731 50 0 FHAAMO C[N@@H+](Cc1c(F)ccc(F)c1Cl)C[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000065410382 221216066 /nfs/dbraw/zinc/21/60/66/221216066.db2.gz FCIRUSZYYBWSSY-GFCCVEGCSA-N 1 1 356.844 3.841 50 0 FHAAMO C[N@H+](Cc1c(F)ccc(F)c1Cl)C[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000065410382 221216067 /nfs/dbraw/zinc/21/60/67/221216067.db2.gz FCIRUSZYYBWSSY-GFCCVEGCSA-N 1 1 356.844 3.841 50 0 FHAAMO CC[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(C(=O)Nc2ccnn2C)cc1 ZINC000065430069 221218568 /nfs/dbraw/zinc/21/85/68/221218568.db2.gz DXKDJBJFRLAYNJ-IBGZPJMESA-N 1 1 363.465 3.651 50 0 FHAAMO CN(C)CC(C)(C)C[N@@H+]1CC[C@@H](c2ccnc(-c3cccc(O)c3)c2)C1 ZINC000065464053 221223019 /nfs/dbraw/zinc/22/30/19/221223019.db2.gz ANGDNBFSOMQAEQ-LJQANCHMSA-N 1 1 353.510 3.831 50 0 FHAAMO CN(C)CC(C)(C)C[N@H+]1CC[C@@H](c2ccnc(-c3cccc(O)c3)c2)C1 ZINC000065464053 221223022 /nfs/dbraw/zinc/22/30/22/221223022.db2.gz ANGDNBFSOMQAEQ-LJQANCHMSA-N 1 1 353.510 3.831 50 0 FHAAMO C[N@H+]1CC[C@H](Cn2cnc(-c3ccccc3)c2-c2cccc3nonc32)C1 ZINC000065533226 221232764 /nfs/dbraw/zinc/23/27/64/221232764.db2.gz RRSGVJSTHKUJDZ-HNNXBMFYSA-N 1 1 359.433 3.705 50 0 FHAAMO Cc1nn2c(nc(N3CCC[N@H+]4CCC[C@@H]4C3)c3ccccc32)c1Cl ZINC000065537203 221233025 /nfs/dbraw/zinc/23/30/25/221233025.db2.gz ZXBWZMUSPRWYCP-CQSZACIVSA-N 1 1 355.873 3.519 50 0 FHAAMO CCCC[N@@H+](C)C[C@@H](C)OC(=O)C(O)(c1ccccc1)c1ccccc1 ZINC000067319146 221251966 /nfs/dbraw/zinc/25/19/66/221251966.db2.gz HDWDSQSFHHWROG-GOSISDBHSA-N 1 1 355.478 3.586 50 0 FHAAMO Cc1cccnc1C[C@H](C)[N@@H+](C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000067654107 221265984 /nfs/dbraw/zinc/26/59/84/221265984.db2.gz JVXXJGZSQSVURS-SFHVURJKSA-N 1 1 351.494 3.558 50 0 FHAAMO O=C(Nc1ccc2ncsc2c1)c1cccc(C[N@@H+]2CCC[C@@H](O)C2)c1 ZINC000067513558 221257137 /nfs/dbraw/zinc/25/71/37/221257137.db2.gz AMLSSGHUMBHLEU-QGZVFWFLSA-N 1 1 367.474 3.505 50 0 FHAAMO O=C(c1ccc(-c2ccoc2)nc1)N1CCC[N@H+](C2CCCCC2)CC1 ZINC000067490741 221257309 /nfs/dbraw/zinc/25/73/09/221257309.db2.gz CMPNUHYDMAWFCR-UHFFFAOYSA-N 1 1 353.466 3.822 50 0 FHAAMO C[N@@H+](CC[C@@H]1CCCCO1)Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067695679 221273914 /nfs/dbraw/zinc/27/39/14/221273914.db2.gz MNAAJQVSFGJQCA-IBGZPJMESA-N 1 1 350.466 3.787 50 0 FHAAMO CN1CCC([N@@H+](CCc2ccccc2)Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000067758719 221283440 /nfs/dbraw/zinc/28/34/40/221283440.db2.gz XMIATULLQGZNMQ-UHFFFAOYSA-N 1 1 364.493 3.809 50 0 FHAAMO O=C(c1ccc(-c2ccncc2)nc1)N1CCC[N@H+](C2CCCCC2)CC1 ZINC000067833438 221291393 /nfs/dbraw/zinc/29/13/93/221291393.db2.gz HDTRNGYKLFYZKR-UHFFFAOYSA-N 1 1 364.493 3.624 50 0 FHAAMO CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(-c2cccc(O)c2)nc1 ZINC000067821171 221290895 /nfs/dbraw/zinc/29/08/95/221290895.db2.gz WFDOGUBBRNKZTR-UHFFFAOYSA-N 1 1 364.449 3.594 50 0 FHAAMO CCc1ccccc1C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccco3)C2)C1 ZINC000067921623 221305193 /nfs/dbraw/zinc/30/51/93/221305193.db2.gz CSPZGJVNLVUSLY-JOCHJYFZSA-N 1 1 352.478 3.970 50 0 FHAAMO c1cc2c(nc[nH+]c2N2CCC(c3n[nH]cc3Cc3ccccc3)CC2)[nH]1 ZINC000067921125 221305314 /nfs/dbraw/zinc/30/53/14/221305314.db2.gz REIBPOKOHPYYFE-UHFFFAOYSA-N 1 1 358.449 3.656 50 0 FHAAMO CN(Cc1cccc(F)c1)C(=O)C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000070016941 221330410 /nfs/dbraw/zinc/33/04/10/221330410.db2.gz HPLQZDJLGFGACK-NRFANRHFSA-N 1 1 354.469 3.881 50 0 FHAAMO CC(C)[C@@H]1C[N@H+](Cc2cncn2C2CCCCC2)CCC(=O)N1CC1CC1 ZINC000071524559 221350439 /nfs/dbraw/zinc/35/04/39/221350439.db2.gz VNRHBPCIIMKWTK-NRFANRHFSA-N 1 1 372.557 3.857 50 0 FHAAMO CC(C)[C@@H]1C[N@@H+](Cc2cncn2C2CCCCC2)CCC(=O)N1CC1CC1 ZINC000071524559 221350441 /nfs/dbraw/zinc/35/04/41/221350441.db2.gz VNRHBPCIIMKWTK-NRFANRHFSA-N 1 1 372.557 3.857 50 0 FHAAMO O=C(c1ccccc1)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000071524480 221350971 /nfs/dbraw/zinc/35/09/71/221350971.db2.gz XGAVNGRZAWEZRZ-IOMROCGXSA-N 1 1 368.427 3.667 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2cccnc2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071614913 221352775 /nfs/dbraw/zinc/35/27/75/221352775.db2.gz DGRKAEMEGGKCSW-HXUWFJFHSA-N 1 1 355.457 3.593 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)c2cnc3ccccc3c2)CCC[N@H+]1CC1CC1 ZINC000071751525 221361769 /nfs/dbraw/zinc/36/17/69/221361769.db2.gz SJEZDQCYRVCLRU-OAQYLSRUSA-N 1 1 351.494 3.817 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2ccccc2-c2ncc[nH]2)CCC[N@H+]1CC1CC1 ZINC000071707876 221353957 /nfs/dbraw/zinc/35/39/57/221353957.db2.gz UUIHVESGAFABMM-FQEVSTJZSA-N 1 1 366.509 3.659 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@@H](C(C)(C)O)C3)c(C)o2)c(F)c1 ZINC000071771229 221373990 /nfs/dbraw/zinc/37/39/90/221373990.db2.gz UAGACFJEKNZTMJ-CQSZACIVSA-N 1 1 362.445 3.781 50 0 FHAAMO CC(C)[C@@H]1CN(Cc2nnc(C3CC3)o2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000071776356 221375419 /nfs/dbraw/zinc/37/54/19/221375419.db2.gz CHVWRRFCDDJFIH-IBGZPJMESA-N 1 1 372.488 3.819 50 0 FHAAMO Cc1nc(C2CCN(c3cc[nH+]c4cc(Cl)ccc43)CC2)cc(=O)[nH]1 ZINC000077287623 132179765 /nfs/dbraw/zinc/17/97/65/132179765.db2.gz ZJURNFFVPLYBGP-UHFFFAOYSA-N 1 1 354.841 3.664 50 0 FHAAMO Cc1nc([C@@H]2CCCN(c3cc[nH+]c4cc(Cl)ccc43)C2)cc(=O)[nH]1 ZINC000077298495 132179966 /nfs/dbraw/zinc/17/99/66/132179966.db2.gz IWJYNMVOTVXVEL-CYBMUJFWSA-N 1 1 354.841 3.664 50 0 FHAAMO O=C(c1ccc(N2CCCCC2)cc1)N1C[C@H]2CC[C@H](C[N@@H+]2CC2CC2)C1 ZINC000091724307 132203454 /nfs/dbraw/zinc/20/34/54/132203454.db2.gz PIWFTXVIZWUMCV-DENIHFKCSA-N 1 1 367.537 3.623 50 0 FHAAMO Clc1ccc(N2CCC[C@@H](c3[nH+]ccn3Cc3cscn3)C2)nc1 ZINC000095368460 132208340 /nfs/dbraw/zinc/20/83/40/132208340.db2.gz RWKVZPTVMWQVJZ-CYBMUJFWSA-N 1 1 359.886 3.820 50 0 FHAAMO Clc1ccc(N2CCC[C@H](c3[nH+]ccn3Cc3ccccn3)C2)nc1 ZINC000095374408 132208956 /nfs/dbraw/zinc/20/89/56/132208956.db2.gz BQCSKCLABQBQLA-HNNXBMFYSA-N 1 1 353.857 3.759 50 0 FHAAMO c1cn(Cc2ccccn2)c([C@H]2CCCN(c3cnc4ccccc4n3)C2)[nH+]1 ZINC000095522749 132214268 /nfs/dbraw/zinc/21/42/68/132214268.db2.gz ZODOAOQPJPRVRZ-KRWDZBQOSA-N 1 1 370.460 3.654 50 0 FHAAMO Cn1cnnc1C1CCN(c2cc[nH+]c3ccc(Br)cc32)CC1 ZINC000225524490 132285139 /nfs/dbraw/zinc/28/51/39/132285139.db2.gz UGSSFGPWGKEGHV-UHFFFAOYSA-N 1 1 372.270 3.510 50 0 FHAAMO COc1ccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)c(OC)c1C ZINC000001227034 132381225 /nfs/dbraw/zinc/38/12/25/132381225.db2.gz IHHAJOCMMOBHDT-UHFFFAOYSA-N 1 1 360.885 3.988 50 0 FHAAMO C[N@H+](Cc1ccon1)C1CCN(c2cccc(-c3cscn3)c2)CC1 ZINC000048179351 136122952 /nfs/dbraw/zinc/12/29/52/136122952.db2.gz XDGBJHCFMQKYTB-UHFFFAOYSA-N 1 1 354.479 3.899 50 0 FHAAMO C[N@@H+](Cc1ccon1)C1CCN(c2cccc(-c3cscn3)c2)CC1 ZINC000048179351 136122953 /nfs/dbraw/zinc/12/29/53/136122953.db2.gz XDGBJHCFMQKYTB-UHFFFAOYSA-N 1 1 354.479 3.899 50 0 FHAAMO COc1cc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)ccc1O ZINC000055542961 136126816 /nfs/dbraw/zinc/12/68/16/136126816.db2.gz OIWGHWDTHMPYNY-UHFFFAOYSA-N 1 1 366.383 3.742 50 0 FHAAMO Cc1cc(C)c2ccc(C(=O)N3C[C@H]4CC[C@H](C[N@@H+]4CC4CC4)C3)cc2n1 ZINC000091620523 221775032 /nfs/dbraw/zinc/77/50/32/221775032.db2.gz PKEREIVHELMDLI-UYAOXDASSA-N 1 1 363.505 3.798 50 0 FHAAMO Fc1ccc(Cl)c(CN2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccn2)C3)c1 ZINC000095373746 221876575 /nfs/dbraw/zinc/87/65/75/221876575.db2.gz UVIJBDNIMLNLOG-HNAYVOBHSA-N 1 1 359.876 3.971 50 0 FHAAMO CC[NH+]1CCN(C(=O)c2cc3ccsc3n2Cc2ccccc2C)CC1 ZINC000096288703 222111383 /nfs/dbraw/zinc/11/13/83/222111383.db2.gz FDJWMMNWOIXDRI-UHFFFAOYSA-N 1 1 367.518 3.837 50 0 FHAAMO C[C@H](CC[NH+]1CCOCC1)NC(=O)Nc1ccc(-c2cccc(F)c2)cc1 ZINC000096139887 222044163 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ZINC000095359945 570454059 /nfs/dbraw/zinc/45/40/59/570454059.db2.gz XMYWSRRMDDNPIR-KRWDZBQOSA-N 1 1 365.481 3.563 50 0 FHAAMO Cc1[nH+]ccn1CCCC(=O)N1CCC[C@H](c2nc3cccc(C)c3[nH]2)C1 ZINC000095359945 570454065 /nfs/dbraw/zinc/45/40/65/570454065.db2.gz XMYWSRRMDDNPIR-KRWDZBQOSA-N 1 1 365.481 3.563 50 0 FHAAMO Cc1nn(-c2ccc(F)cc2)c(C)c1CNC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000095363449 570454482 /nfs/dbraw/zinc/45/44/82/570454482.db2.gz PXHYIVBBKKGXOI-SFHVURJKSA-N 1 1 372.488 3.509 50 0 FHAAMO Cn1cc(C(=O)N2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)c2ccccc21 ZINC000095363954 570454766 /nfs/dbraw/zinc/45/47/66/570454766.db2.gz QFQLXEJUNLNUNY-WOJBJXKFSA-N 1 1 373.500 3.915 50 0 FHAAMO CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000095364248 570454851 /nfs/dbraw/zinc/45/48/51/570454851.db2.gz OGGCPAFYRYSOKK-HXUWFJFHSA-N 1 1 367.424 3.742 50 0 FHAAMO CN(Cc1cccc2cnccc21)C(=O)[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000095382523 570459452 /nfs/dbraw/zinc/45/94/52/570459452.db2.gz CPCQMBQCTPHTGA-HXUWFJFHSA-N 1 1 351.425 3.635 50 0 FHAAMO CSc1cccc(CN(C)C(=O)[C@@H]2CCC[N@@H+](Cc3ccco3)C2)c1 ZINC000095390821 570460609 /nfs/dbraw/zinc/46/06/09/570460609.db2.gz XBMLSQNAXISRRV-QGZVFWFLSA-N 1 1 358.507 3.872 50 0 FHAAMO C[C@@H](NC(=O)CC[N@H+]1CCc2nc(-c3ccccc3)[nH]c2C1)c1ccccc1 ZINC000095500843 570462981 /nfs/dbraw/zinc/46/29/81/570462981.db2.gz UPXOHVBYPPGOHV-QGZVFWFLSA-N 1 1 374.488 3.702 50 0 FHAAMO C[N@H+]1CCCN(C(=O)Nc2ccc(SCCc3ccccn3)cc2)CC1 ZINC000095523976 570468431 /nfs/dbraw/zinc/46/84/31/570468431.db2.gz XYBZQYFAWFLXCE-UHFFFAOYSA-N 1 1 370.522 3.586 50 0 FHAAMO Cc1cc(F)ccc1NC(=O)CC[C@@H]1CCC[N@H+](Cc2ncccn2)C1 ZINC000095529592 570469340 /nfs/dbraw/zinc/46/93/40/570469340.db2.gz NWDBNTXDPCAXJO-INIZCTEOSA-N 1 1 356.445 3.555 50 0 FHAAMO Cc1cc(F)ccc1NC(=O)CC[C@@H]1CCC[N@@H+](Cc2ncccn2)C1 ZINC000095529592 570469342 /nfs/dbraw/zinc/46/93/42/570469342.db2.gz NWDBNTXDPCAXJO-INIZCTEOSA-N 1 1 356.445 3.555 50 0 FHAAMO C[C@@H]1C[NH+](Cc2ccc(C(=O)N[C@@H]3CCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000046435321 570502491 /nfs/dbraw/zinc/50/24/91/570502491.db2.gz FHEZZRCEQVNWLE-DRSNIGMVSA-N 1 1 364.489 3.713 50 0 FHAAMO CCOC(=O)c1ccccc1C(=O)c1cccc(C[NH+]2CCSCC2)c1 ZINC000002515277 570523213 /nfs/dbraw/zinc/52/32/13/570523213.db2.gz SJFTYNPVLYUKNN-UHFFFAOYSA-N 1 1 369.486 3.643 50 0 FHAAMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2cncc(-c3ccc(OCC)cc3)c2)C1 ZINC000034670317 570527060 /nfs/dbraw/zinc/52/70/60/570527060.db2.gz XMDCZBHDGIFUAA-IBGZPJMESA-N 1 1 368.477 3.922 50 0 FHAAMO COc1ccccc1[C@H](CC(=O)NCC(C)C)c1c[nH+]c2n1CC[C@H](C)C2 ZINC000034921198 570563172 /nfs/dbraw/zinc/56/31/72/570563172.db2.gz SUTPDSIVRRTXMB-WMZOPIPTSA-N 1 1 369.509 3.768 50 0 FHAAMO COc1cccc([C@@H](CC(=O)NC(C)C)c2c[nH+]c3n2[C@@H](C)CCC3)c1 ZINC000034919259 570563403 /nfs/dbraw/zinc/56/34/03/570563403.db2.gz TWBWSKJBXGQSED-MAUKXSAKSA-N 1 1 355.482 3.836 50 0 FHAAMO CCC[N@H+](Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1ccccc1C ZINC000036095972 570566674 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FHAAMO Cc1ccoc1C(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(F)c(F)c1)C2 ZINC000011775615 570706626 /nfs/dbraw/zinc/70/66/26/570706626.db2.gz ICMSLGMKYPHVAC-OAQYLSRUSA-N 1 1 374.431 3.995 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cc1OC ZINC000011840944 570709395 /nfs/dbraw/zinc/70/93/95/570709395.db2.gz AILAKWMVBNVBMQ-QGZVFWFLSA-N 1 1 357.425 3.938 50 0 FHAAMO COc1ccc(C[N@@H+]2CCC[C@H](C(=O)c3ccccc3OC)C2)c(OC)c1 ZINC000011843564 570709794 /nfs/dbraw/zinc/70/97/94/570709794.db2.gz KACJLISCWRTOFN-KRWDZBQOSA-N 1 1 369.461 3.807 50 0 FHAAMO COc1ccc(C[N@H+]2CCC[C@H](C(=O)c3ccccc3OC)C2)c(OC)c1 ZINC000011843564 570709797 /nfs/dbraw/zinc/70/97/97/570709797.db2.gz KACJLISCWRTOFN-KRWDZBQOSA-N 1 1 369.461 3.807 50 0 FHAAMO CN(C)c1ncc(C[N@H+]2CCC[C@](CO)(CCCc3ccccc3)C2)s1 ZINC000011843559 570709928 /nfs/dbraw/zinc/70/99/28/570709928.db2.gz RPRFXHSJIQBNTP-OAQYLSRUSA-N 1 1 373.566 3.807 50 0 FHAAMO Cc1ccc(-n2cc(C[N@H+]3CCC[C@H]3CO)c(-c3ccc(F)cc3)n2)cc1 ZINC000011878426 570710844 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CCOC(=O)[C@]1(CCOC)CCC[N@@H+](Cc2cccc(SC)c2)C1 ZINC000012089792 570718254 /nfs/dbraw/zinc/71/82/54/570718254.db2.gz KTCZSZCLXIIGOU-IBGZPJMESA-N 1 1 351.512 3.590 50 0 FHAAMO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC[C@@H](CCC(=O)NC2CC2)C1 ZINC000012111792 570718843 /nfs/dbraw/zinc/71/88/43/570718843.db2.gz IRBPBLGQVFKDCL-HNNXBMFYSA-N 1 1 373.522 3.982 50 0 FHAAMO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@@H](CCC(=O)NC2CC2)C1 ZINC000012111792 570718847 /nfs/dbraw/zinc/71/88/47/570718847.db2.gz IRBPBLGQVFKDCL-HNNXBMFYSA-N 1 1 373.522 3.982 50 0 FHAAMO CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)c3cccc(OC)c3)C2)ccc1O ZINC000012209345 570728056 /nfs/dbraw/zinc/72/80/56/570728056.db2.gz XYZZEPUYSVDAFW-GOSISDBHSA-N 1 1 369.461 3.894 50 0 FHAAMO CC(C)/C=C/C[N@H+]1CCC[C@@H](C(=O)Nc2ccc(-c3cc[nH]n3)cc2)C1 ZINC000012304707 570734385 /nfs/dbraw/zinc/73/43/85/570734385.db2.gz LVOIIZVBEHRDRG-YWPBOTNQSA-N 1 1 352.482 3.939 50 0 FHAAMO O=C(NCC[N@@H+]1Cc2ccccc2O[C@H](c2ccccc2)C1)C1=CCCC1 ZINC000012332390 570737163 /nfs/dbraw/zinc/73/71/63/570737163.db2.gz SQASFGZLRHHZRC-QFIPXVFZSA-N 1 1 362.473 3.849 50 0 FHAAMO CSCc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](CCc3ccccc3)C2)o1 ZINC000012386365 570741285 /nfs/dbraw/zinc/74/12/85/570741285.db2.gz CHSSTRKGVUVPGY-SFHVURJKSA-N 1 1 372.534 3.922 50 0 FHAAMO c1cc(CN(Cc2cccnc2)C[C@H]2CCC[N@H+](C3CCCCC3)C2)n[nH]1 ZINC000012434264 570744756 /nfs/dbraw/zinc/74/47/56/570744756.db2.gz BNVBWMNOCRKQKO-HXUWFJFHSA-N 1 1 367.541 3.852 50 0 FHAAMO O=C(C[NH+]1CCCCC1)Nc1ccc(NC(=O)c2cccc(F)c2)cc1 ZINC000006241066 570779692 /nfs/dbraw/zinc/77/96/92/570779692.db2.gz SMEDSKCITMXULE-UHFFFAOYSA-N 1 1 355.413 3.502 50 0 FHAAMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cccc3c2O[C@@H](C)[C@H]3C)CC1 ZINC000032820186 570817771 /nfs/dbraw/zinc/81/77/71/570817771.db2.gz BLZYUBLYNKUZEK-MSOLQXFVSA-N 1 1 364.489 3.837 50 0 FHAAMO C[C@H]1CCC[N@@H+](CC(=O)N2c3ccccc3OC[C@@H]2c2ccccc2)C1 ZINC000016334627 570854687 /nfs/dbraw/zinc/85/46/87/570854687.db2.gz UVCFBZNFCJHWOD-FXAWDEMLSA-N 1 1 350.462 3.885 50 0 FHAAMO 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FHAAMO CCOc1ccccc1[C@@H](CC)NC(=O)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000077171229 571139807 /nfs/dbraw/zinc/13/98/07/571139807.db2.gz QABROQISDHCDGN-IEBWSBKVSA-N 1 1 355.482 3.818 50 0 FHAAMO CCC[N@H+]1CCC[C@@H](CNc2nc(C3CCCC3)nc3c2cnn3C)C1 ZINC000072135404 571171328 /nfs/dbraw/zinc/17/13/28/571171328.db2.gz VBHAQHQMBOVXCS-HNNXBMFYSA-N 1 1 356.518 3.555 50 0 FHAAMO Cc1nc([C@@H]2CCC[N@@H+](Cc3ccc(OC4CCCC4)cc3)C2)cc(=O)[nH]1 ZINC000072143448 571172416 /nfs/dbraw/zinc/17/24/16/571172416.db2.gz RQEOECWQEWIQGP-GOSISDBHSA-N 1 1 367.493 3.779 50 0 FHAAMO COc1c(F)cc(CN2CCC[N@@H+](Cc3ccncc3)CC2)cc1Cl ZINC000072161438 571175733 /nfs/dbraw/zinc/17/57/33/571175733.db2.gz LSCAGJQAFJHOQH-UHFFFAOYSA-N 1 1 363.864 3.591 50 0 FHAAMO CNc1nc(C[N@H+]2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@@H]32)cs1 ZINC000072162314 571175979 /nfs/dbraw/zinc/17/59/79/571175979.db2.gz RNAORIJMVHUOBV-CMKODMSKSA-N 1 1 357.523 3.837 50 0 FHAAMO COc1c[nH]c(CN2CCCC[C@@H]2c2ccc(C[NH+](C)C)cc2)cc1=O ZINC000072166645 571176779 /nfs/dbraw/zinc/17/67/79/571176779.db2.gz BJHZUQGFMMPROB-LJQANCHMSA-N 1 1 355.482 3.585 50 0 FHAAMO CCOC(=O)c1c2c(sc1NC(=O)C[N@@H+](C)C1CCCCC1)CCC2 ZINC000003237473 571177090 /nfs/dbraw/zinc/17/70/90/571177090.db2.gz YXVVBJZXBDGEKC-UHFFFAOYSA-N 1 1 364.511 3.617 50 0 FHAAMO OC1(c2cccc(C(F)(F)F)c2)CC[NH+](Cc2ncccc2F)CC1 ZINC000072168861 571177289 /nfs/dbraw/zinc/17/72/89/571177289.db2.gz ZZRSQTFQJPIDNM-UHFFFAOYSA-N 1 1 354.347 3.723 50 0 FHAAMO CC(C)n1ccnc1C[N@@H+]1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 ZINC000072174249 571177743 /nfs/dbraw/zinc/17/77/43/571177743.db2.gz ZBVDPZMMVWGGKS-KSEOMHKRSA-N 1 1 368.500 3.665 50 0 FHAAMO CC(C)n1ccnc1C[N@H+]1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 ZINC000072174249 571177744 /nfs/dbraw/zinc/17/77/44/571177744.db2.gz ZBVDPZMMVWGGKS-KSEOMHKRSA-N 1 1 368.500 3.665 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@H]3C(C)(C)O)cs2)cc1OC ZINC000118981444 571177878 /nfs/dbraw/zinc/17/78/78/571177878.db2.gz CFKPJAPZHCWLAO-KRWDZBQOSA-N 1 1 362.495 3.563 50 0 FHAAMO CC[N@H+](CC(=O)NCc1cccs1)Cc1cccc(Br)c1 ZINC000012982379 571184626 /nfs/dbraw/zinc/18/46/26/571184626.db2.gz ZUNKPBGRAMVVGZ-UHFFFAOYSA-N 1 1 367.312 3.649 50 0 FHAAMO CC[N@@H+](CC(=O)NCc1cccs1)Cc1cccc(Br)c1 ZINC000012982379 571184629 /nfs/dbraw/zinc/18/46/29/571184629.db2.gz ZUNKPBGRAMVVGZ-UHFFFAOYSA-N 1 1 367.312 3.649 50 0 FHAAMO O=C(C[C@H]1COCC[N@@H+]1Cc1ccc(C2CCCC2)s1)N1CCCC1 ZINC000072419614 571192937 /nfs/dbraw/zinc/19/29/37/571192937.db2.gz JHMDWMGDBHFNKO-KRWDZBQOSA-N 1 1 362.539 3.619 50 0 FHAAMO O=C(C[C@H]1COCC[N@H+]1Cc1ccc(C2CCCC2)s1)N1CCCC1 ZINC000072419614 571192938 /nfs/dbraw/zinc/19/29/38/571192938.db2.gz JHMDWMGDBHFNKO-KRWDZBQOSA-N 1 1 362.539 3.619 50 0 FHAAMO CNc1nc(N[C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3)C2)nc2c1CCC2 ZINC000072427906 571194792 /nfs/dbraw/zinc/19/47/92/571194792.db2.gz NXFUTHJJSMAYJR-MRXNPFEDSA-N 1 1 371.916 3.737 50 0 FHAAMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@@]4(CN(C)C(=O)O4)C3)o2)cc1 ZINC000072475691 571198944 /nfs/dbraw/zinc/19/89/44/571198944.db2.gz VZCJOYSZRQURSZ-LJQANCHMSA-N 1 1 358.463 3.766 50 0 FHAAMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@]4(CN(C)C(=O)O4)C3)o2)cc1 ZINC000072475691 571198946 /nfs/dbraw/zinc/19/89/46/571198946.db2.gz VZCJOYSZRQURSZ-LJQANCHMSA-N 1 1 358.463 3.766 50 0 FHAAMO Nc1ncccc1CN1CCC[C@]2(CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000072480268 571199863 /nfs/dbraw/zinc/19/98/63/571199863.db2.gz OJYVEWKOWBRYIT-QFIPXVFZSA-N 1 1 350.510 3.542 50 0 FHAAMO CCOC(=O)CCn1c2ccc(C(F)(F)F)cc2c2c1CC[N@@H+](C)C2 ZINC000075567479 571200702 /nfs/dbraw/zinc/20/07/02/571200702.db2.gz PTVJZPKKLFGAGS-UHFFFAOYSA-N 1 1 354.372 3.601 50 0 FHAAMO CCOC(=O)CCn1c2ccc(C(F)(F)F)cc2c2c1CC[N@H+](C)C2 ZINC000075567479 571200704 /nfs/dbraw/zinc/20/07/04/571200704.db2.gz PTVJZPKKLFGAGS-UHFFFAOYSA-N 1 1 354.372 3.601 50 0 FHAAMO c1ccc([C@@H]2C[C@H](c3noc(CCc4cccnc4)n3)[C@H]3CCC[N@@H+]32)cc1 ZINC000299796633 571202153 /nfs/dbraw/zinc/20/21/53/571202153.db2.gz NUHNYDMNYCNNRR-ZCNNSNEGSA-N 1 1 360.461 3.943 50 0 FHAAMO COCC[N@H+]1CCC[C@H](CNC(=O)c2cccc(-c3ccc(C)cc3)c2)C1 ZINC000299796745 571202520 /nfs/dbraw/zinc/20/25/20/571202520.db2.gz PIRIPXWWCREUKO-LJQANCHMSA-N 1 1 366.505 3.750 50 0 FHAAMO C[C@H]1CCCC[N@H+]1C1CN(C(=O)c2cccc(-c3ccc4c[nH]nc4c3)c2)C1 ZINC000534662608 571209028 /nfs/dbraw/zinc/20/90/28/571209028.db2.gz NKARHHBQPAZSEF-INIZCTEOSA-N 1 1 374.488 3.929 50 0 FHAAMO CC[N@@H+](C)C1(CNC(=O)c2cccc(-c3ccc(O)cn3)c2)CCCCC1 ZINC000534676078 571209230 /nfs/dbraw/zinc/20/92/30/571209230.db2.gz NTLHYLBDKCIOFV-UHFFFAOYSA-N 1 1 367.493 3.839 50 0 FHAAMO COc1ccc(CN(C(=O)c2ccco2)[C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000006576888 571210337 /nfs/dbraw/zinc/21/03/37/571210337.db2.gz SUTXCIMFRCHMFF-FRQCXROJSA-N 1 1 356.466 3.659 50 0 FHAAMO CC1(C)C[N@H+](C2CCN(C(=O)c3ccccn3)CC2)C[C@H]1c1ccccc1 ZINC000426379723 571216988 /nfs/dbraw/zinc/21/69/88/571216988.db2.gz MLFFVKOVYWQIGN-FQEVSTJZSA-N 1 1 363.505 3.812 50 0 FHAAMO Cc1[nH+]ccn1CCN(C)C(=O)c1cccc(-c2cccc([C@H](C)O)c2)c1 ZINC000426444409 571225970 /nfs/dbraw/zinc/22/59/70/571225970.db2.gz DLBMPXOPUBKQGX-INIZCTEOSA-N 1 1 363.461 3.684 50 0 FHAAMO C[N@@H+](CCCOc1ccc(Cl)cc1)[C@@H]1CCOC2(CCOCC2)C1 ZINC000082099699 571228152 /nfs/dbraw/zinc/22/81/52/571228152.db2.gz ZGTCKHPFSQKEAS-QGZVFWFLSA-N 1 1 353.890 3.769 50 0 FHAAMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)c2cccc(C)c2n1 ZINC000082100274 571228424 /nfs/dbraw/zinc/22/84/24/571228424.db2.gz LHAJJWKCVWHNSB-NRFANRHFSA-N 1 1 359.473 3.981 50 0 FHAAMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)c2cccc(C)c2n1 ZINC000082100274 571228425 /nfs/dbraw/zinc/22/84/25/571228425.db2.gz LHAJJWKCVWHNSB-NRFANRHFSA-N 1 1 359.473 3.981 50 0 FHAAMO COCC[N@H+]1CCC[C@]2(CCN(c3ccnc4cc(Cl)ccc43)C2)C1 ZINC000426504402 571228977 /nfs/dbraw/zinc/22/89/77/571228977.db2.gz BUOMWCULTTUTCV-FQEVSTJZSA-N 1 1 359.901 3.827 50 0 FHAAMO COCC[N@H+]1CC[C@@H](CNC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC000426574864 571231996 /nfs/dbraw/zinc/23/19/96/571231996.db2.gz WJVJQWUHHVTRHV-INIZCTEOSA-N 1 1 372.896 3.705 50 0 FHAAMO CN(C[C@H]1CCCC[N@H+]1C)C(=O)c1cccc(-c2cc(F)c(F)cc2O)c1 ZINC000426613698 571233316 /nfs/dbraw/zinc/23/33/16/571233316.db2.gz YAYZAJZVICXZFT-MRXNPFEDSA-N 1 1 374.431 3.894 50 0 FHAAMO Cc1nc(C)c(-c2cccc(C(=O)N(C)CCn3cc[nH+]c3C)c2)s1 ZINC000426740587 571236852 /nfs/dbraw/zinc/23/68/52/571236852.db2.gz SFKLTOOVLJIWON-UHFFFAOYSA-N 1 1 354.479 3.704 50 0 FHAAMO Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2cccnc2)C3)ccc1Cl ZINC000091269654 571238543 /nfs/dbraw/zinc/23/85/43/571238543.db2.gz JNYINNWZROQMPF-PKOBYXMFSA-N 1 1 369.896 3.780 50 0 FHAAMO Cc1ccc(C[N@@H+](Cc2nc(C(=O)NC3CC3)co2)[C@@H](C)C(C)C)cc1 ZINC000036063920 571239953 /nfs/dbraw/zinc/23/99/53/571239953.db2.gz BQPHYHXJPYCYCR-INIZCTEOSA-N 1 1 355.482 3.922 50 0 FHAAMO Cc1ccc(C[N@H+](Cc2nc(C(=O)NC3CC3)co2)[C@@H](C)C(C)C)cc1 ZINC000036063920 571239954 /nfs/dbraw/zinc/23/99/54/571239954.db2.gz BQPHYHXJPYCYCR-INIZCTEOSA-N 1 1 355.482 3.922 50 0 FHAAMO CC(C)(Oc1ccccc1)C(=O)N1C[C@H]2CC[C@H](C[N@@H+]2CC2CCC2)C1 ZINC000091616367 571241396 /nfs/dbraw/zinc/24/13/96/571241396.db2.gz UMSHFAUGDJLBGP-RTBURBONSA-N 1 1 356.510 3.567 50 0 FHAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(Cc3ncccn3)CC2)C1 ZINC000091643939 571241462 /nfs/dbraw/zinc/24/14/62/571241462.db2.gz MBRXFODSRCSPFA-FQEVSTJZSA-N 1 1 350.510 3.568 50 0 FHAAMO COc1cccc(C[N@@H+](CC(C)C)C[C@@H](O)COCc2ccccc2)c1 ZINC000036100078 571241549 /nfs/dbraw/zinc/24/15/49/571241549.db2.gz QVIZZSBIFRPYDF-OAQYLSRUSA-N 1 1 357.494 3.731 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@H+](Cc1ccco1)Cc1ccc(F)cc1 ZINC000036102476 571241903 /nfs/dbraw/zinc/24/19/03/571241903.db2.gz NSABIPWJHZYAEG-SFHVURJKSA-N 1 1 359.397 3.592 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccco1)Cc1ccc(F)cc1 ZINC000036102476 571241904 /nfs/dbraw/zinc/24/19/04/571241904.db2.gz NSABIPWJHZYAEG-SFHVURJKSA-N 1 1 359.397 3.592 50 0 FHAAMO C[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(Cc3nnc(C4CC4)o3)CC2)C1 ZINC000091657120 571242063 /nfs/dbraw/zinc/24/20/63/571242063.db2.gz MYZPCXNOHCSCKP-IBGZPJMESA-N 1 1 366.509 3.649 50 0 FHAAMO COc1ccc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(C(=O)c2csc(C)c2)C3)cc1 ZINC000091663927 571242083 /nfs/dbraw/zinc/24/20/83/571242083.db2.gz PEEVOIFDFCJHKR-PKOBYXMFSA-N 1 1 370.518 3.802 50 0 FHAAMO O[C@@H](COCc1ccccc1)C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000036103230 571242209 /nfs/dbraw/zinc/24/22/09/571242209.db2.gz LROSXZZDFXQNTH-OAQYLSRUSA-N 1 1 351.446 3.860 50 0 FHAAMO CCCC(=O)OC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1 ZINC000036104315 571242272 /nfs/dbraw/zinc/24/22/72/571242272.db2.gz SECPKOQJOOHIOI-HXUWFJFHSA-N 1 1 359.441 3.532 50 0 FHAAMO CC[C@@H](C)[N@H+](Cc1ccc(F)cc1F)C[C@@H](O)COCc1ccco1 ZINC000169678032 571246979 /nfs/dbraw/zinc/24/69/79/571246979.db2.gz IOOGXHSFONREPU-RHSMWYFYSA-N 1 1 353.409 3.736 50 0 FHAAMO O=C(NC[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000169680661 571247180 /nfs/dbraw/zinc/24/71/80/571247180.db2.gz UOVDWAMJYCHVQU-BEFAXECRSA-N 1 1 372.900 3.724 50 0 FHAAMO C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000036397393 571253178 /nfs/dbraw/zinc/25/31/78/571253178.db2.gz NJUFYTNHPFJELG-IKVWTGGYSA-N 1 1 370.537 3.911 50 0 FHAAMO C[C@H](NC(=O)C[N@@H+]1CCC[C@H]1c1cccn1C)c1cc2ccccc2o1 ZINC000036488148 571256043 /nfs/dbraw/zinc/25/60/43/571256043.db2.gz QWZBFOWGJSWULM-YJBOKZPZSA-N 1 1 351.450 3.786 50 0 FHAAMO C[C@H](NC(=O)C[N@H+]1CCC[C@H]1c1cccn1C)c1cc2ccccc2o1 ZINC000036488148 571256044 /nfs/dbraw/zinc/25/60/44/571256044.db2.gz QWZBFOWGJSWULM-YJBOKZPZSA-N 1 1 351.450 3.786 50 0 FHAAMO COc1ccc(C(=O)C[NH+]2CCC(Cn3cnc4ccccc43)CC2)cc1 ZINC000036708895 571261422 /nfs/dbraw/zinc/26/14/22/571261422.db2.gz KFCUZCKKZJCLCV-UHFFFAOYSA-N 1 1 363.461 3.640 50 0 FHAAMO C[N@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCC3)[C@@H]1CCCc2ccccc21 ZINC000007327926 571264430 /nfs/dbraw/zinc/26/44/30/571264430.db2.gz QAVVATJJLKOPQK-MRXNPFEDSA-N 1 1 365.502 3.983 50 0 FHAAMO C[N@@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCC3)[C@@H]1CCCc2ccccc21 ZINC000007327926 571264431 /nfs/dbraw/zinc/26/44/31/571264431.db2.gz QAVVATJJLKOPQK-MRXNPFEDSA-N 1 1 365.502 3.983 50 0 FHAAMO CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)C[N@H+]1CCC[C@H](C)C1 ZINC000037222261 571266090 /nfs/dbraw/zinc/26/60/90/571266090.db2.gz BMFOXBJYAQQZII-WMZOPIPTSA-N 1 1 373.541 3.601 50 0 FHAAMO CN(Cc1ccc(Br)cc1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000170614524 571268081 /nfs/dbraw/zinc/26/80/81/571268081.db2.gz JNACFHOFUWZZFH-MRXNPFEDSA-N 1 1 353.304 3.672 50 0 FHAAMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2CC(=O)N[C@H](C)c2ccccc2)c1 ZINC000007717379 571286284 /nfs/dbraw/zinc/28/62/84/571286284.db2.gz ALPMVARFXLZYFH-OXQOHEQNSA-N 1 1 368.477 3.718 50 0 FHAAMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CC(=O)N[C@H](C)c2ccccc2)c1 ZINC000007717379 571286286 /nfs/dbraw/zinc/28/62/86/571286286.db2.gz ALPMVARFXLZYFH-OXQOHEQNSA-N 1 1 368.477 3.718 50 0 FHAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)Nc2ccc(C)cc2)c(OC)c1 ZINC000007719577 571286441 /nfs/dbraw/zinc/28/64/41/571286441.db2.gz IGCXHGGOHWUUCV-LJQANCHMSA-N 1 1 354.450 3.788 50 0 FHAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)Nc2ccc(C)cc2)c(OC)c1 ZINC000007719577 571286443 /nfs/dbraw/zinc/28/64/43/571286443.db2.gz IGCXHGGOHWUUCV-LJQANCHMSA-N 1 1 354.450 3.788 50 0 FHAAMO C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2)C[C@H](C)O1 ZINC000195528680 571289641 /nfs/dbraw/zinc/28/96/41/571289641.db2.gz FHEZZRCEQVNWLE-JKSBSHDWSA-N 1 1 364.489 3.713 50 0 FHAAMO C[C@@H]1C[N@H+](Cc2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2)C[C@H](C)O1 ZINC000195528680 571289642 /nfs/dbraw/zinc/28/96/42/571289642.db2.gz FHEZZRCEQVNWLE-JKSBSHDWSA-N 1 1 364.489 3.713 50 0 FHAAMO Cc1nc(-c2ccccc2C)n(C[N@H+](C)C[C@@H]2OCCc3ccccc32)n1 ZINC000066079166 571290196 /nfs/dbraw/zinc/29/01/96/571290196.db2.gz WTEHUZGGYKVSDO-NRFANRHFSA-N 1 1 362.477 3.765 50 0 FHAAMO Cc1nc(-c2ccccc2C)n(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)n1 ZINC000066079166 571290198 /nfs/dbraw/zinc/29/01/98/571290198.db2.gz WTEHUZGGYKVSDO-NRFANRHFSA-N 1 1 362.477 3.765 50 0 FHAAMO COc1ccc2cc(C[N@H+](C)CC(=O)NCc3ccc(F)cc3)ccc2c1 ZINC000007926655 571294468 /nfs/dbraw/zinc/29/44/68/571294468.db2.gz NDKPQYZWEAKDIO-UHFFFAOYSA-N 1 1 366.436 3.736 50 0 FHAAMO COc1ccc2cc(C[N@@H+](C)CC(=O)NCc3ccc(F)cc3)ccc2c1 ZINC000007926655 571294470 /nfs/dbraw/zinc/29/44/70/571294470.db2.gz NDKPQYZWEAKDIO-UHFFFAOYSA-N 1 1 366.436 3.736 50 0 FHAAMO COC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)[C@@H](C)[N@H+]1CCCC(C)(C)C1 ZINC000002308763 571317483 /nfs/dbraw/zinc/31/74/83/571317483.db2.gz IPTLTKDOGSOEOV-CQSZACIVSA-N 1 1 371.481 3.712 50 0 FHAAMO O=C(CCc1ccc(Cl)c(F)c1)N1CC([N@@H+]2CCc3ccccc3C2)C1 ZINC000253473928 571318651 /nfs/dbraw/zinc/31/86/51/571318651.db2.gz ZXLRHGCZWZXODQ-UHFFFAOYSA-N 1 1 372.871 3.681 50 0 FHAAMO O=C(CCc1ccc(Cl)c(F)c1)N1CC([N@H+]2CCc3ccccc3C2)C1 ZINC000253473928 571318652 /nfs/dbraw/zinc/31/86/52/571318652.db2.gz ZXLRHGCZWZXODQ-UHFFFAOYSA-N 1 1 372.871 3.681 50 0 FHAAMO Fc1ccc([C@H](c2ccccc2)[NH+]2CCC(CN3CCOCC3)CC2)cc1 ZINC000078971190 571326452 /nfs/dbraw/zinc/32/64/52/571326452.db2.gz KRPGQACYZJBYDR-QHCPKHFHSA-N 1 1 368.496 3.959 50 0 FHAAMO CCOCc1ccc(NC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000467950087 571327867 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ZINC000014980765 220139331 /nfs/dbraw/zinc/13/93/31/220139331.db2.gz KJGQNVJNBHDEIC-NRFANRHFSA-N 1 1 362.464 3.970 50 0 FHAAMO CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCC[N@H+](Cc2ncc[nH]2)C1 ZINC000015077119 220146878 /nfs/dbraw/zinc/14/68/78/220146878.db2.gz CKEILCDWWWGNPV-VMLCMGRWSA-N 1 1 353.466 3.659 50 0 FHAAMO CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCC[N@@H+](Cc2ncc[nH]2)C1 ZINC000015077119 220146881 /nfs/dbraw/zinc/14/68/81/220146881.db2.gz CKEILCDWWWGNPV-VMLCMGRWSA-N 1 1 353.466 3.659 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cn1c(-c2cccs2)cc2ccccc21 ZINC000015860939 220168797 /nfs/dbraw/zinc/16/87/97/220168797.db2.gz VCCMQXCASKNSBG-QGZVFWFLSA-N 1 1 367.518 3.970 50 0 FHAAMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccc(Br)o1 ZINC000015860052 220169004 /nfs/dbraw/zinc/16/90/04/220169004.db2.gz MONJNAHEBQBVIF-LBPRGKRZSA-N 1 1 367.243 3.592 50 0 FHAAMO COCC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(=O)c2cccc(F)c2[nH]1 ZINC000015862300 220169569 /nfs/dbraw/zinc/16/95/69/220169569.db2.gz MILIZBZNXDXEQR-UHFFFAOYSA-N 1 1 374.843 3.969 50 0 FHAAMO CCN(C(=O)C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000016339551 220182116 /nfs/dbraw/zinc/18/21/16/220182116.db2.gz WBMXMTOGFRQPDS-LJQANCHMSA-N 1 1 366.461 3.648 50 0 FHAAMO CCN(C(=O)C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000016339551 220182118 /nfs/dbraw/zinc/18/21/18/220182118.db2.gz WBMXMTOGFRQPDS-LJQANCHMSA-N 1 1 366.461 3.648 50 0 FHAAMO CC(C)[C@H](NC(=O)C[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000016338659 220182660 /nfs/dbraw/zinc/18/26/60/220182660.db2.gz KQZOXWFPCZBAEO-KKSFZXQISA-N 1 1 360.498 3.536 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)[C@H](C)[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000016374096 220184248 /nfs/dbraw/zinc/18/42/48/220184248.db2.gz AYPZPXCOIDMIGV-INIZCTEOSA-N 1 1 356.514 3.793 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000016374096 220184250 /nfs/dbraw/zinc/18/42/50/220184250.db2.gz AYPZPXCOIDMIGV-INIZCTEOSA-N 1 1 356.514 3.793 50 0 FHAAMO C[N@@H+](CC(=O)NCCc1c[nH]c2ccccc12)[C@@H]1CCCc2ccccc21 ZINC000016695829 220190522 /nfs/dbraw/zinc/19/05/22/220190522.db2.gz FBAAQKPFDHBSSS-JOCHJYFZSA-N 1 1 361.489 3.836 50 0 FHAAMO Cc1ccsc1C[N@@H+]1CCc2n[nH]c([C@@H]3COc4ccccc4O3)c2C1 ZINC000019301090 220249828 /nfs/dbraw/zinc/24/98/28/220249828.db2.gz RCIWDUGFVJSSKC-SFHVURJKSA-N 1 1 367.474 3.850 50 0 FHAAMO Cc1ccsc1C[N@H+]1CCc2n[nH]c([C@@H]3COc4ccccc4O3)c2C1 ZINC000019301090 220249833 /nfs/dbraw/zinc/24/98/33/220249833.db2.gz RCIWDUGFVJSSKC-SFHVURJKSA-N 1 1 367.474 3.850 50 0 FHAAMO COc1ccc(OC)c([C@@H]2CC[N@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000019720448 220292304 /nfs/dbraw/zinc/29/23/04/220292304.db2.gz AUGZHLHFBXXDGY-CYBMUJFWSA-N 1 1 371.462 3.805 50 0 FHAAMO COc1ccc(OC)c([C@@H]2CC[N@@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000019720448 220292306 /nfs/dbraw/zinc/29/23/06/220292306.db2.gz AUGZHLHFBXXDGY-CYBMUJFWSA-N 1 1 371.462 3.805 50 0 FHAAMO Cc1ccc(-c2cn3c4ccccc4nc3n2CC[NH+]2CCOCC2)cc1 ZINC000019691053 220286505 /nfs/dbraw/zinc/28/65/05/220286505.db2.gz JWHDWFZFUAFWJU-UHFFFAOYSA-N 1 1 360.461 3.597 50 0 FHAAMO C[N@H+](Cc1ccccc1)[C@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000019809536 220298857 /nfs/dbraw/zinc/29/88/57/220298857.db2.gz KOQSEFUBYSUYTN-INIZCTEOSA-N 1 1 363.244 3.757 50 0 FHAAMO C[N@@H+](Cc1ccccc1)[C@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000019809536 220298860 /nfs/dbraw/zinc/29/88/60/220298860.db2.gz KOQSEFUBYSUYTN-INIZCTEOSA-N 1 1 363.244 3.757 50 0 FHAAMO C[C@H]1CCC[C@H]([NH+]2CCC(N3CCN(Cc4ccccc4)CC3)CC2)C1 ZINC000019888821 220304266 /nfs/dbraw/zinc/30/42/66/220304266.db2.gz KZAYPWPXFXBOLG-REWPJTCUSA-N 1 1 355.570 3.847 50 0 FHAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)c2cc3ccc4cccnc4c3[nH]2)C1 ZINC000020575512 220335203 /nfs/dbraw/zinc/33/52/03/220335203.db2.gz NPTMFDYLKPRMKV-OAHLLOKOSA-N 1 1 350.466 3.568 50 0 FHAAMO NC(=O)c1ccc([C@@H]2CCC[N@@H+]2Cc2cnn(-c3ccccc3F)c2)s1 ZINC000020862978 220343061 /nfs/dbraw/zinc/34/30/61/220343061.db2.gz UGNRQIHIQQUCOL-INIZCTEOSA-N 1 1 370.453 3.509 50 0 FHAAMO NC(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2cnn(-c3ccccc3F)c2)s1 ZINC000020862978 220343065 /nfs/dbraw/zinc/34/30/65/220343065.db2.gz UGNRQIHIQQUCOL-INIZCTEOSA-N 1 1 370.453 3.509 50 0 FHAAMO C/C(=C\c1ccccc1)C[N@@H+]1CCN(Cc2ccc(C)o2)[C@@H](CCO)C1 ZINC000020994120 220348010 /nfs/dbraw/zinc/34/80/10/220348010.db2.gz FYDSCXRFJASYFS-TVADFSRQSA-N 1 1 354.494 3.560 50 0 FHAAMO C/C(=C\c1ccccc1)C[N@H+]1CCN(Cc2ccc(C)o2)[C@@H](CCO)C1 ZINC000020994120 220348012 /nfs/dbraw/zinc/34/80/12/220348012.db2.gz FYDSCXRFJASYFS-TVADFSRQSA-N 1 1 354.494 3.560 50 0 FHAAMO Cc1ccccc1OCC[N@H+](C)CCC(=O)NCc1ccccc1Cl ZINC000021320884 220356054 /nfs/dbraw/zinc/35/60/54/220356054.db2.gz NJTBSHMRHYBGDZ-UHFFFAOYSA-N 1 1 360.885 3.666 50 0 FHAAMO C[NH+]1CCN(Cc2cccc(C(=O)c3cc(Cl)ccc3Cl)c2)CC1 ZINC000022028069 220373925 /nfs/dbraw/zinc/37/39/25/220373925.db2.gz XCABMQVTJSYECL-UHFFFAOYSA-N 1 1 363.288 3.972 50 0 FHAAMO CCOc1cc(CNCC[NH+](C)C)ccc1OCc1ccc(Cl)cc1 ZINC000022075367 220376693 /nfs/dbraw/zinc/37/66/93/220376693.db2.gz QVSYBVCGVWNDNE-UHFFFAOYSA-N 1 1 362.901 3.969 50 0 FHAAMO O=C(NCC1([NH+]2CCOCC2)CCCCC1)c1ccc(Cl)cc1Cl ZINC000022462192 220386519 /nfs/dbraw/zinc/38/65/19/220386519.db2.gz MWIOPCRPZVAJSX-UHFFFAOYSA-N 1 1 371.308 3.758 50 0 FHAAMO CC[NH+]1CCN([C@H](c2cccs2)[C@@H](C)NC(=O)c2ccc(C)cc2)CC1 ZINC000022460099 220386729 /nfs/dbraw/zinc/38/67/29/220386729.db2.gz FYSSMAPBTFFJTD-XLIONFOSSA-N 1 1 371.550 3.554 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)c1ccc2ncsc2c1)c1ccccc1Cl ZINC000022619867 220392269 /nfs/dbraw/zinc/39/22/69/220392269.db2.gz INQYUPMGMKSMTM-MRXNPFEDSA-N 1 1 359.882 3.982 50 0 FHAAMO C[C@H](c1nnc(-c2cccs2)o1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000022802372 220398474 /nfs/dbraw/zinc/39/84/74/220398474.db2.gz VFCSATDKTKXXGX-OAHLLOKOSA-N 1 1 354.479 3.677 50 0 FHAAMO C[C@@H](NC(=O)C1CC1)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000023181120 220418275 /nfs/dbraw/zinc/41/82/75/220418275.db2.gz ICPZCIGYUOLMBY-UZLBHIALSA-N 1 1 369.534 3.526 50 0 FHAAMO COc1cc(NC(=O)C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)cc(OC)c1 ZINC000048303167 221006635 /nfs/dbraw/zinc/00/66/35/221006635.db2.gz FLQXHAUZBHIHEQ-OAQYLSRUSA-N 1 1 366.461 3.794 50 0 FHAAMO Cc1ncsc1C(=O)NCc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000048310260 221006981 /nfs/dbraw/zinc/00/69/81/221006981.db2.gz LBVNQKNSTYXOGM-GASCZTMLSA-N 1 1 357.523 3.859 50 0 FHAAMO Cc1ccc(C(=O)NCc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)s1 ZINC000048344699 221008650 /nfs/dbraw/zinc/00/86/50/221008650.db2.gz OVZXKIHXNOFDIT-GJZGRUSLSA-N 1 1 358.507 3.596 50 0 FHAAMO C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)CCc2ccccc2)C[C@@H](C)O1 ZINC000048358540 221010478 /nfs/dbraw/zinc/01/04/78/221010478.db2.gz PBKPTYQQBBPMDP-RTBURBONSA-N 1 1 366.505 3.545 50 0 FHAAMO C[C@H]1C[NH+](Cc2ccccc2CNC(=O)CCc2ccsc2)C[C@H](C)O1 ZINC000048358398 221010694 /nfs/dbraw/zinc/01/06/94/221010694.db2.gz OVOUJQUGIDRBLF-IRXDYDNUSA-N 1 1 372.534 3.606 50 0 FHAAMO C[N@@H+](CCC(=O)Nc1ccccc1)Cc1cc(Br)cs1 ZINC000048575411 221014526 /nfs/dbraw/zinc/01/45/26/221014526.db2.gz WLZIVBUBCCEAEV-UHFFFAOYSA-N 1 1 353.285 3.971 50 0 FHAAMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]2c2ccsc2)cc1OC ZINC000052803664 221040134 /nfs/dbraw/zinc/04/01/34/221040134.db2.gz AHSKNZHDLYMBCP-XJKSGUPXSA-N 1 1 360.479 3.929 50 0 FHAAMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2c2ccsc2)cc1OC ZINC000052803664 221040136 /nfs/dbraw/zinc/04/01/36/221040136.db2.gz AHSKNZHDLYMBCP-XJKSGUPXSA-N 1 1 360.479 3.929 50 0 FHAAMO CCc1ncc(CN2CC[C@@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cn1 ZINC000055107983 221058658 /nfs/dbraw/zinc/05/86/58/221058658.db2.gz XSGXKXWQUNQVHE-QHCPKHFHSA-N 1 1 364.537 3.570 50 0 FHAAMO CS(=O)(=O)Nc1cccc(CNc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC000055104420 221058860 /nfs/dbraw/zinc/05/88/60/221058860.db2.gz FTSVWLDNXRMBCC-UHFFFAOYSA-N 1 1 361.854 3.872 50 0 FHAAMO CCn1c(C[NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)nc2ccccc21 ZINC000054176281 221050982 /nfs/dbraw/zinc/05/09/82/221050982.db2.gz OXNDIKCGNTYLCU-UHFFFAOYSA-N 1 1 365.481 3.876 50 0 FHAAMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc(Br)o2)C1 ZINC000054226379 221051134 /nfs/dbraw/zinc/05/11/34/221051134.db2.gz YSMCVUZUDHAAQP-OCCSQVGLSA-N 1 1 363.255 3.607 50 0 FHAAMO C[N@@H+](CCNC(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000054761770 221055782 /nfs/dbraw/zinc/05/57/82/221055782.db2.gz MWSPFSWORZCJRX-JKSUJKDBSA-N 1 1 357.420 3.539 50 0 FHAAMO CC[C@@H](CO)[N@@H+](Cc1ccco1)Cc1ccc(Oc2ncccn2)cc1 ZINC000055036145 221057235 /nfs/dbraw/zinc/05/72/35/221057235.db2.gz IZKGLTSNZWBMIA-KRWDZBQOSA-N 1 1 353.422 3.635 50 0 FHAAMO COCC[N@H+](Cc1ccc2c(C)cc(=O)oc2c1)Cc1ccccc1F ZINC000055054697 221057472 /nfs/dbraw/zinc/05/74/72/221057472.db2.gz ITLCGHLYFXULSS-UHFFFAOYSA-N 1 1 355.409 3.889 50 0 FHAAMO COCC[N@@H+](Cc1ccc2c(C)cc(=O)oc2c1)Cc1ccccc1F ZINC000055054697 221057473 /nfs/dbraw/zinc/05/74/73/221057473.db2.gz ITLCGHLYFXULSS-UHFFFAOYSA-N 1 1 355.409 3.889 50 0 FHAAMO CC[C@H](CO)[N@@H+](Cc1ccco1)Cc1ccc(Oc2ncccn2)cc1 ZINC000055036147 221057493 /nfs/dbraw/zinc/05/74/93/221057493.db2.gz IZKGLTSNZWBMIA-QGZVFWFLSA-N 1 1 353.422 3.635 50 0 FHAAMO CSc1ccc(C[N@@H+](CCO)Cc2ccc3c(C)cc(=O)oc3c2)cc1 ZINC000055358510 221066876 /nfs/dbraw/zinc/06/68/76/221066876.db2.gz XQGCOSYBPVMGFX-UHFFFAOYSA-N 1 1 369.486 3.818 50 0 FHAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc4ccccc4s3)CC2)nc1 ZINC000058171329 221102379 /nfs/dbraw/zinc/10/23/79/221102379.db2.gz CIFKZRXCZMUMPD-UHFFFAOYSA-N 1 1 366.490 3.850 50 0 FHAAMO CC[C@H](CNC(=O)[C@@H](C)OCc1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000058014218 221097542 /nfs/dbraw/zinc/09/75/42/221097542.db2.gz XNWJYNCWVLCDBN-XMSQKQJNSA-N 1 1 366.505 3.545 50 0 FHAAMO CC(C)(C)C[C@@H]1CCC[N@H+]1CC(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000060877089 221132757 /nfs/dbraw/zinc/13/27/57/221132757.db2.gz ZUXCQUVTICOGMY-ICSRJNTNSA-N 1 1 357.542 3.530 50 0 FHAAMO Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000061600592 221133238 /nfs/dbraw/zinc/13/32/38/221133238.db2.gz NVXGPWPUHQINDK-ZBFHGGJFSA-N 1 1 372.513 3.585 50 0 FHAAMO CSc1ccc(CNC(=O)C2=CC[N@@H+](Cc3cccc(F)c3)CC2)cc1 ZINC000064818113 221152325 /nfs/dbraw/zinc/15/23/25/221152325.db2.gz XBBSOYJKZHDSBG-UHFFFAOYSA-N 1 1 370.493 3.996 50 0 FHAAMO CSc1ccc(CNC(=O)C2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC000064817963 221152485 /nfs/dbraw/zinc/15/24/85/221152485.db2.gz IJWJJRMEGGTBSQ-UHFFFAOYSA-N 1 1 352.503 3.857 50 0 FHAAMO Cc1ccc2[nH]c(=O)c(CCC(=O)NCCC[N@@H+]3CCCC[C@H]3C)cc2c1 ZINC000065245482 221185859 /nfs/dbraw/zinc/18/58/59/221185859.db2.gz QBYJIYKUUUUJGM-QGZVFWFLSA-N 1 1 369.509 3.562 50 0 FHAAMO CCn1cnnc1[C@@H]1CCC[N@H+](Cc2ccc(Br)s2)C1 ZINC000065287722 221196139 /nfs/dbraw/zinc/19/61/39/221196139.db2.gz VGKMNCCKUWHQBK-LLVKDONJSA-N 1 1 355.305 3.502 50 0 FHAAMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2ccc(Br)s2)C1 ZINC000065287722 221196142 /nfs/dbraw/zinc/19/61/42/221196142.db2.gz VGKMNCCKUWHQBK-LLVKDONJSA-N 1 1 355.305 3.502 50 0 FHAAMO Cn1cc(C[NH+]2CCN(C(=O)Nc3cccc(F)c3)CC2)c2ccccc21 ZINC000065330063 221200538 /nfs/dbraw/zinc/20/05/38/221200538.db2.gz BOKWFFLVOJHWTM-UHFFFAOYSA-N 1 1 366.440 3.667 50 0 FHAAMO CCc1[nH+]ccn1CCc1nc(C2CC2)nn1-c1cccc2cccnc21 ZINC000065408119 221214386 /nfs/dbraw/zinc/21/43/86/221214386.db2.gz IBUTUFVPGGJPLJ-UHFFFAOYSA-N 1 1 358.449 3.695 50 0 FHAAMO Cc1ccc(-c2nc(NCC[C@@H]3CCC[N@@H+]3C)ncc2-c2cncnc2)cc1 ZINC000065409693 221216024 /nfs/dbraw/zinc/21/60/24/221216024.db2.gz VXGRMTKVINUBGN-IBGZPJMESA-N 1 1 374.492 3.805 50 0 FHAAMO C[N@@H+](Cc1c(F)ccc(F)c1Cl)C[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000065410380 221216259 /nfs/dbraw/zinc/21/62/59/221216259.db2.gz FCIRUSZYYBWSSY-LBPRGKRZSA-N 1 1 356.844 3.841 50 0 FHAAMO C[N@H+](Cc1c(F)ccc(F)c1Cl)C[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000065410380 221216261 /nfs/dbraw/zinc/21/62/61/221216261.db2.gz FCIRUSZYYBWSSY-LBPRGKRZSA-N 1 1 356.844 3.841 50 0 FHAAMO c1cc([C@@H]2CCCCO2)oc1CN1CCC[N@@H+](Cc2ccncc2)CC1 ZINC000065436212 221220038 /nfs/dbraw/zinc/22/00/38/221220038.db2.gz RSUIKKWBJGHYCX-FQEVSTJZSA-N 1 1 355.482 3.624 50 0 FHAAMO c1cc([C@@H]2CCCCO2)oc1C[N@H+]1CCCN(Cc2ccncc2)CC1 ZINC000065436212 221220040 /nfs/dbraw/zinc/22/00/40/221220040.db2.gz RSUIKKWBJGHYCX-FQEVSTJZSA-N 1 1 355.482 3.624 50 0 FHAAMO c1cc([C@@H]2CCCCO2)oc1C[N@@H+]1CCCN(Cc2ccncc2)CC1 ZINC000065436212 221220042 /nfs/dbraw/zinc/22/00/42/221220042.db2.gz RSUIKKWBJGHYCX-FQEVSTJZSA-N 1 1 355.482 3.624 50 0 FHAAMO O=C(Nc1ccncc1)c1cccc(C[N@H+](Cc2ccccn2)C2CC2)c1 ZINC000067756148 221281571 /nfs/dbraw/zinc/28/15/71/221281571.db2.gz FRYDJAJNAXNFDT-UHFFFAOYSA-N 1 1 358.445 3.894 50 0 FHAAMO O=C(Nc1ccncc1)c1cccc(C[N@@H+](Cc2ccccn2)C2CC2)c1 ZINC000067756148 221281574 /nfs/dbraw/zinc/28/15/74/221281574.db2.gz FRYDJAJNAXNFDT-UHFFFAOYSA-N 1 1 358.445 3.894 50 0 FHAAMO COCCC[N@@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067787108 221285740 /nfs/dbraw/zinc/28/57/40/221285740.db2.gz IVJZRRXKKFVAFO-UHFFFAOYSA-N 1 1 370.474 3.900 50 0 FHAAMO COCCC[N@H+]1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 ZINC000067787108 221285742 /nfs/dbraw/zinc/28/57/42/221285742.db2.gz IVJZRRXKKFVAFO-UHFFFAOYSA-N 1 1 370.474 3.900 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)c1cccc(C[N@H+](C)Cc2ccoc2)c1 ZINC000067975573 221312459 /nfs/dbraw/zinc/31/24/59/221312459.db2.gz GYPFNQHPMBYGIQ-UHFFFAOYSA-N 1 1 352.438 3.514 50 0 FHAAMO Cc1nn(C)c(C)c1NC(=O)c1cccc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000067975573 221312462 /nfs/dbraw/zinc/31/24/62/221312462.db2.gz GYPFNQHPMBYGIQ-UHFFFAOYSA-N 1 1 352.438 3.514 50 0 FHAAMO Cc1oc(-c2cccc(Cl)c2)nc1C[N@H+]1CCC[C@@H](CCC(N)=O)C1 ZINC000067921080 221305523 /nfs/dbraw/zinc/30/55/23/221305523.db2.gz MPVGYJOTHLLMMC-AWEZNQCLSA-N 1 1 361.873 3.781 50 0 FHAAMO CCc1[nH]c([C@H]2CC(=O)Nc3c2cnn3Cc2ccccc2Cl)c(C)[nH+]1 ZINC000067934537 221306781 /nfs/dbraw/zinc/30/67/81/221306781.db2.gz SSOZADBMOXFGOS-ZDUSSCGKSA-N 1 1 369.856 3.653 50 0 FHAAMO C[N@H+](Cc1ccc(Br)cc1)C[C@@H](O)COCc1cccs1 ZINC000068047598 221313129 /nfs/dbraw/zinc/31/31/29/221313129.db2.gz IDVJPODBTNEHMR-OAHLLOKOSA-N 1 1 370.312 3.520 50 0 FHAAMO CCc1[nH+]ccn1CCN1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000071682211 221353216 /nfs/dbraw/zinc/35/32/16/221353216.db2.gz MWLNNOPJQQAJIX-MRXNPFEDSA-N 1 1 354.281 3.826 50 0 FHAAMO CCc1ccc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)nc1 ZINC000071439489 221348929 /nfs/dbraw/zinc/34/89/29/221348929.db2.gz NPVDEHAZMOSGGR-NRFANRHFSA-N 1 1 351.494 3.657 50 0 FHAAMO Cc1ncnc(N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1C ZINC000071746158 221357954 /nfs/dbraw/zinc/35/79/54/221357954.db2.gz PZXYSXUCNOMUMA-FQEVSTJZSA-N 1 1 356.489 3.969 50 0 FHAAMO C[C@H]1CCC[N@H+]1Cc1c(C(=O)N(C)Cc2ccccc2)nc2ccccn21 ZINC000071745946 221358095 /nfs/dbraw/zinc/35/80/95/221358095.db2.gz RNOYQCLNFYGCEG-KRWDZBQOSA-N 1 1 362.477 3.591 50 0 FHAAMO c1cnn(-c2cccc([C@@H]3c4[nH]cnc4CC[N@@H+]3CCc3ccccc3)c2)c1 ZINC000071738868 221358290 /nfs/dbraw/zinc/35/82/90/221358290.db2.gz UOJWKUQQRSXTFJ-HSZRJFAPSA-N 1 1 369.472 3.786 50 0 FHAAMO Cn1ncc(C[N@@H+]2CCO[C@H](Cc3cccc4ccccc43)C2)c1C1CC1 ZINC000071748109 221359146 /nfs/dbraw/zinc/35/91/46/221359146.db2.gz GCJJMISDXIPZKU-OAQYLSRUSA-N 1 1 361.489 3.894 50 0 FHAAMO Cn1ncc(C[N@H+]2CCO[C@H](Cc3cccc4ccccc43)C2)c1C1CC1 ZINC000071748109 221359150 /nfs/dbraw/zinc/35/91/50/221359150.db2.gz GCJJMISDXIPZKU-OAQYLSRUSA-N 1 1 361.489 3.894 50 0 FHAAMO O=C(C[N@@H+]1CCC[C@@H](C(=O)c2ccc(-c3ccccc3)cc2)C1)NC1CC1 ZINC000071681717 221353826 /nfs/dbraw/zinc/35/38/26/221353826.db2.gz NAPWHLRMGCNNEC-HXUWFJFHSA-N 1 1 362.473 3.527 50 0 FHAAMO O=C(C[N@H+]1CCC[C@@H](C(=O)c2ccc(-c3ccccc3)cc2)C1)NC1CC1 ZINC000071681717 221353827 /nfs/dbraw/zinc/35/38/27/221353827.db2.gz NAPWHLRMGCNNEC-HXUWFJFHSA-N 1 1 362.473 3.527 50 0 FHAAMO Cc1ccncc1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071762362 221369259 /nfs/dbraw/zinc/36/92/59/221369259.db2.gz YIKFDEMZLXNATL-NRFANRHFSA-N 1 1 369.484 3.902 50 0 FHAAMO COCc1ncc(C[N@H+]2CCC[C@@H](CCc3ccc(F)cc3F)C2)cn1 ZINC000071767917 221373128 /nfs/dbraw/zinc/37/31/28/221373128.db2.gz YQRBECVXKZANDP-HNNXBMFYSA-N 1 1 361.436 3.746 50 0 FHAAMO Cc1ccc(CCNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)c(C)c1 ZINC000072039955 221398489 /nfs/dbraw/zinc/39/84/89/221398489.db2.gz FEIBEZSFLFYGOY-NRFANRHFSA-N 1 1 351.494 3.544 50 0 FHAAMO Cc1ccc(CCNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)c(C)c1 ZINC000072039955 221398491 /nfs/dbraw/zinc/39/84/91/221398491.db2.gz FEIBEZSFLFYGOY-NRFANRHFSA-N 1 1 351.494 3.544 50 0 FHAAMO c1cn(Cc2ccccc2)c([C@@H]2CCCN(c3[nH+]cnc4[nH]ccc43)C2)n1 ZINC000082170751 132198067 /nfs/dbraw/zinc/19/80/67/132198067.db2.gz VCZWRMPDEOVAIS-QGZVFWFLSA-N 1 1 358.449 3.587 50 0 FHAAMO c1cn(Cc2ccncc2)c([C@H]2CCCN(c3cnc4ccccc4n3)C2)[nH+]1 ZINC000091536355 132202006 /nfs/dbraw/zinc/20/20/06/132202006.db2.gz DDGWJOIEOZSUTL-SFHVURJKSA-N 1 1 370.460 3.654 50 0 FHAAMO COCCn1cc[nH+]c1C1CCN(c2cc(C(F)(F)F)cc(C)n2)CC1 ZINC000091624559 132202831 /nfs/dbraw/zinc/20/28/31/132202831.db2.gz ZTSPUJSJHDUICL-UHFFFAOYSA-N 1 1 368.403 3.636 50 0 FHAAMO Fc1cc(Cl)cnc1N1CCC[C@@H](c2[nH+]ccn2Cc2ccncc2)C1 ZINC000091998167 132205430 /nfs/dbraw/zinc/20/54/30/132205430.db2.gz SBWHYQNCTUYUPL-OAHLLOKOSA-N 1 1 371.847 3.898 50 0 FHAAMO FC(F)(F)c1ccc(N2CCC([N@H+]3CCOC4(CCCC4)C3)CC2)nc1 ZINC000095361751 132207747 /nfs/dbraw/zinc/20/77/47/132207747.db2.gz AJBPPAMTHOVYRB-UHFFFAOYSA-N 1 1 369.431 3.714 50 0 FHAAMO c1cn(Cc2ccccn2)c([C@@H]2CCCN(c3cnc4ccccc4n3)C2)[nH+]1 ZINC000095522750 132214394 /nfs/dbraw/zinc/21/43/94/132214394.db2.gz ZODOAOQPJPRVRZ-QGZVFWFLSA-N 1 1 370.460 3.654 50 0 FHAAMO COc1ccc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)c(OC)c1C ZINC000055543033 136126827 /nfs/dbraw/zinc/12/68/27/136126827.db2.gz NSFHSNPYOMABGI-UHFFFAOYSA-N 1 1 360.885 3.988 50 0 FHAAMO CCCn1ccnc1C[N@H+]1CCCC12CCN(c1cccc(C)n1)CC2 ZINC000072428393 136146701 /nfs/dbraw/zinc/14/67/01/136146701.db2.gz XJIHLRYNSGLMJW-UHFFFAOYSA-N 1 1 353.514 3.632 50 0 FHAAMO Cc1[nH]ccc1C(=O)N(C)C[C@H]1CCC[N@@H+](CCc2ccccc2C)C1 ZINC000095505011 221931139 /nfs/dbraw/zinc/93/11/39/221931139.db2.gz ACTCQIOPRBNMIN-LJQANCHMSA-N 1 1 353.510 3.658 50 0 FHAAMO COC(=O)c1ccc(C[NH+]2CCC(c3nnc(-c4ccsc4)o3)CC2)o1 ZINC000096024390 221993513 /nfs/dbraw/zinc/99/35/13/221993513.db2.gz COAGCXOEZWVRBG-UHFFFAOYSA-N 1 1 373.434 3.557 50 0 FHAAMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000096138975 222042294 /nfs/dbraw/zinc/04/22/94/222042294.db2.gz VSIOJWVOPRDYEE-KRWDZBQOSA-N 1 1 369.465 3.711 50 0 FHAAMO Cc1ccc(SCC[NH+]2CCN(Cc3cn4ccccc4n3)CC2)cc1 ZINC000096997512 222149755 /nfs/dbraw/zinc/14/97/55/222149755.db2.gz NREIWMCXQMCYKO-UHFFFAOYSA-N 1 1 366.534 3.553 50 0 FHAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)/C=C\c2ccc(Br)cc2)C1 ZINC000097107638 222159741 /nfs/dbraw/zinc/15/97/41/222159741.db2.gz RITDZBXDLUODDU-YYRKOSNBSA-N 1 1 365.315 3.701 50 0 FHAAMO Cc1nc(C[NH2+][C@@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)oc1C ZINC000097143571 222164437 /nfs/dbraw/zinc/16/44/37/222164437.db2.gz NBKBUMFPFJMGLA-JTQLQIEISA-N 1 1 355.360 3.817 50 0 FHAAMO COCc1ncc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccc(F)c(C)c2)C3)cn1 ZINC000102546439 222299524 /nfs/dbraw/zinc/29/95/24/222299524.db2.gz BCWBMUCJDHSHGB-REPLKXPHSA-N 1 1 355.457 3.981 50 0 FHAAMO Nc1ncccc1CN1CCC[C@@]2(CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000102839877 222310282 /nfs/dbraw/zinc/31/02/82/222310282.db2.gz OJYVEWKOWBRYIT-JOCHJYFZSA-N 1 1 350.510 3.542 50 0 FHAAMO CCOc1ccccc1CN1CC[N@@H+](Cc2ccc(C)s2)C[C@H]1CCO ZINC000104496583 222359943 /nfs/dbraw/zinc/35/99/43/222359943.db2.gz SNSPHNWERPDHCW-LJQANCHMSA-N 1 1 374.550 3.524 50 0 FHAAMO c1cc([C@H]2CCCCO2)oc1CN1CCC[N@@H+](Cc2ccncc2)CC1 ZINC000106265081 222385004 /nfs/dbraw/zinc/38/50/04/222385004.db2.gz RSUIKKWBJGHYCX-HXUWFJFHSA-N 1 1 355.482 3.624 50 0 FHAAMO c1cc([C@H]2CCCCO2)oc1C[N@H+]1CCCN(Cc2ccncc2)CC1 ZINC000106265081 222385007 /nfs/dbraw/zinc/38/50/07/222385007.db2.gz RSUIKKWBJGHYCX-HXUWFJFHSA-N 1 1 355.482 3.624 50 0 FHAAMO c1cc([C@H]2CCCCO2)oc1C[N@@H+]1CCCN(Cc2ccncc2)CC1 ZINC000106265081 222385010 /nfs/dbraw/zinc/38/50/10/222385010.db2.gz RSUIKKWBJGHYCX-HXUWFJFHSA-N 1 1 355.482 3.624 50 0 FHAAMO CN(C[C@@H]1CCCC[N@H+]1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000426471050 263597154 /nfs/dbraw/zinc/59/71/54/263597154.db2.gz TVJWTWQHEJMZRT-FQEVSTJZSA-N 1 1 351.494 3.902 50 0 FHAAMO Cc1ccc(C[N@@H+]2CCOc3ccc([C@H](O)c4ccncc4)cc3C2)s1 ZINC000299762874 533938239 /nfs/dbraw/zinc/93/82/39/533938239.db2.gz CTJCBSKNVSEYDA-OAQYLSRUSA-N 1 1 366.486 3.928 50 0 FHAAMO Cc1ccc(C[N@H+]2CCOc3ccc([C@H](O)c4ccncc4)cc3C2)s1 ZINC000299762874 533938249 /nfs/dbraw/zinc/93/82/49/533938249.db2.gz CTJCBSKNVSEYDA-OAQYLSRUSA-N 1 1 366.486 3.928 50 0 FHAAMO Cc1noc(C[NH+]2CCC(c3cc(-c4ccccc4Cl)n[nH]3)CC2)n1 ZINC000299769059 534406629 /nfs/dbraw/zinc/40/66/29/534406629.db2.gz MFPOUBUZYKXXCQ-UHFFFAOYSA-N 1 1 357.845 3.801 50 0 FHAAMO CC(=O)OC1CC[NH+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 ZINC000153583166 519754854 /nfs/dbraw/zinc/75/48/54/519754854.db2.gz NZRDWEDHDWTTKM-FQEVSTJZSA-N 1 1 370.424 3.533 50 0 FHAAMO CC(C)c1[nH+]ccn1[C@@H](C)C(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000091587207 519880768 /nfs/dbraw/zinc/88/07/68/519880768.db2.gz WPHJCLPDMYGGRF-HNNXBMFYSA-N 1 1 360.889 3.570 50 0 FHAAMO CCCCc1ncc(C[N@H+]2CC[C@@]3(C2)CCCN(C2CCCCC2)C3=O)[nH]1 ZINC000091645266 521297271 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O=C(c1ccc(F)cc1F)c1ccccc1C[NH+]1CCC2(CC1)OCCO2 ZINC000085651612 571233857 /nfs/dbraw/zinc/23/38/57/571233857.db2.gz KPLFFBJGUPGXQY-UHFFFAOYSA-N 1 1 373.399 3.535 50 0 FHAAMO C[N@@H+](CCO)C1CCN(C(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000426648149 571234182 /nfs/dbraw/zinc/23/41/82/571234182.db2.gz PNYBVQXPHWKXAQ-UHFFFAOYSA-N 1 1 372.896 3.536 50 0 FHAAMO CC(=O)c1ccc(-c2cccc(C(=O)NCCCn3cc[nH+]c3C)c2)s1 ZINC000426651348 571234224 /nfs/dbraw/zinc/23/42/24/571234224.db2.gz OALXUQALYOFXQH-UHFFFAOYSA-N 1 1 367.474 3.943 50 0 FHAAMO O=C(NCCC[N@@H+]1CCC[C@@H](O)C1)c1ccc(-c2ccccc2Cl)cc1 ZINC000426678208 571234823 /nfs/dbraw/zinc/23/48/23/571234823.db2.gz WGYYAADUAIOMSX-GOSISDBHSA-N 1 1 372.896 3.584 50 0 FHAAMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(-c3ccc(O)c(F)c3)cc2)C1 ZINC000426701810 571235839 /nfs/dbraw/zinc/23/58/39/571235839.db2.gz ZMTVGTRTSCEKLQ-OAHLLOKOSA-N 1 1 356.441 3.660 50 0 FHAAMO CC1(C)C[N@H+](C2CCN(C(=O)c3ccncc3)CC2)C[C@H]1c1ccccc1 ZINC000426740662 571236904 /nfs/dbraw/zinc/23/69/04/571236904.db2.gz XRWITJGAJPWDBP-NRFANRHFSA-N 1 1 363.505 3.812 50 0 FHAAMO O=C(c1ccccc1-c1ccccc1)N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000091321324 571239055 /nfs/dbraw/zinc/23/90/55/571239055.db2.gz GNLFYWHNCYLNHR-HXUWFJFHSA-N 1 1 364.489 3.681 50 0 FHAAMO Cc1noc(C)c1C[N@H+]1C[C@@H]2CC[C@H](C1)N(C(=O)c1cc(C)ccc1C)C2 ZINC000091410079 571239287 /nfs/dbraw/zinc/23/92/87/571239287.db2.gz WJDRRXDXMBHHNF-RBUKOAKNSA-N 1 1 367.493 3.645 50 0 FHAAMO O=C1CCC2(CC[NH+](C3CCCCCCC3)CC2)CN1CCc1cnc[nH]1 ZINC000091410917 571239397 /nfs/dbraw/zinc/23/93/97/571239397.db2.gz SAQBRJUSZAGEON-UHFFFAOYSA-N 1 1 372.557 3.770 50 0 FHAAMO Cc1c2ccc(C)cc2oc1C(=O)N1CC[NH+](C2Cc3ccccc3C2)CC1 ZINC000091416406 571239446 /nfs/dbraw/zinc/23/94/46/571239446.db2.gz FKMILUAPCYGHAJ-UHFFFAOYSA-N 1 1 374.484 3.975 50 0 FHAAMO C[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1ccc2cccc(F)c2n1 ZINC000091440129 571239690 /nfs/dbraw/zinc/23/96/90/571239690.db2.gz KDDANNPUXNUQDJ-OAHLLOKOSA-N 1 1 363.436 3.551 50 0 FHAAMO COc1ccc(OC[C@@H](O)C[N@H+](Cc2ccc(C)cc2)CC(C)C)cc1 ZINC000036094936 571240877 /nfs/dbraw/zinc/24/08/77/571240877.db2.gz WEBFOJRMUWILMQ-FQEVSTJZSA-N 1 1 357.494 3.902 50 0 FHAAMO Cc1c(C(=O)N2CC([N@@H+]3CCCC[C@H]3C)C2)[nH]nc1-c1ccc(Cl)cc1 ZINC000091594358 571240988 /nfs/dbraw/zinc/24/09/88/571240988.db2.gz ONSWAHBUYSUHHA-CYBMUJFWSA-N 1 1 372.900 3.737 50 0 FHAAMO Cc1c(C(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)n[nH]c1-c1ccc(Cl)cc1 ZINC000091594358 571240994 /nfs/dbraw/zinc/24/09/94/571240994.db2.gz ONSWAHBUYSUHHA-CYBMUJFWSA-N 1 1 372.900 3.737 50 0 FHAAMO Cc1c(C(=O)N2CC([N@@H+]3CCCC[C@H]3C)C2)n[nH]c1-c1ccc(Cl)cc1 ZINC000091594358 571240997 /nfs/dbraw/zinc/24/09/97/571240997.db2.gz ONSWAHBUYSUHHA-CYBMUJFWSA-N 1 1 372.900 3.737 50 0 FHAAMO Cc1nc[nH]c1CN1C[C@H]2CC[C@H](C[N@@H+]2Cc2cc3ccccc3o2)C1 ZINC000091620269 571241314 /nfs/dbraw/zinc/24/13/14/571241314.db2.gz KSEHDSAERJRSMH-FUHWJXTLSA-N 1 1 350.466 3.561 50 0 FHAAMO CCn1nc(C)c(CN2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)c1C ZINC000091625022 571241477 /nfs/dbraw/zinc/24/14/77/571241477.db2.gz NMSVNXKHIZVALH-LEWJYISDSA-N 1 1 352.526 3.616 50 0 FHAAMO Cc1ccccc1C[N@@H+](C[C@H](O)COc1ccccc1C)C[C@H]1CCCO1 ZINC000036100022 571241525 /nfs/dbraw/zinc/24/15/25/571241525.db2.gz LPBYLAZOYHYLRD-FCHUYYIVSA-N 1 1 369.505 3.724 50 0 FHAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3cccnc3)CC2)C1 ZINC000091657318 571242060 /nfs/dbraw/zinc/24/20/60/571242060.db2.gz ALKDNTYOIKBSIQ-NRFANRHFSA-N 1 1 363.505 3.813 50 0 FHAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1 ZINC000036104290 571242130 /nfs/dbraw/zinc/24/21/30/571242130.db2.gz RIKBEOTWXGZKDY-NRFANRHFSA-N 1 1 369.436 3.999 50 0 FHAAMO CCCC(=O)OC[C@H](O)C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1C ZINC000036104701 571242483 /nfs/dbraw/zinc/24/24/83/571242483.db2.gz CMURVQSETCQOTQ-OAQYLSRUSA-N 1 1 373.468 3.841 50 0 FHAAMO CC(C)n1ccnc1C1CCN(C(=O)[C@@H](c2ccc(F)cc2)[NH+](C)C)CC1 ZINC000091746234 571243367 /nfs/dbraw/zinc/24/33/67/571243367.db2.gz NAWYQNCDHSXPNL-LJQANCHMSA-N 1 1 372.488 3.612 50 0 FHAAMO C[NH+](C)[C@H](CNC(=O)CCC(=O)c1ccc(Cl)s1)c1cccs1 ZINC000006787835 571246556 /nfs/dbraw/zinc/24/65/56/571246556.db2.gz LJMAOACKOJBBCA-LLVKDONJSA-N 1 1 370.927 3.845 50 0 FHAAMO COc1ccc(CC(=O)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)cc1 ZINC000036392048 571252672 /nfs/dbraw/zinc/25/26/72/571252672.db2.gz DTHQFMFYRQLPBV-GOSISDBHSA-N 1 1 366.505 3.929 50 0 FHAAMO CCCc1ccc(C(=O)NCCC[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000036699967 571261237 /nfs/dbraw/zinc/26/12/37/571261237.db2.gz FBZKRZYXQGRYDQ-QFIPXVFZSA-N 1 1 366.505 3.833 50 0 FHAAMO CCCc1ccc(C(=O)NCCC[N@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000036699967 571261239 /nfs/dbraw/zinc/26/12/39/571261239.db2.gz FBZKRZYXQGRYDQ-QFIPXVFZSA-N 1 1 366.505 3.833 50 0 FHAAMO COc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCOc1ccc(Cl)cc1 ZINC000007267494 571263771 /nfs/dbraw/zinc/26/37/71/571263771.db2.gz WVNQJCQEWBMWMM-AWEZNQCLSA-N 1 1 362.857 3.686 50 0 FHAAMO COc1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000007267494 571263772 /nfs/dbraw/zinc/26/37/72/571263772.db2.gz WVNQJCQEWBMWMM-AWEZNQCLSA-N 1 1 362.857 3.686 50 0 FHAAMO CC(C)[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(=O)OC(C)(C)C ZINC000170592268 571266209 /nfs/dbraw/zinc/26/62/09/571266209.db2.gz CYYSYESDHIKTRQ-IHPCNDPISA-N 1 1 360.542 3.995 50 0 FHAAMO O=C1NC2(CCCCCC2)C(=O)N1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000089830373 571273563 /nfs/dbraw/zinc/27/35/63/571273563.db2.gz FKPKTEXQKIDXBM-UHFFFAOYSA-N 1 1 369.509 3.543 50 0 FHAAMO CC[C@H]1C[N@@H+](CC(C)(C)O)[C@@H](CC)CN1CCSc1ccccc1 ZINC000252549762 571283455 /nfs/dbraw/zinc/28/34/55/571283455.db2.gz RUYPNIUJCUDEDR-ROUUACIJSA-N 1 1 350.572 3.724 50 0 FHAAMO CC[C@H]1C[N@H+](CCSc2ccccc2)[C@@H](CC)CN1CC(C)(C)O ZINC000252549762 571283457 /nfs/dbraw/zinc/28/34/57/571283457.db2.gz RUYPNIUJCUDEDR-ROUUACIJSA-N 1 1 350.572 3.724 50 0 FHAAMO CC[C@H]1C[N@@H+](CCSc2ccccc2)[C@@H](CC)CN1CC(C)(C)O ZINC000252549762 571283458 /nfs/dbraw/zinc/28/34/58/571283458.db2.gz RUYPNIUJCUDEDR-ROUUACIJSA-N 1 1 350.572 3.724 50 0 FHAAMO O=C(C[N@@H+]1CCc2sccc2[C@@H]1C1CC1)NC(=O)Nc1ccccc1F ZINC000007880280 571290471 /nfs/dbraw/zinc/29/04/71/571290471.db2.gz GIACPFSETJXHIY-SFHVURJKSA-N 1 1 373.453 3.545 50 0 FHAAMO O=C(C[N@H+]1CCc2sccc2[C@@H]1C1CC1)NC(=O)Nc1ccccc1F ZINC000007880280 571290472 /nfs/dbraw/zinc/29/04/72/571290472.db2.gz GIACPFSETJXHIY-SFHVURJKSA-N 1 1 373.453 3.545 50 0 FHAAMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2nc(Cc3ccccc3)no2)C1 ZINC000252678287 571292518 /nfs/dbraw/zinc/29/25/18/571292518.db2.gz DCVHEURVXSDGDC-ICSRJNTNSA-N 1 1 368.525 3.747 50 0 FHAAMO O=C(C[NH+]1CCCC1)N1N=C(c2cccc(Cl)c2)C[C@H]1c1ccco1 ZINC000253392736 571311859 /nfs/dbraw/zinc/31/18/59/571311859.db2.gz ZRDKQGBFSMDDKL-KRWDZBQOSA-N 1 1 357.841 3.707 50 0 FHAAMO CN(Cc1cccc2cnccc21)C(=O)NC[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000584899348 571315950 /nfs/dbraw/zinc/31/59/50/571315950.db2.gz GWXMQXVMUQZQET-KRWDZBQOSA-N 1 1 366.509 3.641 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 ZINC000007960765 571325880 /nfs/dbraw/zinc/32/58/80/571325880.db2.gz KGASUGDVMKMWAM-MRXNPFEDSA-N 1 1 368.506 3.610 50 0 FHAAMO Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[N@@H+]1C[C@@H](CO)CC[C@@H]1C ZINC000093738016 571327190 /nfs/dbraw/zinc/32/71/90/571327190.db2.gz SMNCJFKVMSDQAT-KSSFIOAISA-N 1 1 361.917 3.794 50 0 FHAAMO c1ccc(C[N@H+]2CCCN(c3nc(-c4ccccc4)ns3)CC2)cc1 ZINC000095401989 571329361 /nfs/dbraw/zinc/32/93/61/571329361.db2.gz MCZCHGFEFABWJG-UHFFFAOYSA-N 1 1 350.491 3.917 50 0 FHAAMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2csc(Br)c2)c1 ZINC000095434655 571329587 /nfs/dbraw/zinc/32/95/87/571329587.db2.gz ORENVVYYVWAMMX-UHFFFAOYSA-N 1 1 363.240 3.652 50 0 FHAAMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000095446834 571329735 /nfs/dbraw/zinc/32/97/35/571329735.db2.gz WMXQXXQBETZRGI-OAHLLOKOSA-N 1 1 366.387 3.821 50 0 FHAAMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000095446834 571329736 /nfs/dbraw/zinc/32/97/36/571329736.db2.gz WMXQXXQBETZRGI-OAHLLOKOSA-N 1 1 366.387 3.821 50 0 FHAAMO CCC[C@H]1CN(C(=O)c2ccc(Cl)nc2)CC[N@H+]1Cc1ccccc1 ZINC000095463176 571330337 /nfs/dbraw/zinc/33/03/37/571330337.db2.gz FVRXMESLSUEWDB-SFHVURJKSA-N 1 1 357.885 3.862 50 0 FHAAMO COc1ccc2cc(C(=O)N(C)C[C@H]3CCC[N@H+]4CCCC[C@H]34)n(C)c2c1 ZINC000299754410 571338463 /nfs/dbraw/zinc/33/84/63/571338463.db2.gz KNAYXGKHAXKSAB-IEBWSBKVSA-N 1 1 369.509 3.523 50 0 FHAAMO C[C@@H]([NH2+]CC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccccc1Cl ZINC000057336076 571342600 /nfs/dbraw/zinc/34/26/00/571342600.db2.gz DOADEUGJMCVIFW-CYBMUJFWSA-N 1 1 371.868 3.522 50 0 FHAAMO Cc1ccc(NC(=S)N2CCC([N@@H+](C)C[C@@H]3CCCO3)CC2)cc1C ZINC000003058251 571344406 /nfs/dbraw/zinc/34/44/06/571344406.db2.gz ZRGBARZITUOYIE-IBGZPJMESA-N 1 1 361.555 3.575 50 0 FHAAMO O=c1cc(C[NH+](Cc2ccccc2)Cc2ccccc2)nc2sccn21 ZINC000003251700 571346108 /nfs/dbraw/zinc/34/61/08/571346108.db2.gz XVTVRLSHMIOTKD-UHFFFAOYSA-N 1 1 361.470 3.958 50 0 FHAAMO C[NH+](C)C[C@@H](NS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000030499418 571346159 /nfs/dbraw/zinc/34/61/59/571346159.db2.gz SXUARMCGBUAINX-LJQANCHMSA-N 1 1 360.523 3.565 50 0 FHAAMO CCOC(=O)C1CC[NH+](Cc2cc(=O)oc3cc(C)c(Cl)cc23)CC1 ZINC000003350975 571348184 /nfs/dbraw/zinc/34/81/84/571348184.db2.gz WTSGVAHYBUZSKF-UHFFFAOYSA-N 1 1 363.841 3.530 50 0 FHAAMO Cc1ccc(C[N@H+]2CCCN(C(=O)NCc3ccc(F)cc3)CC2)cc1 ZINC000031029613 571350399 /nfs/dbraw/zinc/35/03/99/571350399.db2.gz REWKZCAHKRGJIS-UHFFFAOYSA-N 1 1 355.457 3.552 50 0 FHAAMO CCC[N@H+]1CCC[C@H](NC(=O)c2ccc(N3Cc4ccccc4C3)cc2)C1 ZINC000670453424 571353000 /nfs/dbraw/zinc/35/30/00/571353000.db2.gz BSEJEJCGJIVHSZ-NRFANRHFSA-N 1 1 363.505 3.811 50 0 FHAAMO C[N@@H+]1CCC[C@H]1c1cccnc1-n1c(=O)c2ccccc2nc1-c1ccco1 ZINC000003999640 571353774 /nfs/dbraw/zinc/35/37/74/571353774.db2.gz MTFLAKCMCKZOCI-SFHVURJKSA-N 1 1 372.428 3.807 50 0 biogenic FHAAMO C[N@H+]1CCC[C@H]1c1cccnc1-n1c(=O)c2ccccc2nc1-c1ccco1 ZINC000003999640 571353775 /nfs/dbraw/zinc/35/37/75/571353775.db2.gz MTFLAKCMCKZOCI-SFHVURJKSA-N 1 1 372.428 3.807 50 0 biogenic FHAAMO COc1cccc(/C=C/C(=O)OC[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1OC ZINC000004028966 571354261 /nfs/dbraw/zinc/35/42/61/571354261.db2.gz AMTPWEOSAFWDMM-AAIOHFERSA-N 1 1 359.466 3.525 50 0 biogenic FHAAMO COCc1cc(CN2CCC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ccc1OC ZINC000022852897 934995931 /nfs/dbraw/zinc/99/59/31/934995931.db2.gz JQJVJTOIBSYOBB-JOCHJYFZSA-N 1 1 368.521 3.938 50 0 FHAAMO OCc1ccc(C[N@H+]2CCC[C@H](c3n[nH]cc3-c3cccc(F)c3)C2)o1 ZINC000023478828 935630368 /nfs/dbraw/zinc/63/03/68/935630368.db2.gz WDJLWZMAGWSJFR-HNNXBMFYSA-N 1 1 355.413 3.681 50 0 FHAAMO COc1cccc(-c2nc(C[N@H+]3CCC[C@H]3C(C)(C)O)cs2)c1OC ZINC000136251688 942019324 /nfs/dbraw/zinc/01/93/24/942019324.db2.gz XYWCLUSHEINZOS-INIZCTEOSA-N 1 1 362.495 3.563 50 0 FHAAMO Cc1c(C[N@H+]2CC3(C[C@H]2COc2ccncc2)CCCCC3)cnn1C ZINC000257191924 942654288 /nfs/dbraw/zinc/65/42/88/942654288.db2.gz RTOLAVFGBWABSO-IBGZPJMESA-N 1 1 354.498 3.727 50 0 FHAAMO Cc1c2ccccc2oc1C(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190612600 944056778 /nfs/dbraw/zinc/05/67/78/944056778.db2.gz WBPKSKRERICXDK-SFHVURJKSA-N 1 1 363.461 3.730 50 0 FHAAMO CCc1ccc(C[N@H+]2CC[C@]3(OC)CC[C@@H](Oc4ccccn4)C[C@H]23)nc1 ZINC000426505924 945011899 /nfs/dbraw/zinc/01/18/99/945011899.db2.gz VMZAWDIUCREIQS-RZUBCFFCSA-N 1 1 367.493 3.630 50 0 FHAAMO CC(C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(N2CCCCC2=O)CC1 ZINC000120367769 945462838 /nfs/dbraw/zinc/46/28/38/945462838.db2.gz JOHHHUWNOWPZLA-QGZVFWFLSA-N 1 1 371.525 3.614 50 0 FHAAMO CCc1nc(C)sc1C(=O)NCC[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000299759818 529730471 /nfs/dbraw/zinc/73/04/71/529730471.db2.gz NNQUHYZAYZCRRL-MRXNPFEDSA-N 1 1 357.523 3.542 50 0 FHAAMO CCc1[nH+]ccn1CCCNC(=O)c1sc(C)nc1-c1ccccc1 ZINC000257173306 529759620 /nfs/dbraw/zinc/75/96/20/529759620.db2.gz JFJASRVFENNTRI-UHFFFAOYSA-N 1 1 354.479 3.698 50 0 FHAAMO COc1ccc(C[NH+]2CCC(Oc3cccnc3)CC2)c(Cl)c1OC ZINC000215657408 222650627 /nfs/dbraw/zinc/65/06/27/222650627.db2.gz XYRSHDPYEJOIRC-UHFFFAOYSA-N 1 1 362.857 3.796 50 0 FHAAMO COc1ccc(C[N@@H+]2CCc3cc(OC)c(OC)cc3C2)c(OC)c1C ZINC000001227704 219391557 /nfs/dbraw/zinc/39/15/57/219391557.db2.gz ILJTXKNIYLUOKP-UHFFFAOYSA-N 1 1 357.450 3.588 50 0 biogenic FHAAMO COc1ccc(C[N@H+]2CCc3cc(OC)c(OC)cc3C2)c(OC)c1C ZINC000001227704 219391560 /nfs/dbraw/zinc/39/15/60/219391560.db2.gz ILJTXKNIYLUOKP-UHFFFAOYSA-N 1 1 357.450 3.588 50 0 biogenic FHAAMO CC(C)n1cc[nH+]c1C1CCN(Cc2nc3ccsc3c(=O)[nH]2)CC1 ZINC000253537238 222994479 /nfs/dbraw/zinc/99/44/79/222994479.db2.gz GPWGXPFVNIIQGW-UHFFFAOYSA-N 1 1 357.483 3.554 50 0 FHAAMO O=C(NCc1c(F)cccc1F)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299772944 223088909 /nfs/dbraw/zinc/08/89/09/223088909.db2.gz BJMBFUSPCDSJMU-BEVDRBHNSA-N 1 1 356.416 3.807 50 0 FHAAMO CCn1cncc1CNC(=O)Nc1cccc(C[N@H+]2CCCC[C@H]2C)c1 ZINC000299787207 223096250 /nfs/dbraw/zinc/09/62/50/223096250.db2.gz SBYNOWAYUGEQLD-MRXNPFEDSA-N 1 1 355.486 3.599 50 0 FHAAMO Cc1ccc2nc(C(=O)N3CCC[C@@H]3c3ccc(C[NH+](C)C)cc3)[nH]c2c1 ZINC000299801141 223104648 /nfs/dbraw/zinc/10/46/48/223104648.db2.gz UZVRFQRTHQXHMK-HXUWFJFHSA-N 1 1 362.477 3.910 50 0 FHAAMO O=C(Nc1cccc(-c2cc[nH]n2)c1)N1CCC[N@H+](C2CCCCC2)CC1 ZINC000299791160 223098704 /nfs/dbraw/zinc/09/87/04/223098704.db2.gz CKJHPYYFLIKIDF-UHFFFAOYSA-N 1 1 367.497 3.949 50 0 FHAAMO CC(C)(C)CN1CCC[C@]2(CC[N@@H+](Cc3ccc(-c4cc[nH]n4)o3)C2)C1=O ZINC000012306116 219977871 /nfs/dbraw/zinc/97/78/71/219977871.db2.gz SFMQFHNCSYCRDI-OAQYLSRUSA-N 1 1 370.497 3.530 50 0 FHAAMO OC[C@]1(Cc2cccc(Cl)c2)CCC[N@H+](C2CSCCSC2)C1 ZINC000012715124 220020719 /nfs/dbraw/zinc/02/07/19/220020719.db2.gz QQAKFDGHUFXYDK-SFHVURJKSA-N 1 1 371.999 3.806 50 0 FHAAMO COc1ccc(C(=O)N2CCC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1F ZINC000012713082 220021093 /nfs/dbraw/zinc/02/10/93/220021093.db2.gz IZRVLKZXZWPIRH-SFHVURJKSA-N 1 1 356.441 3.571 50 0 FHAAMO COc1cccc(C(=O)[C@H]2CCC[N@H+](Cc3cc(OC)ccc3OC)C2)c1 ZINC000012704259 220018014 /nfs/dbraw/zinc/01/80/14/220018014.db2.gz MTAUFLPPZMGAAG-KRWDZBQOSA-N 1 1 369.461 3.807 50 0 FHAAMO CN(C(=O)CCC(F)(F)F)[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000012707238 220019699 /nfs/dbraw/zinc/01/96/99/220019699.db2.gz DCNPCQKWWMKOJC-QGZVFWFLSA-N 1 1 356.432 3.885 50 0 FHAAMO CCOC(=O)c1cc(C(C)C)sc1NC(=O)C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000012765159 220027028 /nfs/dbraw/zinc/02/70/28/220027028.db2.gz LDKPHILEGVYYTH-ZIAGYGMSSA-N 1 1 366.527 3.965 50 0 FHAAMO Cc1ccc(C[N@H+](CCc2ccccc2)CC(=O)Nc2ccon2)s1 ZINC000012751791 220025056 /nfs/dbraw/zinc/02/50/56/220025056.db2.gz LTTHKIPWBGQWHB-UHFFFAOYSA-N 1 1 355.463 3.728 50 0 FHAAMO Cc1ccc(C[N@@H+](CCc2ccccc2)CC(=O)Nc2ccon2)s1 ZINC000012751791 220025060 /nfs/dbraw/zinc/02/50/60/220025060.db2.gz LTTHKIPWBGQWHB-UHFFFAOYSA-N 1 1 355.463 3.728 50 0 FHAAMO C[C@@H](Nc1ccc(C(=O)N2CCC[N@H+](C3CCCCC3)CC2)cn1)C1CC1 ZINC000012760140 220025523 /nfs/dbraw/zinc/02/55/23/220025523.db2.gz UGTPMFUEBXAPQY-QGZVFWFLSA-N 1 1 370.541 3.773 50 0 FHAAMO C[C@H](Nc1ccc(C(=O)N2CCC[N@H+](C3CCCCC3)CC2)cn1)C1CC1 ZINC000012760145 220026142 /nfs/dbraw/zinc/02/61/42/220026142.db2.gz UGTPMFUEBXAPQY-KRWDZBQOSA-N 1 1 370.541 3.773 50 0 FHAAMO Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1 ZINC000012781764 220029380 /nfs/dbraw/zinc/02/93/80/220029380.db2.gz GVXYZJRGROXQAZ-ZWKOTPCHSA-N 1 1 365.477 3.673 50 0 FHAAMO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cn1c2ccccc2nc1CO ZINC000013062729 220056090 /nfs/dbraw/zinc/05/60/90/220056090.db2.gz HDLIOHGJTYPSLC-UHFFFAOYSA-N 1 1 350.249 3.925 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](Cc3cnc(C)s3)C2)c(OC)c1 ZINC000013593216 220077122 /nfs/dbraw/zinc/07/71/22/220077122.db2.gz KKAUBQHNMGOBNA-CQSZACIVSA-N 1 1 360.479 3.564 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cnc(C)s3)C2)c(OC)c1 ZINC000013593216 220077125 /nfs/dbraw/zinc/07/71/25/220077125.db2.gz KKAUBQHNMGOBNA-CQSZACIVSA-N 1 1 360.479 3.564 50 0 FHAAMO O=C(CCc1nc2ccccc2s1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000014085470 220105615 /nfs/dbraw/zinc/10/56/15/220105615.db2.gz RYCAPUIZQNMDFN-QGZVFWFLSA-N 1 1 365.502 3.620 50 0 FHAAMO COc1ccc([C@@H]([NH2+]CC(=O)N2CCCCCC2)c2ccccc2)cc1 ZINC000014199762 220115996 /nfs/dbraw/zinc/11/59/96/220115996.db2.gz CKODHZHGHBWODC-QFIPXVFZSA-N 1 1 352.478 3.777 50 0 FHAAMO CCC[C@@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1 ZINC000014230269 220118876 /nfs/dbraw/zinc/11/88/76/220118876.db2.gz UACSEOSCAUJUBO-JOCHJYFZSA-N 1 1 366.505 3.719 50 0 FHAAMO CC(C)CNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@@H+](CC(C)C)C1 ZINC000014540610 220125825 /nfs/dbraw/zinc/12/58/25/220125825.db2.gz RFNNUDDPCRGARU-ZWKOTPCHSA-N 1 1 364.505 3.571 50 0 FHAAMO O=C(c1cccc(Cl)c1)[C@@H]1CCC[N@H+](Cc2cccc(OCCO)c2)C1 ZINC000014977226 220138570 /nfs/dbraw/zinc/13/85/70/220138570.db2.gz RVEHPAYRAHBUDY-GOSISDBHSA-N 1 1 373.880 3.806 50 0 FHAAMO O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]12CC[N@@H+](CC1CCCC1)C2 ZINC000014980767 220139135 /nfs/dbraw/zinc/13/91/35/220139135.db2.gz KJGQNVJNBHDEIC-OAQYLSRUSA-N 1 1 362.464 3.970 50 0 FHAAMO CCCn1c(Cn2cc[nH+]c2C)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000015669145 220158303 /nfs/dbraw/zinc/15/83/03/220158303.db2.gz CWRYEEHDYYKFJK-UHFFFAOYSA-N 1 1 363.421 3.845 50 0 FHAAMO CCCC[N@@H+](CC)CCNc1nc(C)nc2oc(C)c(C(=O)OCC)c21 ZINC000015727402 220161507 /nfs/dbraw/zinc/16/15/07/220161507.db2.gz GRXSBDAEHQEGBQ-UHFFFAOYSA-N 1 1 362.474 3.550 50 0 FHAAMO CCOC(=O)c1c(C)oc2nc(C)nc(NCCC[N@H+]3CCCC[C@@H]3C)c21 ZINC000015727457 220161655 /nfs/dbraw/zinc/16/16/55/220161655.db2.gz CZKMMOBJTCKNRP-ZDUSSCGKSA-N 1 1 374.485 3.693 50 0 FHAAMO CCOC(=O)c1c(C)oc2ncnc(NCCC[N@H+]3CCCC[C@@H]3CC)c21 ZINC000015727189 220161690 /nfs/dbraw/zinc/16/16/90/220161690.db2.gz UYPINSMGJIBCNQ-HNNXBMFYSA-N 1 1 374.485 3.774 50 0 FHAAMO CC(C)[N@@H+](CCCNC(=O)N[C@@H]1COc2ccccc2C1)C1CCCCC1 ZINC000015787324 220165694 /nfs/dbraw/zinc/16/56/94/220165694.db2.gz XEPDFGXUUMLJDB-IBGZPJMESA-N 1 1 373.541 3.723 50 0 FHAAMO Cc1ccc([C@@H](CNC(=O)COc2cc(C)c(Cl)c(C)c2)[NH+](C)C)o1 ZINC000015860133 220169172 /nfs/dbraw/zinc/16/91/72/220169172.db2.gz XIQPZMBCMTWVRS-MRXNPFEDSA-N 1 1 364.873 3.656 50 0 FHAAMO C[C@@H]1C[N@@H+](CCOCCOc2cccc(Oc3ccccc3)c2)C[C@H](C)O1 ZINC000016247630 220180759 /nfs/dbraw/zinc/18/07/59/220180759.db2.gz CABUERIBDOQBGP-KDURUIRLSA-N 1 1 371.477 3.984 50 0 FHAAMO C[C@@H]1C[N@H+](CCOCCOc2cccc(Oc3ccccc3)c2)C[C@H](C)O1 ZINC000016247630 220180765 /nfs/dbraw/zinc/18/07/65/220180765.db2.gz CABUERIBDOQBGP-KDURUIRLSA-N 1 1 371.477 3.984 50 0 FHAAMO OC[C@H]1CCC[N@@H+](Cc2cc(F)cc3c2O[C@H](c2ccsc2)OC3)C1 ZINC000016046982 220176118 /nfs/dbraw/zinc/17/61/18/220176118.db2.gz NPQVTGVRQDCXKS-ORAYPTAESA-N 1 1 363.454 3.699 50 0 FHAAMO C[N@@H+](CC(=O)Nc1ccc2c(c1)OCCCO2)[C@H]1CCCc2ccccc21 ZINC000016342730 220182899 /nfs/dbraw/zinc/18/28/99/220182899.db2.gz ZXEAYQDTBIIKTN-IBGZPJMESA-N 1 1 366.461 3.796 50 0 FHAAMO C[C@@H]([NH2+]Cc1nc2ccccc2c(=O)[nH]1)c1ccc(Br)cc1 ZINC000016685056 220190675 /nfs/dbraw/zinc/19/06/75/220190675.db2.gz OFVSLBJYEFICBJ-LLVKDONJSA-N 1 1 358.239 3.536 50 0 FHAAMO C[N@@H+](CC(=O)NCCSc1ccccc1)[C@@H]1CCCc2ccccc21 ZINC000016694376 220190803 /nfs/dbraw/zinc/19/08/03/220190803.db2.gz MEWHCRUJVVKIFH-HXUWFJFHSA-N 1 1 354.519 3.904 50 0 FHAAMO C[N@@H+](CC(=O)NCCSc1ccccc1)[C@H]1CCCc2ccccc21 ZINC000016694379 220191495 /nfs/dbraw/zinc/19/14/95/220191495.db2.gz MEWHCRUJVVKIFH-FQEVSTJZSA-N 1 1 354.519 3.904 50 0 FHAAMO Cc1ccc(C)c(NC(=O)C[N@@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)c1 ZINC000017305824 220213702 /nfs/dbraw/zinc/21/37/02/220213702.db2.gz GVOXPHBUVGZDKA-QGZVFWFLSA-N 1 1 363.465 3.516 50 0 FHAAMO Cc1ccc(C)c(NC(=O)C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)c1 ZINC000017305824 220213706 /nfs/dbraw/zinc/21/37/06/220213706.db2.gz GVOXPHBUVGZDKA-QGZVFWFLSA-N 1 1 363.465 3.516 50 0 FHAAMO CC(C)C[N@H+]1CCN(CC(c2ccccc2)c2ccccc2)C[C@@H]1CCO ZINC000019220845 220240684 /nfs/dbraw/zinc/24/06/84/220240684.db2.gz NOSDIDBCQSZZSG-QHCPKHFHSA-N 1 1 366.549 3.843 50 0 FHAAMO CC(C)CN1CC[N@H+](CC(c2ccccc2)c2ccccc2)C[C@@H]1CCO ZINC000019220845 220240688 /nfs/dbraw/zinc/24/06/88/220240688.db2.gz NOSDIDBCQSZZSG-QHCPKHFHSA-N 1 1 366.549 3.843 50 0 FHAAMO CC(C)CN1CC[N@@H+](CC(c2ccccc2)c2ccccc2)C[C@@H]1CCO ZINC000019220845 220240691 /nfs/dbraw/zinc/24/06/91/220240691.db2.gz NOSDIDBCQSZZSG-QHCPKHFHSA-N 1 1 366.549 3.843 50 0 FHAAMO c1ccc(COc2cccc(C[N@H+]3CCC[C@@H](N4CCOCC4)C3)c2)cc1 ZINC000019228064 220241299 /nfs/dbraw/zinc/24/12/99/220241299.db2.gz NWLGDFCTJBQHGK-JOCHJYFZSA-N 1 1 366.505 3.562 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNCc1cccc(OC)c1OCc1ccccc1 ZINC000019366920 220254082 /nfs/dbraw/zinc/25/40/82/220254082.db2.gz LSRXTNQSOBHIPY-HXUWFJFHSA-N 1 1 354.494 3.848 50 0 FHAAMO CCN1CCC[C@@H]1C[NH2+]Cc1cccc(OC)c1OCc1ccccc1 ZINC000019366920 220254083 /nfs/dbraw/zinc/25/40/83/220254083.db2.gz LSRXTNQSOBHIPY-HXUWFJFHSA-N 1 1 354.494 3.848 50 0 FHAAMO COc1ccc(OC)c(CN2CC[NH+](C/C=C/c3ccccc3)CC2)c1 ZINC000019537196 220268639 /nfs/dbraw/zinc/26/86/39/220268639.db2.gz VXXIYMIJVVVRCE-RMKNXTFCSA-N 1 1 352.478 3.535 50 0 FHAAMO CN(C)c1ncc(C[N@@H+]2CCC[C@H](C(=O)c3cccc(Cl)c3)C2)s1 ZINC000019720534 220291318 /nfs/dbraw/zinc/29/13/18/220291318.db2.gz AZPSPQXSJVSHQW-AWEZNQCLSA-N 1 1 363.914 3.957 50 0 FHAAMO CN(C)c1ncc(C[N@H+]2CCC[C@H](C(=O)c3cccc(Cl)c3)C2)s1 ZINC000019720534 220291323 /nfs/dbraw/zinc/29/13/23/220291323.db2.gz AZPSPQXSJVSHQW-AWEZNQCLSA-N 1 1 363.914 3.957 50 0 FHAAMO Cc1sc2ncnc(NCCC[NH+]3CCOCC3)c2c1-c1ccccc1 ZINC000019691605 220286067 /nfs/dbraw/zinc/28/60/67/220286067.db2.gz GISBONPIXAEVBT-UHFFFAOYSA-N 1 1 368.506 3.801 50 0 FHAAMO COc1ccc(C(=O)N2CC[NH+](Cc3ccc4ccccc4c3)CC2)cc1 ZINC000019773992 220297014 /nfs/dbraw/zinc/29/70/14/220297014.db2.gz MIFVUFZOBMTKRY-UHFFFAOYSA-N 1 1 360.457 3.806 50 0 FHAAMO CC[N@@H+]1CCc2c(sc3nc(SC)n(Cc4ccccc4)c(=O)c32)C1 ZINC000020123605 220314151 /nfs/dbraw/zinc/31/41/51/220314151.db2.gz YZRARLCJPKICGQ-UHFFFAOYSA-N 1 1 371.531 3.606 50 0 FHAAMO CC[N@H+]1CCc2c(sc3nc(SC)n(Cc4ccccc4)c(=O)c32)C1 ZINC000020123605 220314154 /nfs/dbraw/zinc/31/41/54/220314154.db2.gz YZRARLCJPKICGQ-UHFFFAOYSA-N 1 1 371.531 3.606 50 0 FHAAMO CCC[N@@H+]1CCc2c(sc3ncn4nc(Cc5ccccc5)nc4c23)C1 ZINC000020548901 220332796 /nfs/dbraw/zinc/33/27/96/220332796.db2.gz VISKCTGAUJKDCF-UHFFFAOYSA-N 1 1 363.490 3.698 50 0 FHAAMO CCC[N@H+]1CCc2c(sc3ncn4nc(Cc5ccccc5)nc4c23)C1 ZINC000020548901 220332799 /nfs/dbraw/zinc/33/27/99/220332799.db2.gz VISKCTGAUJKDCF-UHFFFAOYSA-N 1 1 363.490 3.698 50 0 FHAAMO Fc1cccc(C[N@@H+]2CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C2)c1 ZINC000020601656 220335107 /nfs/dbraw/zinc/33/51/07/220335107.db2.gz DBHFSPKDKNVGEK-UHFFFAOYSA-N 1 1 351.381 3.503 50 0 FHAAMO Fc1cccc(C[N@H+]2CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C2)c1 ZINC000020601656 220335109 /nfs/dbraw/zinc/33/51/09/220335109.db2.gz DBHFSPKDKNVGEK-UHFFFAOYSA-N 1 1 351.381 3.503 50 0 FHAAMO S=c1nc(-c2ccccc2)n(CCC[NH+]2CCOCC2)c2c1CCCC2 ZINC000020390320 220326195 /nfs/dbraw/zinc/32/61/95/220326195.db2.gz INLJGBZLHNFSTP-UHFFFAOYSA-N 1 1 369.534 3.881 50 0 FHAAMO COc1c2c(cc3c1[C@H](n1ccc4ccc(F)cc41)[N@H+](C)CC3)OCO2 ZINC000020759345 220340533 /nfs/dbraw/zinc/34/05/33/220340533.db2.gz NMWFHRFZEBIUKN-FQEVSTJZSA-N 1 1 354.381 3.553 50 0 FHAAMO 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Cc1nc(Cl)ccc1NC(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(O)c2)C1 ZINC000299758502 534430922 /nfs/dbraw/zinc/43/09/22/534430922.db2.gz LUMUMWLWSZTHQW-OAHLLOKOSA-N 1 1 374.872 3.535 50 0 FHAAMO CCOC[C@@H]1CC[N@H+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C1 ZINC000081522139 520134248 /nfs/dbraw/zinc/13/42/48/520134248.db2.gz WMMXOHNOHWSBNJ-UZLBHIALSA-N 1 1 356.441 3.864 50 0 FHAAMO CCCC[N@@H+](C)CC1CCN(c2ncnc3c2cnn3C(C)(C)C)CC1 ZINC000089953518 520401629 /nfs/dbraw/zinc/40/16/29/520401629.db2.gz GYTIPZOWWXRFCG-UHFFFAOYSA-N 1 1 358.534 3.530 50 0 FHAAMO C[N@@H+](CCc1ccccc1)[C@H]1CCCN(Cc2ccc3nsnc3c2)C1 ZINC000020201870 522955557 /nfs/dbraw/zinc/95/55/57/522955557.db2.gz SQTGTVUGCMLQBE-IBGZPJMESA-N 1 1 366.534 3.830 50 0 FHAAMO C[N@@H+](CCc1ccccn1)[C@H]1CCCN(C/C=C/c2ccc(F)cc2)C1 ZINC000020995599 522966273 /nfs/dbraw/zinc/96/62/73/522966273.db2.gz XIYWMXYSCGRSBR-LHXJMTLCSA-N 1 1 353.485 3.873 50 0 FHAAMO COc1cc2c(cc1C[N@H+]1CC[C@@H](Cc3cccc(CO)c3)C1)CCC2 ZINC000091351241 522998469 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O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)Nc1ccc2c(c1)OCO2 ZINC000089807622 526596540 /nfs/dbraw/zinc/59/65/40/526596540.db2.gz KMDSJCDETRZXHK-QGZVFWFLSA-N 1 1 359.470 3.582 50 0 FHAAMO O=C(c1cccc(C(F)(F)F)c1)[C@H]1CCC[N@@H+](CCCn2cccn2)C1 ZINC000020996244 526751787 /nfs/dbraw/zinc/75/17/87/526751787.db2.gz IUFGBNSHCSVPLO-INIZCTEOSA-N 1 1 365.399 3.887 50 0 FHAAMO Cc1nc(CC(=O)N[C@@H]2CCCC[N@@H+](C/C=C/c3ccccc3)C2)cs1 ZINC000082091629 526791350 /nfs/dbraw/zinc/79/13/50/526791350.db2.gz JVDYMSCVSMLHPK-QPGLYAHGSA-N 1 1 369.534 3.678 50 0 FHAAMO CCCc1ccccc1NC(=O)N1CCCC[C@@H]1CCN1CC[NH+](C)CC1 ZINC000299778267 528643185 /nfs/dbraw/zinc/64/31/85/528643185.db2.gz GXGANXOYJXJCFA-HXUWFJFHSA-N 1 1 372.557 3.663 50 0 FHAAMO CCCc1nc(C(=O)NCC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000299792274 528695243 /nfs/dbraw/zinc/69/52/43/528695243.db2.gz DVTYVVNTQKTACY-QGZVFWFLSA-N 1 1 357.523 3.738 50 0 FHAAMO Brc1cncc(Br)c1C[NH2+]Cc1ccccc1 ZINC000253419659 571312813 /nfs/dbraw/zinc/31/28/13/571312813.db2.gz 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374.488 3.929 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1C1CN(C(=O)c2ccc(-c3ccc4nc[nH]c4c3)cc2)C1 ZINC000426712021 571236244 /nfs/dbraw/zinc/23/62/44/571236244.db2.gz JVVRAYLJENMDIM-MRXNPFEDSA-N 1 1 374.488 3.929 50 0 FHAAMO CSc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2cccnc2)C3)cc1 ZINC000091305451 571238871 /nfs/dbraw/zinc/23/88/71/571238871.db2.gz AZXXBEZFQDNRNH-PKOBYXMFSA-N 1 1 367.518 3.540 50 0 FHAAMO CCCN1CCC[C@@]2(CC[N@@H+](Cc3cc(-c4ccc(C)cc4)no3)C2)C1=O ZINC000091326737 571239002 /nfs/dbraw/zinc/23/90/02/571239002.db2.gz OHBRDWMTWBEYPQ-QFIPXVFZSA-N 1 1 367.493 3.875 50 0 FHAAMO Cc1[nH+]ccn1CC[C@@H](NC(=O)c1cn2cc(C)ccc2n1)c1ccccc1 ZINC000091411473 571239424 /nfs/dbraw/zinc/23/94/24/571239424.db2.gz MJBSICRHEPPCIQ-LJQANCHMSA-N 1 1 373.460 3.709 50 0 FHAAMO CC(=O)c1cccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccccc2)C3)c1 ZINC000091563269 571240655 /nfs/dbraw/zinc/24/06/55/571240655.db2.gz GQHDKWQEKLZRMY-SIKLNZKXSA-N 1 1 362.473 3.626 50 0 FHAAMO COc1ccc(C[N@H+](Cc2cccc(C)c2)C[C@H](O)COC(C)C)cc1 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CC[C@@H](CO)Nc1nc(C[NH+]2CCC(C)CC2)nc2sc3c(c21)CCC3 ZINC000012755143 220024851 /nfs/dbraw/zinc/02/48/51/220024851.db2.gz GDQZLFKICKYXSV-AWEZNQCLSA-N 1 1 374.554 3.595 50 0 FHAAMO COc1ccc(CCC(=O)N2CCC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1 ZINC000012836153 220034683 /nfs/dbraw/zinc/03/46/83/220034683.db2.gz MWTIMUPQHSYUMP-OAQYLSRUSA-N 1 1 366.505 3.751 50 0 FHAAMO COc1cccc(OCC[NH+]2CCN(c3nsc4ccccc43)CC2)c1 ZINC000013691639 220087029 /nfs/dbraw/zinc/08/70/29/220087029.db2.gz LIYKMFPNJYZLDE-UHFFFAOYSA-N 1 1 369.490 3.506 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cn1)[N@H+](C)CCOc1ccc(Cl)cc1 ZINC000014124648 220108371 /nfs/dbraw/zinc/10/83/71/220108371.db2.gz GLOJOIKNGYODFE-LBPRGKRZSA-N 1 1 368.264 3.726 50 0 FHAAMO C[C@@H](C(=O)Nc1ccc(Cl)cn1)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000014124648 220108374 /nfs/dbraw/zinc/10/83/74/220108374.db2.gz GLOJOIKNGYODFE-LBPRGKRZSA-N 1 1 368.264 3.726 50 0 FHAAMO C[C@H]1C[C@]2(CC(C)(C)C1)NC(=O)N(C[N@@H+]1CCC[C@@H]1c1ccccc1)C2=O ZINC000014183929 220113662 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O=C(c1cccc(Cl)c1)[C@H]1CCC[N@H+](Cc2cccc(OCCO)c2)C1 ZINC000014977229 220138290 /nfs/dbraw/zinc/13/82/90/220138290.db2.gz RVEHPAYRAHBUDY-SFHVURJKSA-N 1 1 373.880 3.806 50 0 FHAAMO O=C1CC[N@H+](Cc2cc3ccccc3[nH]2)CCN1Cc1ccccc1F ZINC000014983803 220138560 /nfs/dbraw/zinc/13/85/60/220138560.db2.gz VSICOWZXCVHXQJ-UHFFFAOYSA-N 1 1 351.425 3.542 50 0 FHAAMO CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCC[N@H+](Cc2ncc[nH]2)C1 ZINC000015077117 220147312 /nfs/dbraw/zinc/14/73/12/220147312.db2.gz CKEILCDWWWGNPV-ISPXXFMDSA-N 1 1 353.466 3.659 50 0 FHAAMO CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCC[N@@H+](Cc2ncc[nH]2)C1 ZINC000015077117 220147313 /nfs/dbraw/zinc/14/73/13/220147313.db2.gz CKEILCDWWWGNPV-ISPXXFMDSA-N 1 1 353.466 3.659 50 0 FHAAMO O=C(OC[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccccc1Br ZINC000015225216 220148989 /nfs/dbraw/zinc/14/89/89/220148989.db2.gz PMZBYYOEWUUODT-BBRMVZONSA-N 1 1 352.272 3.870 50 0 FHAAMO COC(=O)CC[C@@H](C)[N@H+]1CCc2[nH]nc(-c3cccc4ccccc43)c2C1 ZINC000015065664 220143833 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FHAAMO C[NH+]1CCN(C(=O)CC23C[C@H]4C[C@@H](C2)CC(c2ccccc2)(C4)C3)CC1 ZINC000016320015 220182681 /nfs/dbraw/zinc/18/26/81/220182681.db2.gz SVFLALMSYJMEDE-MGAZVUHYSA-N 1 1 352.522 3.689 50 0 FHAAMO C[C@H](C(=O)N[C@@H](C)c1ccccc1)[N@H+](C)CCOc1cccc(Cl)c1 ZINC000016421808 220184349 /nfs/dbraw/zinc/18/43/49/220184349.db2.gz RAHNBVHFJRJVJM-JKSUJKDBSA-N 1 1 360.885 3.917 50 0 FHAAMO C[C@H](C(=O)N[C@@H](C)c1ccccc1)[N@@H+](C)CCOc1cccc(Cl)c1 ZINC000016421808 220184351 /nfs/dbraw/zinc/18/43/51/220184351.db2.gz RAHNBVHFJRJVJM-JKSUJKDBSA-N 1 1 360.885 3.917 50 0 FHAAMO CC(C)n1nccc1NC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000016474800 220184769 /nfs/dbraw/zinc/18/47/69/220184769.db2.gz NPNLEOZQMCXHFE-QGZVFWFLSA-N 1 1 354.498 3.746 50 0 FHAAMO O=C1C[C@H]([NH+]2CCC(C3CCCCC3)CC2)C(=O)N1c1ccc(F)cc1 ZINC000018220135 220228774 /nfs/dbraw/zinc/22/87/74/220228774.db2.gz YITIBXQNRLZBEQ-IBGZPJMESA-N 1 1 358.457 3.750 50 0 FHAAMO COc1cccc(CN2CC[NH+](Cc3ccc(SC)cc3)CC2)c1OC ZINC000019360268 220254017 /nfs/dbraw/zinc/25/40/17/220254017.db2.gz PWWRWVCVTIDDES-UHFFFAOYSA-N 1 1 372.534 3.744 50 0 FHAAMO CC(C)CC[N@H+]1CCC[C@H]1c1ccc(C(=O)NCCn2ccnc2)s1 ZINC000019743190 220292127 /nfs/dbraw/zinc/29/21/27/220292127.db2.gz UKTSEHPUVGCVRC-INIZCTEOSA-N 1 1 360.527 3.558 50 0 FHAAMO COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1ccc(F)cc1 ZINC000020944766 220346192 /nfs/dbraw/zinc/34/61/92/220346192.db2.gz NDGQQKNYQKOFCX-GOSISDBHSA-N 1 1 373.424 3.505 50 0 FHAAMO COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1ccc(F)cc1 ZINC000020944766 220346194 /nfs/dbraw/zinc/34/61/94/220346194.db2.gz NDGQQKNYQKOFCX-GOSISDBHSA-N 1 1 373.424 3.505 50 0 FHAAMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)Nc1c[nH]c2ccc(C)cc2c1=O ZINC000021148803 220353547 /nfs/dbraw/zinc/35/35/47/220353547.db2.gz MUWIRVSEYOMSID-INIZCTEOSA-N 1 1 370.497 3.613 50 0 FHAAMO O=C1c2ccccc2C(=O)N1CC[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000021582023 220360711 /nfs/dbraw/zinc/36/07/11/220360711.db2.gz MJNFHYSVAWSZJU-UHFFFAOYSA-N 1 1 360.413 3.578 50 0 FHAAMO O=C1c2ccccc2C(=O)N1CC[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000021582023 220360715 /nfs/dbraw/zinc/36/07/15/220360715.db2.gz MJNFHYSVAWSZJU-UHFFFAOYSA-N 1 1 360.413 3.578 50 0 FHAAMO C[C@@H]1C[C@H](C)C[N@H+](CC2CCN(C(=O)NCc3ccc(F)cc3)CC2)C1 ZINC000021718295 220364399 /nfs/dbraw/zinc/36/43/99/220364399.db2.gz NYMDMDOHZZHDDL-CALCHBBNSA-N 1 1 361.505 3.725 50 0 FHAAMO Cc1nc(N(C)C)cc(Nc2ccc(NC(=O)c3cccs3)cc2)[nH+]1 ZINC000021794097 220367460 /nfs/dbraw/zinc/36/74/60/220367460.db2.gz HWYLYVSVQPZOPZ-UHFFFAOYSA-N 1 1 353.451 3.908 50 0 FHAAMO Cc1nc(Nc2ccc(NC(=O)c3cccs3)cc2)cc(N(C)C)[nH+]1 ZINC000021794097 220367462 /nfs/dbraw/zinc/36/74/62/220367462.db2.gz HWYLYVSVQPZOPZ-UHFFFAOYSA-N 1 1 353.451 3.908 50 0 FHAAMO C[NH+]1CCN(Cc2cccc(C(=O)c3cccc(C(F)(F)F)c3)c2)CC1 ZINC000022028047 220374020 /nfs/dbraw/zinc/37/40/20/220374020.db2.gz ODWYKRKEGBTIQT-UHFFFAOYSA-N 1 1 362.395 3.684 50 0 FHAAMO CCC(CC)[C@@H](CNC(=O)c1ccc(Cl)cc1Cl)[NH+]1CCOCC1 ZINC000022755241 220397479 /nfs/dbraw/zinc/39/74/79/220397479.db2.gz JWZQFBHGFZKQNR-QGZVFWFLSA-N 1 1 373.324 3.860 50 0 FHAAMO C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)c2ccccc2Cl)C[C@H](C)O1 ZINC000048345451 221009181 /nfs/dbraw/zinc/00/91/81/221009181.db2.gz IKOAIRPEYLYASV-IYBDPMFKSA-N 1 1 372.896 3.879 50 0 FHAAMO C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)c2ccccc2Cl)C[C@H](C)O1 ZINC000048345451 221009183 /nfs/dbraw/zinc/00/91/83/221009183.db2.gz IKOAIRPEYLYASV-IYBDPMFKSA-N 1 1 372.896 3.879 50 0 FHAAMO C[N@@H+]1CCc2c(c3ccccc3n2CCC(=O)Nc2ccc(Cl)cn2)C1 ZINC000049545693 221024347 /nfs/dbraw/zinc/02/43/47/221024347.db2.gz KBXRBMINZJFQLM-UHFFFAOYSA-N 1 1 368.868 3.706 50 0 FHAAMO C[N@H+]1CCc2c(c3ccccc3n2CCC(=O)Nc2ccc(Cl)cn2)C1 ZINC000049545693 221024349 /nfs/dbraw/zinc/02/43/49/221024349.db2.gz KBXRBMINZJFQLM-UHFFFAOYSA-N 1 1 368.868 3.706 50 0 FHAAMO CC[NH+]1CCN(C(=O)c2cc(-c3cccc(C)c3)nc3ccccc32)CC1 ZINC000055079259 221058725 /nfs/dbraw/zinc/05/87/25/221058725.db2.gz PDLQPZGSYINABV-UHFFFAOYSA-N 1 1 359.473 3.988 50 0 FHAAMO CC(C)[C@H](C)[N@@H+](Cc1ccco1)Cc1cn(CC(N)=O)c2ccccc12 ZINC000055166926 221061629 /nfs/dbraw/zinc/06/16/29/221061629.db2.gz WOIZKVIIMTYYAH-INIZCTEOSA-N 1 1 353.466 3.766 50 0 FHAAMO Cc1ccsc1C[N@@H+](CCN(C)C)Cc1cccc(-n2cccn2)c1 ZINC000055392814 221068335 /nfs/dbraw/zinc/06/83/35/221068335.db2.gz DBSVDIJLFAOIIK-UHFFFAOYSA-N 1 1 354.523 3.806 50 0 FHAAMO Cc1ccsc1C[N@H+](CCN(C)C)Cc1cccc(-n2cccn2)c1 ZINC000055392814 221068337 /nfs/dbraw/zinc/06/83/37/221068337.db2.gz DBSVDIJLFAOIIK-UHFFFAOYSA-N 1 1 354.523 3.806 50 0 FHAAMO O=C(c1cc(-c2ccccc2Cl)[nH]n1)N1CCC([NH+]2CCCCC2)CC1 ZINC000057413210 221088985 /nfs/dbraw/zinc/08/89/85/221088985.db2.gz RKJNKQLFQBQRRG-UHFFFAOYSA-N 1 1 372.900 3.821 50 0 FHAAMO Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)c(Cl)c1 ZINC000057775731 221094620 /nfs/dbraw/zinc/09/46/20/221094620.db2.gz SYONUYOOOHKCMZ-IBGZPJMESA-N 1 1 357.885 3.576 50 0 FHAAMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)NCC[C@@H]2CCCO2)c1 ZINC000058087473 221098710 /nfs/dbraw/zinc/09/87/10/221098710.db2.gz CDBRMMIHWQPZDS-SFHVURJKSA-N 1 1 356.470 3.745 50 0 FHAAMO CN(Cc1ccc(-c2ccc(Cl)cc2)o1)C(=O)NC[C@H]1CCC[N@H+]1C ZINC000058158575 221100412 /nfs/dbraw/zinc/10/04/12/221100412.db2.gz AQMVFPYXMOWFTD-MRXNPFEDSA-N 1 1 361.873 3.836 50 0 FHAAMO CCOC(=O)c1ccccc1C(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000058979972 221124384 /nfs/dbraw/zinc/12/43/84/221124384.db2.gz WZBXHPUVVQVIBG-UHFFFAOYSA-N 1 1 369.486 3.643 50 0 FHAAMO C[C@H](NC(=O)C[N@@H+]1CC[C@H](Nc2ccccc2)C1)c1ccccc1Cl ZINC000058289268 221112529 /nfs/dbraw/zinc/11/25/29/221112529.db2.gz VBOKUNVRJAVPBT-RDJZCZTQSA-N 1 1 357.885 3.704 50 0 FHAAMO C[C@H](NC(=O)C[N@H+]1CC[C@H](Nc2ccccc2)C1)c1ccccc1Cl ZINC000058289268 221112531 /nfs/dbraw/zinc/11/25/31/221112531.db2.gz VBOKUNVRJAVPBT-RDJZCZTQSA-N 1 1 357.885 3.704 50 0 FHAAMO C[N@H+](Cc1cccnc1)C[C@@H]1CCCN(C(=O)Nc2cccc(F)c2)C1 ZINC000058330186 221114755 /nfs/dbraw/zinc/11/47/55/221114755.db2.gz IBSXGVNJGXOFTN-KRWDZBQOSA-N 1 1 356.445 3.597 50 0 FHAAMO COc1ccc(-n2ccnc2C[N@H+](C)[C@H](C)Cc2cc(C)ccn2)cc1 ZINC000063855905 221144173 /nfs/dbraw/zinc/14/41/73/221144173.db2.gz VCZYWWUPCJMBAO-QGZVFWFLSA-N 1 1 350.466 3.647 50 0 FHAAMO COc1ccc(-n2ccnc2C[N@@H+](C)[C@H](C)Cc2cc(C)ccn2)cc1 ZINC000063855905 221144174 /nfs/dbraw/zinc/14/41/74/221144174.db2.gz VCZYWWUPCJMBAO-QGZVFWFLSA-N 1 1 350.466 3.647 50 0 FHAAMO COc1ccc(C[N@@H+](CCc2ccccc2)C2CCN(C)CC2)cc1O ZINC000063871408 221144435 /nfs/dbraw/zinc/14/44/35/221144435.db2.gz SDFYZKKSMLCYGX-UHFFFAOYSA-N 1 1 354.494 3.540 50 0 FHAAMO CCOc1ccc(C[N@@H+](CC)Cc2cc(=O)n3cc(Cl)ccc3n2)cc1 ZINC000064590918 221149128 /nfs/dbraw/zinc/14/91/28/221149128.db2.gz YCMAFZNICQBKCU-UHFFFAOYSA-N 1 1 371.868 3.769 50 0 FHAAMO O=C(C[NH+]1CCC(c2nc(-c3cccs3)no2)CC1)Nc1ccccc1 ZINC000065184199 221176026 /nfs/dbraw/zinc/17/60/26/221176026.db2.gz AIRUQKRZBOVKHL-UHFFFAOYSA-N 1 1 368.462 3.616 50 0 FHAAMO CC1CC[NH+](Cc2nc(-c3ccc(N4CCCCCC4)nc3)no2)CC1 ZINC000065216219 221181766 /nfs/dbraw/zinc/18/17/66/221181766.db2.gz GLPAQUHHEUMYEC-UHFFFAOYSA-N 1 1 355.486 3.744 50 0 FHAAMO COc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccncc3)no2)cc1 ZINC000065286340 221194989 /nfs/dbraw/zinc/19/49/89/221194989.db2.gz OMTPDQODPKVMPB-SFHVURJKSA-N 1 1 350.422 3.867 50 0 FHAAMO COc1ccc(C[N@H+]2CCCC[C@H]2c2nc(-c3ccncc3)no2)cc1 ZINC000065286340 221194990 /nfs/dbraw/zinc/19/49/90/221194990.db2.gz OMTPDQODPKVMPB-SFHVURJKSA-N 1 1 350.422 3.867 50 0 FHAAMO Cc1noc(C)c1[C@@H]1CCC[N@H+]1Cc1ccc(Sc2nncn2C)o1 ZINC000065373252 221205714 /nfs/dbraw/zinc/20/57/14/221205714.db2.gz XVQFRZBQIMZVQQ-AWEZNQCLSA-N 1 1 359.455 3.501 50 0 FHAAMO Cc1noc(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(Sc2nncn2C)o1 ZINC000065373252 221205716 /nfs/dbraw/zinc/20/57/16/221205716.db2.gz XVQFRZBQIMZVQQ-AWEZNQCLSA-N 1 1 359.455 3.501 50 0 FHAAMO O=C(Nc1nncs1)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000065423070 221217510 /nfs/dbraw/zinc/21/75/10/221217510.db2.gz XNUKQNYCFFGINX-QGZVFWFLSA-N 1 1 365.462 3.523 50 0 FHAAMO C[C@@H](C(=O)N1CCCCCC1)[N@H+]1CC=C(c2cnn(C(C)(C)C)c2)CC1 ZINC000065465518 221223106 /nfs/dbraw/zinc/22/31/06/221223106.db2.gz GWPNBLGJRVOMFA-KRWDZBQOSA-N 1 1 358.530 3.518 50 0 FHAAMO C[C@@H](C(=O)N1CCCCCC1)[N@@H+]1CC=C(c2cnn(C(C)(C)C)c2)CC1 ZINC000065465518 221223107 /nfs/dbraw/zinc/22/31/07/221223107.db2.gz GWPNBLGJRVOMFA-KRWDZBQOSA-N 1 1 358.530 3.518 50 0 FHAAMO CC(=O)N[C@@H]1C[C@H](C2CCCCC2)O[C@H](c2[nH+]c(C)n3ccccc23)C1 ZINC000065399118 221211630 /nfs/dbraw/zinc/21/16/30/221211630.db2.gz CVSRAPCBDZPHRY-RLLQIKCJSA-N 1 1 355.482 3.948 50 0 FHAAMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2ccc(-n3cc[nH]c3=S)cc2)C1 ZINC000065474291 221224539 /nfs/dbraw/zinc/22/45/39/221224539.db2.gz UVWAGJFXUKECPU-INIZCTEOSA-N 1 1 372.538 3.777 50 0 FHAAMO CCc1[nH+]ccn1CCC(=O)N1CCC[C@@]2(C=Cc3ccccc3O2)CC1 ZINC000065525939 221229237 /nfs/dbraw/zinc/22/92/37/221229237.db2.gz PYIYXTQDDMZXOX-JOCHJYFZSA-N 1 1 365.477 3.693 50 0 FHAAMO COc1cccc([C@@H]2CC[N@@H+](Cc3cn(C)c4ccccc34)C[C@H]2O)c1 ZINC000065525817 221229510 /nfs/dbraw/zinc/22/95/10/221229510.db2.gz DYFOLNCRRGFIKK-RBBKRZOGSA-N 1 1 350.462 3.537 50 0 FHAAMO C[C@H](C[NH+]1CCCC1)C(=O)N1CCC(c2[nH]ncc2-c2ccccc2)CC1 ZINC000067458346 221256514 /nfs/dbraw/zinc/25/65/14/221256514.db2.gz BOMWVMWYCIJJAG-QGZVFWFLSA-N 1 1 366.509 3.515 50 0 FHAAMO Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+][C@@H]1c2ccccc2C[C@@H]1O ZINC000067718524 221276991 /nfs/dbraw/zinc/27/69/91/221276991.db2.gz FYCPNTZJYPAERQ-VQTJNVASSA-N 1 1 367.880 3.641 50 0 FHAAMO COc1ccccc1-n1cc(C[NH2+]Cc2nc3c(ccc(C)c3C)[nH]2)cn1 ZINC000067688800 221271354 /nfs/dbraw/zinc/27/13/54/221271354.db2.gz YVDCEIQTQYJOFQ-UHFFFAOYSA-N 1 1 361.449 3.664 50 0 FHAAMO COc1ccc(-c2nc(C[N@H+]3CCC[C@H](O)C3)c(C)o2)c2ccccc12 ZINC000067739698 221279178 /nfs/dbraw/zinc/27/91/78/221279178.db2.gz WQGQCWCOCVIRDR-HNNXBMFYSA-N 1 1 352.434 3.769 50 0 FHAAMO Oc1cc(-c2cccc(Cl)c2)cc2c1OCC[N@H+](CCn1cccn1)C2 ZINC000067743505 221280392 /nfs/dbraw/zinc/28/03/92/221280392.db2.gz DWLNOOQBFISXHB-UHFFFAOYSA-N 1 1 369.852 3.804 50 0 FHAAMO Oc1cc(-c2cccc(Cl)c2)cc2c1OCC[N@@H+](CCn1cccn1)C2 ZINC000067743505 221280394 /nfs/dbraw/zinc/28/03/94/221280394.db2.gz DWLNOOQBFISXHB-UHFFFAOYSA-N 1 1 369.852 3.804 50 0 FHAAMO CC(C)c1cc(C2CCN(C(=O)[C@@H](C)n3cc[nH+]c3C(C)C)CC2)[nH]n1 ZINC000067758213 221282344 /nfs/dbraw/zinc/28/23/44/221282344.db2.gz ZKKPPANFANPSQJ-OAHLLOKOSA-N 1 1 357.502 3.820 50 0 FHAAMO CN(C(=O)c1cc2ccccc2[nH]1)[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000067834357 221292805 /nfs/dbraw/zinc/29/28/05/221292805.db2.gz KFBOLNXOVLRAHL-FQEVSTJZSA-N 1 1 373.500 3.872 50 0 FHAAMO CC(C)C[N@H+]1CCCN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC1 ZINC000067866827 221296788 /nfs/dbraw/zinc/29/67/88/221296788.db2.gz NHIICSWFAKTUHH-UHFFFAOYSA-N 1 1 363.509 3.560 50 0 FHAAMO CC(C)(C)CNC(=O)c1cc(C[NH+]2CCC(Cc3ccccc3)CC2)on1 ZINC000067920534 221305766 /nfs/dbraw/zinc/30/57/66/221305766.db2.gz SCNKWUFOGKHGMC-UHFFFAOYSA-N 1 1 369.509 3.905 50 0 FHAAMO Cc1nn(C)c(C)c1C[N@H+](Cc1ccc2c(C)cc(=O)oc2c1)C1CC1 ZINC000067946513 221306089 /nfs/dbraw/zinc/30/60/89/221306089.db2.gz BHFUSLWSYIXYKE-UHFFFAOYSA-N 1 1 351.450 3.616 50 0 FHAAMO Cc1nn(C)c(C)c1C[N@@H+](Cc1ccc2c(C)cc(=O)oc2c1)C1CC1 ZINC000067946513 221306093 /nfs/dbraw/zinc/30/60/93/221306093.db2.gz BHFUSLWSYIXYKE-UHFFFAOYSA-N 1 1 351.450 3.616 50 0 FHAAMO CC[N@H+]1CC[C@@H](CN2CCOc3c(O)cc(-c4ccc(C)s4)cc3C2)C1 ZINC000067934390 221306323 /nfs/dbraw/zinc/30/63/23/221306323.db2.gz ALUWEYBEYGERAA-MRXNPFEDSA-N 1 1 372.534 3.965 50 0 FHAAMO Nc1cc(N2CCc3[nH]nc(-c4ccc(-c5ccccc5)cc4)c3C2)nc[nH+]1 ZINC000067946969 221307682 /nfs/dbraw/zinc/30/76/82/221307682.db2.gz AAFOOKBAYVIIIB-UHFFFAOYSA-N 1 1 368.444 3.679 50 0 FHAAMO Cc1nccn1CCC[N@H+]1CCCN(Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071385537 221344641 /nfs/dbraw/zinc/34/46/41/221344641.db2.gz YOZZITXHJIIVLG-QFIPXVFZSA-N 1 1 372.532 3.953 50 0 FHAAMO CCCn1ncc(C[N@H+]2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)c1C ZINC000071589464 221351409 /nfs/dbraw/zinc/35/14/09/221351409.db2.gz LXSSRRMWTXFNKF-OAQYLSRUSA-N 1 1 368.525 3.615 50 0 FHAAMO COc1cccc(C[C@H]2C[N@@H+](CCc3c[nH]c4ccccc34)CCO2)c1 ZINC000071746735 221357899 /nfs/dbraw/zinc/35/78/99/221357899.db2.gz PFKPCCHQPQQKMA-FQEVSTJZSA-N 1 1 350.462 3.663 50 0 FHAAMO Oc1cccc(C[N@H+]2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)c1 ZINC000071745873 221358251 /nfs/dbraw/zinc/35/82/51/221358251.db2.gz TZSHQAVPGIDKEL-VLCRHTCISA-N 1 1 370.443 3.733 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](Cc3ccnc(C(C)C)n3)C2)cc1F ZINC000071748148 221359882 /nfs/dbraw/zinc/35/98/82/221359882.db2.gz AFJYMPIBZNNQPD-MRXNPFEDSA-N 1 1 371.456 3.843 50 0 FHAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccnc(C(C)C)n3)C2)cc1F ZINC000071748148 221359884 /nfs/dbraw/zinc/35/98/84/221359884.db2.gz AFJYMPIBZNNQPD-MRXNPFEDSA-N 1 1 371.456 3.843 50 0 FHAAMO CC(C)[C@H]1CN(C(=O)Cc2ccc(O)c(Cl)c2)CCC[N@H+]1CC1CC1 ZINC000071751348 221361869 /nfs/dbraw/zinc/36/18/69/221361869.db2.gz XORWZULQRBCMKL-GOSISDBHSA-N 1 1 364.917 3.557 50 0 FHAAMO CC(C)[C@@H]1CN(C(=O)c2cccc3c2ccn3C)CCC[N@H+]1CC1CC1 ZINC000071752068 221364385 /nfs/dbraw/zinc/36/43/85/221364385.db2.gz MZFZCADNGWVWTJ-NRFANRHFSA-N 1 1 353.510 3.761 50 0 FHAAMO Cc1oc(-c2cccc(F)c2F)nc1CN1CC([N@@H+]2CCCC[C@@H]2C)C1 ZINC000071761219 221367705 /nfs/dbraw/zinc/36/77/05/221367705.db2.gz JXUYURXIMNTLKK-ZDUSSCGKSA-N 1 1 361.436 3.987 50 0 FHAAMO Fc1cccc([C@@H]2CN(Cc3ncccc3F)[C@H]3[C@@H]2[NH+]2CCC3CC2)c1F ZINC000071763711 221370938 /nfs/dbraw/zinc/37/09/38/221370938.db2.gz PJEJQTZCSRDKRC-IWMITWMQSA-N 1 1 373.422 3.561 50 0 FHAAMO Fc1cccc([C@@H]2C[N@@H+](Cc3ncccc3F)[C@H]3[C@@H]2N2CCC3CC2)c1F ZINC000071763711 221370942 /nfs/dbraw/zinc/37/09/42/221370942.db2.gz PJEJQTZCSRDKRC-IWMITWMQSA-N 1 1 373.422 3.561 50 0 FHAAMO Fc1cccc([C@@H]2C[N@H+](Cc3ncccc3F)[C@H]3[C@@H]2N2CCC3CC2)c1F ZINC000071763711 221370946 /nfs/dbraw/zinc/37/09/46/221370946.db2.gz PJEJQTZCSRDKRC-IWMITWMQSA-N 1 1 373.422 3.561 50 0 FHAAMO COc1c[nH]c(C[N@H+]2CCC[C@H](Nc3ccc(C(C)C)cc3)C2)cc1=O ZINC000072145030 221422408 /nfs/dbraw/zinc/42/24/08/221422408.db2.gz JGENOFXYTRZIDC-SFHVURJKSA-N 1 1 355.482 3.996 50 0 FHAAMO COc1ncccc1-c1nc([C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)no1 ZINC000299764486 533247704 /nfs/dbraw/zinc/24/77/04/533247704.db2.gz HNOBAOCRVIATDZ-KSZLIROESA-N 1 1 362.433 3.833 50 0 FHAAMO c1cn(Cc2ccncc2)c(C2CCN(c3cnc4ccccc4n3)CC2)[nH+]1 ZINC000091690663 132203228 /nfs/dbraw/zinc/20/32/28/132203228.db2.gz XCJIVVAMGWYPGJ-UHFFFAOYSA-N 1 1 370.460 3.654 50 0 FHAAMO CCCc1cncnc1N1CCC[C@H](c2[nH+]ccn2Cc2cscn2)C1 ZINC000095356581 132207404 /nfs/dbraw/zinc/20/74/04/132207404.db2.gz KQCJKXODGZMJDX-INIZCTEOSA-N 1 1 368.510 3.514 50 0 FHAAMO [NH2+]=C1c2ccccc2CN1c1cc(C(F)(F)F)ccc1N1CCOCC1 ZINC000003201915 132253802 /nfs/dbraw/zinc/25/38/02/132253802.db2.gz XMJLQZOKFVYLAZ-UHFFFAOYSA-N 1 1 361.367 3.888 50 0 FHAAMO Cc1cnc(C)c(N2CC[NH+](Cc3ccc([C@H]4CCCCO4)s3)CC2)n1 ZINC000215441731 132270256 /nfs/dbraw/zinc/27/02/56/132270256.db2.gz VVBYTBUBEJJWKQ-GOSISDBHSA-N 1 1 372.538 3.719 50 0 FHAAMO Cc1cccc(N2CCC(NC(=O)[C@@H](C)n3cc[nH+]c3C(C)C)CC2)c1 ZINC000299784516 132299778 /nfs/dbraw/zinc/29/97/78/132299778.db2.gz OPMMQOQEXXDRHE-QGZVFWFLSA-N 1 1 354.498 3.661 50 0 FHAAMO Cc1cccc(N2CCC(NC(=O)[C@H](C)n3cc[nH+]c3C(C)C)CC2)c1 ZINC000299784505 132299955 /nfs/dbraw/zinc/29/99/55/132299955.db2.gz OPMMQOQEXXDRHE-KRWDZBQOSA-N 1 1 354.498 3.661 50 0 FHAAMO Cc1ccc2c(C[NH+]3CCN(c4ccc(F)cc4)CC3)cc(=O)oc2c1 ZINC000054105879 132376170 /nfs/dbraw/zinc/37/61/70/132376170.db2.gz XXFZWKRWEKBLNI-UHFFFAOYSA-N 1 1 352.409 3.563 50 0 FHAAMO CC[NH+]1CCN(c2ccc(NC(=O)c3cccc(OC)c3)cc2Cl)CC1 ZINC000000809771 132378659 /nfs/dbraw/zinc/37/86/59/132378659.db2.gz VEXGIJYRQXXRND-UHFFFAOYSA-N 1 1 373.884 3.743 50 0 FHAAMO CCOc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)cc1 ZINC000004412847 132386930 /nfs/dbraw/zinc/38/69/30/132386930.db2.gz KRCVSAFWXRESRS-UHFFFAOYSA-N 1 1 373.884 3.743 50 0 FHAAMO Nc1cc(N2CCC[C@H](C(=O)c3ccc(Oc4ccccc4)cc3)C2)nc[nH+]1 ZINC000071662818 136139691 /nfs/dbraw/zinc/13/96/91/136139691.db2.gz LXKNVMFZFJDMCU-KRWDZBQOSA-N 1 1 374.444 3.950 50 0 FHAAMO C[C@@H](CC(=O)N1c2ccccc2Sc2ccccc21)[NH+]1CCOCC1 ZINC000071770750 136140978 /nfs/dbraw/zinc/14/09/78/136140978.db2.gz YRCPOQKNPFNYBN-HNNXBMFYSA-N 1 1 354.475 3.927 50 0 FHAAMO Cc1ccccc1N1CC[N@H+](Cc2cnc(-c3ccccn3)nc2)[C@H](C)C1 ZINC000072430961 136146982 /nfs/dbraw/zinc/14/69/82/136146982.db2.gz JRSSKAXGJWCROG-GOSISDBHSA-N 1 1 359.477 3.558 50 0 FHAAMO Cc1ccccc1N1CC[N@@H+](Cc2cnc(-c3ccccn3)nc2)[C@H](C)C1 ZINC000072430961 136146983 /nfs/dbraw/zinc/14/69/83/136146983.db2.gz JRSSKAXGJWCROG-GOSISDBHSA-N 1 1 359.477 3.558 50 0 FHAAMO CC(C)c1nc(N2C[C@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CC[NH+]3CC2)no1 ZINC000095374512 221877227 /nfs/dbraw/zinc/87/72/27/221877227.db2.gz OEAOVEYRXWEUNO-KZNAEPCWSA-N 1 1 374.435 3.538 50 0 FHAAMO CC(C)c1ncc(CN2C[C@H]3CC[C@H](C[N@@H+]3Cc3ccccc3)C2)cn1 ZINC000095382374 221886363 /nfs/dbraw/zinc/88/63/63/221886363.db2.gz RVIZZSCRKHIFOE-PZJWPPBQSA-N 1 1 350.510 3.696 50 0 FHAAMO Cc1nn(C)c2nc(N[C@@H]3CCC[N@@H+](Cc4ccccc4F)C3)sc12 ZINC000096136808 222041885 /nfs/dbraw/zinc/04/18/85/222041885.db2.gz YRVLQMOOFZLCCJ-CQSZACIVSA-N 1 1 359.474 3.554 50 0 FHAAMO CCOc1ccc(NC(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)cc1Cl ZINC000096164051 222063004 /nfs/dbraw/zinc/06/30/04/222063004.db2.gz JZEUWHQZWXIQBN-ZDUSSCGKSA-N 1 1 351.878 3.829 50 0 FHAAMO CCn1nc(C)c(C(=O)NC[C@@H](c2ccc(F)cc2)[NH+]2CCCCC2)c1C ZINC000097076560 222157366 /nfs/dbraw/zinc/15/73/66/222157366.db2.gz OCEYBLMRJMOWBY-IBGZPJMESA-N 1 1 372.488 3.616 50 0 FHAAMO Cc1cc(CN2CCc3nc[nH]c3C2)c(C)c(C[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000097137604 222163067 /nfs/dbraw/zinc/16/30/67/222163067.db2.gz HWKFXASQIQMSSC-MRXNPFEDSA-N 1 1 352.526 3.817 50 0 FHAAMO CC(=O)c1cc(CC(=O)NC[C@H](c2ccccc2F)[NH+]2CCCC2)cs1 ZINC000097213300 222168407 /nfs/dbraw/zinc/16/84/07/222168407.db2.gz WULZOCAPPIULBS-GOSISDBHSA-N 1 1 374.481 3.586 50 0 FHAAMO CC[N@H+]1CCCC[C@H]1C(=O)N(Cc1scnc1C)Cc1ccccc1 ZINC000097514457 222187443 /nfs/dbraw/zinc/18/74/43/222187443.db2.gz XQDOBRJQWDTKGU-SFHVURJKSA-N 1 1 357.523 3.855 50 0 FHAAMO C[C@@H]1CCCC[N@H+]1C1CN(C(=O)c2cccc(-c3ccc(O)cc3)c2)C1 ZINC000097732840 222209559 /nfs/dbraw/zinc/20/95/59/222209559.db2.gz XSRBJVCUIJIOQO-MRXNPFEDSA-N 1 1 350.462 3.758 50 0 FHAAMO COc1ccccc1C[N@H+]1CC[C@]2(OC)CC[C@@H](Oc3ccccn3)C[C@H]12 ZINC000426500296 263609043 /nfs/dbraw/zinc/60/90/43/263609043.db2.gz OFTKKJSSAPJNQR-KAGYGMCKSA-N 1 1 368.477 3.681 50 0 FHAAMO O=C(NCC[N@H+]1CC[C@@H](c2ccccc2)C1)Nc1ccnn1C1CCCC1 ZINC000299763209 534341970 /nfs/dbraw/zinc/34/19/70/534341970.db2.gz ZACILBWVPULWBR-GOSISDBHSA-N 1 1 367.497 3.609 50 0 FHAAMO CC(C)C(=O)N[C@@H](C)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288413 519506562 /nfs/dbraw/zinc/50/65/62/519506562.db2.gz XCRSKTOCNGJLFY-FXAWDEMLSA-N 1 1 371.550 3.772 50 0 FHAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc(-c3ccsc3)oc2C)C1 ZINC000020535741 520539337 /nfs/dbraw/zinc/53/93/37/520539337.db2.gz ZAKZUQSUUSXCDP-HNNXBMFYSA-N 1 1 361.511 3.792 50 0 FHAAMO CCCCc1ncc(C[N@H+]2CC[C@]3(C2)CCCN(C2CCCCC2)C3=O)[nH]1 ZINC000091645267 521299882 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/nfs/dbraw/zinc/24/85/30/571248530.db2.gz DIFDMUUHEKWAJU-NRFANRHFSA-N 1 1 365.452 3.989 50 0 FHAAMO COc1cccc(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)c1 ZINC000036394287 571252874 /nfs/dbraw/zinc/25/28/74/571252874.db2.gz UIKUOPRCBZAIJO-GOSISDBHSA-N 1 1 366.505 3.786 50 0 FHAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000006881870 571252884 /nfs/dbraw/zinc/25/28/84/571252884.db2.gz ASCRJOBFBPUMGA-HXUWFJFHSA-N 1 1 374.488 3.753 50 0 FHAAMO COc1cccc(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)c1 ZINC000036394288 571252891 /nfs/dbraw/zinc/25/28/91/571252891.db2.gz UIKUOPRCBZAIJO-SFHVURJKSA-N 1 1 366.505 3.786 50 0 FHAAMO Cn1c(C(=O)NC[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc2ccc(Cl)cc21 ZINC000170613633 571267954 /nfs/dbraw/zinc/26/79/54/571267954.db2.gz QDNICQCLJISVMO-WBVHZDCISA-N 1 1 359.901 3.826 50 0 FHAAMO O=C(NC1CCCCC1)[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(F)(F)F ZINC000170614512 571268181 /nfs/dbraw/zinc/26/81/81/571268181.db2.gz FQKSKVINDFNZQZ-DLBZAZTESA-N 1 1 354.416 3.746 50 0 FHAAMO CC(=O)Nc1ccc(CC[NH2+]CC(C)(C)CN(C)Cc2ccccc2)cc1 ZINC000076094443 571274357 /nfs/dbraw/zinc/27/43/57/571274357.db2.gz SRQHZBWARUXVFH-UHFFFAOYSA-N 1 1 367.537 3.935 50 0 FHAAMO COc1cccc(C[N@@H+](Cc2ccc3c[nH]nc3c2)C2CCC(O)CC2)c1 ZINC000130228782 571275661 /nfs/dbraw/zinc/27/56/61/571275661.db2.gz BDRJXYNZJMFTDW-UHFFFAOYSA-N 1 1 365.477 3.877 50 0 FHAAMO COc1cc2c(cc1OC)[C@@H]([NH+]1CCN(C)CC1)Cc1ccccc1S2 ZINC000033884271 571308549 /nfs/dbraw/zinc/30/85/49/571308549.db2.gz NJINVTPOJJDKII-KRWDZBQOSA-N 1 1 370.518 3.700 50 0 FHAAMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@H](c3ccncc3)C2)cc1Cl ZINC000253428247 571313204 /nfs/dbraw/zinc/31/32/04/571313204.db2.gz ITBQISTUGHDKMM-HNNXBMFYSA-N 1 1 359.857 3.562 50 0 FHAAMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H](c3ccncc3)C2)cc1Cl ZINC000253428247 571313205 /nfs/dbraw/zinc/31/32/05/571313205.db2.gz ITBQISTUGHDKMM-HNNXBMFYSA-N 1 1 359.857 3.562 50 0 FHAAMO CN(Cc1cccc(O)c1)C(=O)NC[C@@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000584894878 571315184 /nfs/dbraw/zinc/31/51/84/571315184.db2.gz BGNCHHJEYHMZHS-SFHVURJKSA-N 1 1 359.514 3.578 50 0 FHAAMO Cc1sc2ncn(Cc3[nH]cc[nH+]3)c(=O)c2c1-c1cc(C)ccc1C ZINC000584899673 571316067 /nfs/dbraw/zinc/31/60/67/571316067.db2.gz PKUIPRBGSQKYLS-UHFFFAOYSA-N 1 1 350.447 3.822 50 0 FHAAMO CCN(C(=O)C[N@@H+]1CCC[C@H](CSC)C1)c1nc2ccccc2s1 ZINC000253432319 571316643 /nfs/dbraw/zinc/31/66/43/571316643.db2.gz JRUZLPREAFTIAK-AWEZNQCLSA-N 1 1 363.552 3.724 50 0 FHAAMO CCN(C(=O)C[N@H+]1CCC[C@H](CSC)C1)c1nc2ccccc2s1 ZINC000253432319 571316644 /nfs/dbraw/zinc/31/66/44/571316644.db2.gz JRUZLPREAFTIAK-AWEZNQCLSA-N 1 1 363.552 3.724 50 0 FHAAMO COC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)[C@H](C)[N@H+]1CCCC(C)(C)C1 ZINC000002308764 571317522 /nfs/dbraw/zinc/31/75/22/571317522.db2.gz IPTLTKDOGSOEOV-AWEZNQCLSA-N 1 1 371.481 3.712 50 0 FHAAMO Cn1cc(NC(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c(C2CCCCC2)n1 ZINC000585101654 571320583 /nfs/dbraw/zinc/32/05/83/571320583.db2.gz GLNNVSPSVDPEPS-OAHLLOKOSA-N 1 1 361.534 3.710 50 0 FHAAMO O=C(NCc1ccccc1)N1CCCC2=C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]21 ZINC000390828180 571328258 /nfs/dbraw/zinc/32/82/58/571328258.db2.gz PHPWGEMSZMRUSS-DXBBTUNJSA-N 1 1 365.521 3.791 50 0 FHAAMO CC[N@H+](C)[C@@H](C(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccccc1 ZINC000095348710 571328797 /nfs/dbraw/zinc/32/87/97/571328797.db2.gz AEZVYMBJLMROHN-LJQANCHMSA-N 1 1 352.413 3.643 50 0 FHAAMO CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccccc1 ZINC000095348710 571328798 /nfs/dbraw/zinc/32/87/98/571328798.db2.gz AEZVYMBJLMROHN-LJQANCHMSA-N 1 1 352.413 3.643 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@H+](C)Cc1cccc(-n2cccn2)c1 ZINC000095453898 571329907 /nfs/dbraw/zinc/32/99/07/571329907.db2.gz PBELJJMNHPBYEW-UHFFFAOYSA-N 1 1 366.490 3.665 50 0 FHAAMO CSc1ccccc1NC(=O)C[N@@H+](C)Cc1cccc(-n2cccn2)c1 ZINC000095453898 571329908 /nfs/dbraw/zinc/32/99/08/571329908.db2.gz PBELJJMNHPBYEW-UHFFFAOYSA-N 1 1 366.490 3.665 50 0 FHAAMO CC(C)N(C)c1cccc(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccncc2)c1 ZINC000095955953 571332886 /nfs/dbraw/zinc/33/28/86/571332886.db2.gz PLPFYONPJUVIRK-NRFANRHFSA-N 1 1 366.509 3.919 50 0 FHAAMO CC(C)N(C)c1cccc(NC(=O)[C@@H]2CCCC[N@H+]2Cc2ccncc2)c1 ZINC000095955953 571332887 /nfs/dbraw/zinc/33/28/87/571332887.db2.gz PLPFYONPJUVIRK-NRFANRHFSA-N 1 1 366.509 3.919 50 0 FHAAMO COc1cccc(C(=O)N2CC[NH+](Cc3cc4ccccc4s3)CC2)c1 ZINC000095982661 571333375 /nfs/dbraw/zinc/33/33/75/571333375.db2.gz WVHJHFOIHCWLEM-UHFFFAOYSA-N 1 1 366.486 3.868 50 0 FHAAMO O=C(CCSc1ccccc1)N1CC[C@H]([N@H+]2CCc3ccccc3C2)C1 ZINC000225685137 571337846 /nfs/dbraw/zinc/33/78/46/571337846.db2.gz LTZSTTDMQZXBOB-FQEVSTJZSA-N 1 1 366.530 3.828 50 0 FHAAMO COc1ccc2cc(C(=O)N(C)C[C@H]3CCC[N@H+]4CCCC[C@@H]34)n(C)c2c1 ZINC000299754411 571338510 /nfs/dbraw/zinc/33/85/10/571338510.db2.gz KNAYXGKHAXKSAB-MJGOQNOKSA-N 1 1 369.509 3.523 50 0 FHAAMO O=C(Nc1ccccc1)[C@H]([NH2+]C[C@@H]1COc2ccccc2O1)c1ccccc1 ZINC000057352276 571342608 /nfs/dbraw/zinc/34/26/08/571342608.db2.gz SDPRPTRHGZCLGG-DENIHFKCSA-N 1 1 374.440 3.796 50 0 FHAAMO CC[C@@H](CNC(=O)CCc1cccc(OC)c1)[N@H+]1CCc2ccccc2C1 ZINC000029911557 571344196 /nfs/dbraw/zinc/34/41/96/571344196.db2.gz JYFAVUKULSAHFR-NRFANRHFSA-N 1 1 366.505 3.581 50 0 FHAAMO O=C(C1CCC1)N1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000030181533 571345151 /nfs/dbraw/zinc/34/51/51/571345151.db2.gz VGXZMVAGVQJHRO-UHFFFAOYSA-N 1 1 358.482 3.999 50 0 FHAAMO C[NH+](C)C[C@H](NS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000030499422 571346147 /nfs/dbraw/zinc/34/61/47/571346147.db2.gz SXUARMCGBUAINX-IBGZPJMESA-N 1 1 360.523 3.565 50 0 FHAAMO Cn1c(C(=O)NC[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc2c1cccc2Cl ZINC000504401803 571347258 /nfs/dbraw/zinc/34/72/58/571347258.db2.gz VYEVFIWPVHADNM-PBHICJAKSA-N 1 1 359.901 3.826 50 0 FHAAMO Cc1cc(C(=O)NC[C@H]2CCC[N@H+]3CCCC[C@H]23)c2cc(F)ccc2n1 ZINC000504700709 571348849 /nfs/dbraw/zinc/34/88/49/571348849.db2.gz IWGOGVQXAIAKHJ-FOIQADDNSA-N 1 1 355.457 3.677 50 0 FHAAMO CCc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(NC(C)=O)cc2)cc1 ZINC000003414475 571349329 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