smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1C[C@@]2(CC[NH2+]C2)CO1 ZINC000903732236 736161278 /nfs/dbraw/zinc/16/12/78/736161278.db2.gz DLZILQSMORGGCX-DOTOQJQBSA-N 2 0 369.303 2.745 20 10 FFCDRP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000756399462 736327751 /nfs/dbraw/zinc/32/77/51/736327751.db2.gz POJQSDRTQGYJFK-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3cccc(Cl)c3)cc2)CC1 ZINC000771824922 737759785 /nfs/dbraw/zinc/75/97/85/737759785.db2.gz SJGSOKCGAFNXMJ-HXUWFJFHSA-N 2 0 359.901 2.915 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CC[C@H](C(F)(F)F)O3)cc2)CC1 ZINC000922457041 738148623 /nfs/dbraw/zinc/14/86/23/738148623.db2.gz GRFDVGMSFFDAPO-IAGOWNOFSA-N 2 0 357.420 2.638 20 10 FFCDRP Cc1cc(Br)cc(C[NH2+][C@@H](C)CN(C)CCC[NH+](C)C)c1O ZINC000826903724 743467312 /nfs/dbraw/zinc/46/73/12/743467312.db2.gz UADARERODXYQAC-AWEZNQCLSA-N 2 0 372.351 2.825 20 10 FFCDRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000841099519 747268929 /nfs/dbraw/zinc/26/89/29/747268929.db2.gz KIVZMHRCLFCQHD-WBVHZDCISA-N 2 0 369.303 2.873 20 10 FFCDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901915 748131900 /nfs/dbraw/zinc/13/19/00/748131900.db2.gz IWIDOMYMRZTBGS-MJEQTWJJSA-N 2 0 369.303 2.873 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000854231604 750265781 /nfs/dbraw/zinc/26/57/81/750265781.db2.gz MITKNDQTRRZCIG-ZDUSSCGKSA-N 2 0 353.894 2.687 20 10 FFCDRP Cn1ccc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000896492307 971510022 /nfs/dbraw/zinc/51/00/22/971510022.db2.gz CBHSFMNINYNLQD-IBGZPJMESA-N 2 0 353.514 2.552 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C3CC(n4cccn4)C3)cc2F)CC1 ZINC000877012487 1014448396 /nfs/dbraw/zinc/44/83/96/1014448396.db2.gz USICTUNVTWVKJK-UHFFFAOYSA-N 2 0 357.477 2.657 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3F)cc2)CC1 ZINC000905428732 980438755 /nfs/dbraw/zinc/43/87/55/980438755.db2.gz VNEVHBDEORVYFE-FQEVSTJZSA-N 2 0 361.436 2.540 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206011529 1032108285 /nfs/dbraw/zinc/10/82/85/1032108285.db2.gz DGPJJNKOOHXZKZ-DOTOQJQBSA-N 2 0 351.922 2.983 20 10 FFCDRP CCc1noc([C@@H]2CC[C@@H]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000922864797 988966166 /nfs/dbraw/zinc/96/61/66/988966166.db2.gz TVWQFLOKVOAPOQ-QZTJIDSGSA-N 2 0 369.513 2.810 20 10 FFCDRP Oc1ccccc1C[NH+]1CCN([C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000809700736 994575111 /nfs/dbraw/zinc/57/51/11/994575111.db2.gz NISJATHZPUINLV-NRFANRHFSA-N 2 0 351.494 2.784 20 10 FFCDRP COCCC[N@H+](Cc1ccncc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809741066 994601364 /nfs/dbraw/zinc/60/13/64/994601364.db2.gz OUHOZJCVXLUJFU-UHFFFAOYSA-N 2 0 368.525 2.872 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)c(O)c1 ZINC001144508742 998621301 /nfs/dbraw/zinc/62/13/01/998621301.db2.gz WUYPHGRXMJXANM-UHFFFAOYSA-N 2 0 369.465 2.687 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnc(OC(F)F)c3)cc2)CC1 ZINC000790637117 1002441446 /nfs/dbraw/zinc/44/14/46/1002441446.db2.gz UJMSCQBXHAKIBJ-UHFFFAOYSA-N 2 0 362.424 2.725 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(C)nn3C)cc2F)CC1 ZINC000793524667 1003400758 /nfs/dbraw/zinc/40/07/58/1003400758.db2.gz IXEZOQXMFNRQDI-MRXNPFEDSA-N 2 0 359.493 2.860 20 10 FFCDRP CC[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCN1CC(F)F ZINC000775726572 1003859819 /nfs/dbraw/zinc/85/98/19/1003859819.db2.gz UDPHJNJIGMGPIB-SFHVURJKSA-N 2 0 366.500 2.600 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929128 /nfs/dbraw/zinc/92/91/28/1003929128.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 3 0 368.569 2.887 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(OC[C@@H]4CCCO4)CC3)cc2)CC1 ZINC000775666324 1005007001 /nfs/dbraw/zinc/00/70/01/1005007001.db2.gz VUDLELVELWHERZ-QFIPXVFZSA-N 2 0 373.541 2.598 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(-c4cccnc4)n[nH]3)cc2)CC1 ZINC000883283814 1006731364 /nfs/dbraw/zinc/73/13/64/1006731364.db2.gz UOQAAYNZFMJQDC-UHFFFAOYSA-N 2 0 362.481 2.513 20 10 FFCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 ZINC000817889963 1007796119 /nfs/dbraw/zinc/79/61/19/1007796119.db2.gz QYYGMYGRXAQPHC-HOJAQTOUSA-N 2 0 372.557 2.789 20 10 FFCDRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817917585 1007808240 /nfs/dbraw/zinc/80/82/40/1007808240.db2.gz SEJPHCXGRIWFBA-GCJKJVERSA-N 3 0 356.558 2.696 20 10 FFCDRP FC(F)Oc1ccc(N2CCC([NH2+][C@@H]3[C@H]4C[C@H]5C[NH2+][C@H]3[C@H]5C4)CC2)cc1 ZINC000925577441 1017792746 /nfs/dbraw/zinc/79/27/46/1017792746.db2.gz OQQOKVHIWUUKQV-KMNYTQEUSA-N 2 0 363.452 2.843 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000827750483 1018638912 /nfs/dbraw/zinc/63/89/12/1018638912.db2.gz HXKBXOPSQDUZIZ-CTNGQTDRSA-N 2 0 359.514 2.650 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@@](C)(O)c3ccccc3)cc2)CC1 ZINC000778213363 1021130454 /nfs/dbraw/zinc/13/04/54/1021130454.db2.gz ILTYFOPLFOHIEG-JOCHJYFZSA-N 2 0 353.510 2.826 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c1 ZINC000756641463 1023739411 /nfs/dbraw/zinc/73/94/11/1023739411.db2.gz HYDFJVYCMZPQTF-INIZCTEOSA-N 2 0 361.530 2.978 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@@H]([NH3+])CCCC[NH+](C)C ZINC001157431950 1029584892 /nfs/dbraw/zinc/58/48/92/1029584892.db2.gz BYYGJOMLKRBMPI-QFBILLFUSA-N 2 0 361.530 2.808 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001157435664 1029585944 /nfs/dbraw/zinc/58/59/44/1029585944.db2.gz UUKLSYLLPZVZDY-QFBILLFUSA-N 2 0 371.525 2.623 20 10 FFCDRP C[C@@H]1CN(C(=O)C[C@@H]([NH3+])c2ccccc2O)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC001157615752 1029630819 /nfs/dbraw/zinc/63/08/19/1029630819.db2.gz OZAKCOHKQWYQMY-FUHIMQAGSA-N 2 0 367.493 2.904 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128882 1031195844 /nfs/dbraw/zinc/19/58/44/1031195844.db2.gz YIXGTLZIKMJBAJ-MOPGFXCFSA-N 2 0 361.505 2.874 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c(O)c1 ZINC001205295942 1031655213 /nfs/dbraw/zinc/65/52/13/1031655213.db2.gz CYDMULUTCXXZHJ-HXUWFJFHSA-N 2 0 364.486 2.818 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@]3(CO)CCCc4ccccc43)cc2)CC1 ZINC000799345097 1031742066 /nfs/dbraw/zinc/74/20/66/1031742066.db2.gz RASWAESVUVOJLM-QHCPKHFHSA-N 2 0 365.521 2.752 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(O)cc1Br ZINC001205653037 1031906805 /nfs/dbraw/zinc/90/68/05/1031906805.db2.gz SFAHNZSWDHFGFM-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001138218125 1033969754 /nfs/dbraw/zinc/96/97/54/1033969754.db2.gz BXILWFYJCVWTSA-FCHUYYIVSA-N 2 0 356.558 2.887 20 10 FFCDRP COc1cc(CN2CCC([NH+]3CCCCC3)CC2)cc(C[NH+](C)C)c1O ZINC001139252871 1035029926 /nfs/dbraw/zinc/02/99/26/1035029926.db2.gz CHHKRQCVOGELCS-UHFFFAOYSA-N 2 0 361.530 2.913 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(NC(=O)C(C)(C)C)CC3)cc2)CC1 ZINC001139410939 1035095810 /nfs/dbraw/zinc/09/58/10/1035095810.db2.gz MQNSNHYGHLCGQO-UHFFFAOYSA-N 2 0 372.557 2.565 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(c4cccnc4)CC3)cc2)CC1 ZINC001140301869 1035424918 /nfs/dbraw/zinc/42/49/18/1035424918.db2.gz BUNGXYHZLKCUPN-UHFFFAOYSA-N 2 0 365.525 2.546 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C(=O)OC)[C@@H]3C)cc2)CC1 ZINC001140304287 1035426323 /nfs/dbraw/zinc/42/63/23/1035426323.db2.gz LXQWSJNGFMMIEU-FXAWDEMLSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]4(C3)CC(F)(F)CO4)cc2)CC1 ZINC001140306197 1035427303 /nfs/dbraw/zinc/42/73/03/1035427303.db2.gz OPHIHEUHOKBTJK-LJQANCHMSA-N 2 0 365.468 2.829 20 10 FFCDRP CCOC(=O)[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305831 1035427595 /nfs/dbraw/zinc/42/75/95/1035427595.db2.gz IAEXHPGHFAUBCV-FQEVSTJZSA-N 2 0 373.541 2.994 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C(C)C)[C@H]3CCN(C(C)=O)C3)cc2)CC1 ZINC001140309550 1035429371 /nfs/dbraw/zinc/42/93/71/1035429371.db2.gz LFEPLJVDFDFURC-QFIPXVFZSA-N 2 0 372.557 2.660 20 10 FFCDRP CCN(CC)c1ccc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001140857286 1036294846 /nfs/dbraw/zinc/29/48/46/1036294846.db2.gz OJNUDRRLZDHHRP-UHFFFAOYSA-N 2 0 374.573 2.698 20 10 FFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cccc(I)c1[O-] ZINC001235717145 1037708710 /nfs/dbraw/zinc/70/87/10/1037708710.db2.gz FKEYFWSOQRJQHN-UHFFFAOYSA-N 2 0 374.266 2.818 20 10 FFCDRP Clc1ccc([C@@H]2C[NH2+]CCN2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235816355 1037763593 /nfs/dbraw/zinc/76/35/93/1037763593.db2.gz RXYQKDWXLCFFAJ-NRFANRHFSA-N 2 0 370.928 2.896 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001235935351 1037843888 /nfs/dbraw/zinc/84/38/88/1037843888.db2.gz UCKJHDXUUITWRH-QGZVFWFLSA-N 2 0 355.457 2.930 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@H](N3CC(C[NH3+])C3)C2)cc1 ZINC001236078733 1037919562 /nfs/dbraw/zinc/91/95/62/1037919562.db2.gz JPHDZRQGEYMGAW-JOCHJYFZSA-N 2 0 352.526 2.949 20 10 FFCDRP [NH3+]C1CN([C@H]2CCC[N@H+](Cc3ccc(OCc4ccccc4)cc3O)C2)C1 ZINC001236077621 1037921126 /nfs/dbraw/zinc/92/11/26/1037921126.db2.gz JCCQJIWEADDNHT-FQEVSTJZSA-N 2 0 367.493 2.579 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C[C@H]3CCC[NH2+]C3)C3CC3)cc2)CC1 ZINC001236599661 1038148229 /nfs/dbraw/zinc/14/82/29/1038148229.db2.gz USOHISQHHILCSQ-FQEVSTJZSA-N 3 0 356.558 2.793 20 10 FFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)C2CC[NH2+]CC2)c(OC)c1 ZINC001236911318 1038350539 /nfs/dbraw/zinc/35/05/39/1038350539.db2.gz BVPYZNWBQAKBPQ-UHFFFAOYSA-N 2 0 362.562 2.657 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCO)Cc3ccccc3)c(F)c2)CC1 ZINC001236931282 1038363898 /nfs/dbraw/zinc/36/38/98/1038363898.db2.gz IQOJNUXOLLKERE-UHFFFAOYSA-N 2 0 357.473 2.572 20 10 FFCDRP c1ccc(N2C[C@H]3C[NH+](Cc4ccc(N5CC[NH2+]CC5)cc4)C[C@@H]3C2)cc1 ZINC001237036844 1038415299 /nfs/dbraw/zinc/41/52/99/1038415299.db2.gz DQGTUDPWVALXHY-NHCUHLMSSA-N 2 0 362.521 2.664 20 10 FFCDRP CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C1)[NH+](C)C ZINC001264486791 1042693570 /nfs/dbraw/zinc/69/35/70/1042693570.db2.gz GHDBIGYCGUPDPC-OTWHNJEPSA-N 2 0 361.530 2.718 20 10 FFCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](n2cncn2)C1 ZINC001333594635 1048995600 /nfs/dbraw/zinc/99/56/00/1048995600.db2.gz CFPQQBIDTDLPPJ-DUXKGJEZSA-N 2 0 368.529 2.549 20 10 FFCDRP CC(C)C[NH+]1CCC(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC001304768024 1051689852 /nfs/dbraw/zinc/68/98/52/1051689852.db2.gz JSUFZSGGFOGVBA-NRFANRHFSA-N 2 0 374.573 2.840 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769724 1051690052 /nfs/dbraw/zinc/69/00/52/1051690052.db2.gz ZFVHTKKODYQKHE-LEWJYISDSA-N 2 0 372.557 2.879 20 10 FFCDRP CN(C)c1ccc(C[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1F ZINC001461149690 1061224609 /nfs/dbraw/zinc/22/46/09/1061224609.db2.gz MWHPNPWHJZVBDA-NRFANRHFSA-N 2 0 370.516 2.970 20 10 FFCDRP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155739734 509062708 /nfs/dbraw/zinc/06/27/08/509062708.db2.gz LTYBGQVKVVOBCE-CZUORRHYSA-N 2 0 370.335 2.831 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC2CC[NH+](C)CC2)C1 ZINC000443922212 514073121 /nfs/dbraw/zinc/07/31/21/514073121.db2.gz NYXJREVNOMZQND-UHFFFAOYSA-N 2 0 368.525 2.618 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391139 738135893 /nfs/dbraw/zinc/13/58/93/738135893.db2.gz SWKFEMZFDMTBCV-LFVTVUPYSA-N 2 0 356.869 2.754 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)c1O ZINC000817973244 742225543 /nfs/dbraw/zinc/22/55/43/742225543.db2.gz RNWZUHGBUMAJGM-BXUZGUMPSA-N 2 0 365.827 2.841 20 10 FFCDRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3cc(Br)ccc3O)CC2)C1 ZINC000841104136 747270319 /nfs/dbraw/zinc/27/03/19/747270319.db2.gz OIRDJZAWGGWMHF-DOTOQJQBSA-N 2 0 369.303 2.873 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000840759667 972960574 /nfs/dbraw/zinc/96/05/74/972960574.db2.gz ZTVNWQMKRAVLJQ-SNRMKQJTSA-N 2 0 365.468 2.764 20 10 FFCDRP CC(C)CC(=O)N1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000877773943 1014720939 /nfs/dbraw/zinc/72/09/39/1014720939.db2.gz BIRIOMODTBOCSP-UHFFFAOYSA-N 2 0 372.557 2.519 20 10 FFCDRP CN(Cc1ccnn1-c1cc[nH+]cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000825509315 997405910 /nfs/dbraw/zinc/40/59/10/997405910.db2.gz ICGQYTOVFYQHOH-UHFFFAOYSA-N 2 0 351.454 2.844 20 10 FFCDRP Cc1cc(N2CC[NH+](Cc3c(O)cc(O)cc3O)CC2)c2ccccc2[nH+]1 ZINC001144500505 998608785 /nfs/dbraw/zinc/60/87/85/998608785.db2.gz VEPRZKMNQGFSJQ-UHFFFAOYSA-N 2 0 365.433 2.982 20 10 FFCDRP CN(Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873304 1016280145 /nfs/dbraw/zinc/28/01/45/1016280145.db2.gz GQWTVYWQLYXILH-FQEVSTJZSA-N 2 0 368.529 2.825 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3COc4ccccc4C3)cc2)CC1 ZINC001199037650 1004817251 /nfs/dbraw/zinc/81/72/51/1004817251.db2.gz BQQJTVNRSYOVAF-LJQANCHMSA-N 2 0 351.494 2.779 20 10 FFCDRP Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000775654549 1004963399 /nfs/dbraw/zinc/96/33/99/1004963399.db2.gz LOXMJICUOAJZJB-SFHVURJKSA-N 2 0 355.486 2.509 20 10 FFCDRP CCN(CC)C(=O)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775664366 1004998054 /nfs/dbraw/zinc/99/80/54/1004998054.db2.gz MNEBLZUAYMHVTN-UHFFFAOYSA-N 2 0 372.557 2.519 20 10 FFCDRP CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667263 1005013291 /nfs/dbraw/zinc/01/32/91/1005013291.db2.gz GWLNLFNANBZWOC-FQEVSTJZSA-N 2 0 372.557 2.567 20 10 FFCDRP Fc1cc(C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)ccc1N1CCOCC1 ZINC000850035126 1005780237 /nfs/dbraw/zinc/78/02/37/1005780237.db2.gz VFJQVDGEABGENI-UHFFFAOYSA-N 2 0 367.428 2.533 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN[C@H]3CC[N@@H+](C4CCCCC4)C3)cc2)CC1 ZINC000850382275 1005812135 /nfs/dbraw/zinc/81/21/35/1005812135.db2.gz QKNPIXGBANOTCK-FQEVSTJZSA-N 2 0 356.558 2.935 20 10 FFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3ccc(N(C)C)c(F)c3)CC2)CC1 ZINC000817414381 1007592190 /nfs/dbraw/zinc/59/21/90/1007592190.db2.gz XUQFWQIBPKITER-UHFFFAOYSA-N 2 0 362.537 2.884 20 10 FFCDRP C[C@@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000817972018 1007835680 /nfs/dbraw/zinc/83/56/80/1007835680.db2.gz JGHLGJCABLZYHA-ACJLOTCBSA-N 2 0 371.447 2.758 20 10 FFCDRP COc1cccc([C@@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)OC)c1 ZINC000858204673 1008324400 /nfs/dbraw/zinc/32/44/00/1008324400.db2.gz QULHMTPWSFEPOO-JOCHJYFZSA-N 2 0 369.509 2.924 20 10 FFCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@@H]1CCC[NH2+]CC1 ZINC001206598468 1032357796 /nfs/dbraw/zinc/35/77/96/1032357796.db2.gz KHOQRYRKPSLMTO-LJQANCHMSA-N 3 0 362.537 2.930 20 10 FFCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn1 ZINC000840907213 1029917797 /nfs/dbraw/zinc/91/77/97/1029917797.db2.gz AWKBZETXSMCIQC-UHFFFAOYSA-N 2 0 351.498 2.607 20 10 FFCDRP NC(=O)C1CC[NH+](Cc2ccc(C[NH2+]Cc3cc(F)ccc3O)cc2)CC1 ZINC000840973987 1029955720 /nfs/dbraw/zinc/95/57/20/1029955720.db2.gz YYOBPFSVFYYJRR-UHFFFAOYSA-N 2 0 371.456 2.518 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](n3cc(C[NH3+])nn3)C2)cc1F ZINC000841099724 1030035186 /nfs/dbraw/zinc/03/51/86/1030035186.db2.gz NZUDNHFZWABVQP-QGZVFWFLSA-N 2 0 360.481 2.559 20 10 FFCDRP C[C@H](CC[NH+](C)C)C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353238 1031702448 /nfs/dbraw/zinc/70/24/48/1031702448.db2.gz CRRRYPYBVMVUCF-PBHICJAKSA-N 2 0 367.921 2.714 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3cccc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139261110 1035032851 /nfs/dbraw/zinc/03/28/51/1035032851.db2.gz UTJWCAXESBDPTQ-SFHVURJKSA-N 2 0 371.481 2.819 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1c1ccccc1 ZINC001139409604 1035093506 /nfs/dbraw/zinc/09/35/06/1035093506.db2.gz MYZRARGHCDTYLI-QHCPKHFHSA-N 2 0 364.537 2.927 20 10 FFCDRP CCOC(=O)[C@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139410970 1035095718 /nfs/dbraw/zinc/09/57/18/1035095718.db2.gz OAZBNVKWSPQZMG-OAQYLSRUSA-N 2 0 359.514 2.604 20 10 FFCDRP CC(C)C(=O)N(C)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139411453 1035095780 /nfs/dbraw/zinc/09/57/80/1035095780.db2.gz MUJUOOJMMRISEQ-UHFFFAOYSA-N 2 0 372.557 2.517 20 10 FFCDRP CCOC(=O)CC1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140302006 1035425092 /nfs/dbraw/zinc/42/50/92/1035425092.db2.gz HEUBBRCOGBAMCF-UHFFFAOYSA-N 2 0 373.541 2.994 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc(=O)[nH]c4CC3)cc2)CC1 ZINC001140305567 1035427499 /nfs/dbraw/zinc/42/74/99/1035427499.db2.gz CJDKNMAYVOWFOB-UHFFFAOYSA-N 2 0 366.509 2.530 20 10 FFCDRP CN(C)c1ccc(/C=C\C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052747 1035494546 /nfs/dbraw/zinc/49/45/46/1035494546.db2.gz HIESVNJOSZHDHE-QJKPHDSHSA-N 2 0 356.558 2.866 20 10 FFCDRP COc1cc(O)c(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)cc1Cl ZINC001232271136 1035541722 /nfs/dbraw/zinc/54/17/22/1035541722.db2.gz OBRVRDWVTIPRJY-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP COC(=O)c1c(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c2ccccc2n1C ZINC001232406536 1035656346 /nfs/dbraw/zinc/65/63/46/1035656346.db2.gz XPQZENZIVPBGFX-UHFFFAOYSA-N 2 0 355.482 2.883 20 10 FFCDRP C[NH+](C)CCN1CC[NH+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001231466292 1037614059 /nfs/dbraw/zinc/61/40/59/1037614059.db2.gz QCWBEORSTQBNMN-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cc(N)ccc4C3)cc2)CC1 ZINC001236105917 1037934361 /nfs/dbraw/zinc/93/43/61/1037934361.db2.gz XIYZMKXZDJMREU-UHFFFAOYSA-N 2 0 350.510 2.969 20 10 FFCDRP Oc1cc2c(cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376954 1038059677 /nfs/dbraw/zinc/05/96/77/1038059677.db2.gz XKMMSBXJWORDMS-INIZCTEOSA-N 2 0 359.514 2.618 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN([C@@H]3CC[NH2+]C3)C3CCCCC3)cc2)CC1 ZINC001236654172 1038174992 /nfs/dbraw/zinc/17/49/92/1038174992.db2.gz TXWJWYRXPJVLHR-JOCHJYFZSA-N 2 0 356.558 2.935 20 10 FFCDRP COc1ccc2ccc(O)c(CN(CC[NH+](C)C)[C@H]3CCC[NH2+]C3)c2c1 ZINC001236931444 1038364044 /nfs/dbraw/zinc/36/40/44/1038364044.db2.gz HCFIOLQREYVCQB-KRWDZBQOSA-N 2 0 357.498 2.670 20 10 FFCDRP Cc1ccccc1OC[C@H](O)C[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001251742518 1039282091 /nfs/dbraw/zinc/28/20/91/1039282091.db2.gz HCWIILSLEHXWHJ-HXUWFJFHSA-N 2 0 370.493 2.695 20 10 FFCDRP COc1ccc(O)c(C[NH+]2CCC3(CCC[N@H+](CCN(C)C)C3)CC2)c1 ZINC001278572022 1041219799 /nfs/dbraw/zinc/21/97/99/1041219799.db2.gz ZRFVOPYLWBFKPN-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@@H]2C1 ZINC001333890609 1049158840 /nfs/dbraw/zinc/15/88/40/1049158840.db2.gz FGCAMXYRLNGRDJ-IRFCIJBXSA-N 2 0 357.542 2.810 20 10 FFCDRP CCc1cccc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)c1O ZINC000848910456 1055348820 /nfs/dbraw/zinc/34/88/20/1055348820.db2.gz JJFNJAUYZNCCSP-UHFFFAOYSA-N 2 0 373.541 2.769 20 10 FFCDRP CCC[NH2+][C@H](C)C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551309 1078375940 /nfs/dbraw/zinc/37/59/40/1078375940.db2.gz OSIAMALYUUOUDH-CJNGLKHVSA-N 2 0 353.894 2.514 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(-c4ccccn4)n[nH]3)cc2)CC1 ZINC001560571511 1076280651 /nfs/dbraw/zinc/28/06/51/1076280651.db2.gz WMRMQZWXGRDCSR-UHFFFAOYSA-N 2 0 362.481 2.513 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+]C3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000237270606 509607785 /nfs/dbraw/zinc/60/77/85/509607785.db2.gz NRJIGCKVQMOUID-UHFFFAOYSA-N 2 0 374.573 2.670 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000375786516 512506579 /nfs/dbraw/zinc/50/65/79/512506579.db2.gz MSVKTZYLUJLQNL-YZGWKJHDSA-N 2 0 361.505 2.749 20 10 FFCDRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000858127165 730417223 /nfs/dbraw/zinc/41/72/23/730417223.db2.gz BJHKMUNHABORMV-UHFFFAOYSA-N 2 0 370.335 2.518 20 10 FFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000858126329 730417241 /nfs/dbraw/zinc/41/72/41/730417241.db2.gz XWXAGPJSVKXFIP-CQSZACIVSA-N 2 0 370.335 2.518 20 10 FFCDRP C[C@@H]([NH2+]CCCCCN1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000925843987 738535447 /nfs/dbraw/zinc/53/54/47/738535447.db2.gz HQVPQBJJEUXCJU-CQSZACIVSA-N 2 0 370.335 2.881 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@H](C)C1 ZINC000894256422 734825902 /nfs/dbraw/zinc/82/59/02/734825902.db2.gz QIASBHGHTJGSMA-AEFFLSMTSA-N 2 0 350.503 2.936 20 10 FFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817888577 742220928 /nfs/dbraw/zinc/22/09/28/742220928.db2.gz MRHPUKUSHHMEHT-GUYCJALGSA-N 2 0 357.420 2.759 20 10 FFCDRP COC(=O)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1F ZINC000895607621 970782816 /nfs/dbraw/zinc/78/28/16/970782816.db2.gz RPMPUBXBHRAYCU-UHFFFAOYSA-N 2 0 371.456 2.654 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)CC1 ZINC000872733315 1013253394 /nfs/dbraw/zinc/25/33/94/1013253394.db2.gz URIMUWXRAVLKDL-UHFFFAOYSA-N 2 0 361.530 2.607 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc([C@H]4CCC[NH2+]4)cn3)cc2)CC1 ZINC001167422801 963010098 /nfs/dbraw/zinc/01/00/98/963010098.db2.gz BURRKEKJSVFSAC-HXUWFJFHSA-N 2 0 351.498 2.870 20 10 FFCDRP COc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Cn1cccn1 ZINC000873115131 1013390628 /nfs/dbraw/zinc/39/06/28/1013390628.db2.gz HASWRQZVOCDHIP-UHFFFAOYSA-N 2 0 354.498 2.904 20 10 FFCDRP C[C@H]1C[C@H]([NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c2c1c(F)ccc2O ZINC000873243048 1013442530 /nfs/dbraw/zinc/44/25/30/1013442530.db2.gz IVAJWEQKDLQFEG-SJCJKPOMSA-N 2 0 367.428 2.909 20 10 FFCDRP COC(=O)c1c(CNC[C@H]2CC[N@@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172203 978098723 /nfs/dbraw/zinc/09/87/23/978098723.db2.gz DPNIQKTZBBWVTI-CYBMUJFWSA-N 2 0 359.445 2.678 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(Br)c1 ZINC001206024983 1032111559 /nfs/dbraw/zinc/11/15/59/1032111559.db2.gz LWBYVGJYWDBUOY-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP CC(C)[C@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388497 988534873 /nfs/dbraw/zinc/53/48/73/988534873.db2.gz FGMYHSSWSVYOKW-VBSBHUPXSA-N 2 0 367.484 2.600 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC(C)([NH+]4CCC4)CC3)cc2)CC1 ZINC000922844627 988953321 /nfs/dbraw/zinc/95/33/21/988953321.db2.gz HJDFJGPIWFBROM-UHFFFAOYSA-N 3 0 356.558 2.935 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](CO)(c4ccccc4)C3)cc2)CC1 ZINC000812781455 995532372 /nfs/dbraw/zinc/53/23/72/995532372.db2.gz UXXHEWNCXIRDIW-HSZRJFAPSA-N 2 0 365.521 2.574 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@H](c4ccncc4)C3)cc2)CC1 ZINC000824955698 997157562 /nfs/dbraw/zinc/15/75/62/997157562.db2.gz YOBNHAVZSKAMEY-IRLDBZIGSA-N 2 0 366.509 2.843 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1C ZINC001085202192 999153713 /nfs/dbraw/zinc/15/37/13/999153713.db2.gz RJQBQRKXSOLIQQ-VBSBHUPXSA-N 2 0 373.541 2.861 20 10 FFCDRP Cc1csc(N2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000775653012 1004959465 /nfs/dbraw/zinc/95/94/65/1004959465.db2.gz ZLPBUSJBIXISLO-UHFFFAOYSA-N 2 0 371.554 2.526 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3c(C4CC4)cnn3C)cc2F)CC1 ZINC000850126212 1005788121 /nfs/dbraw/zinc/78/81/21/1005788121.db2.gz MHDGQLFSSWRBQU-UHFFFAOYSA-N 2 0 371.504 2.868 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850508385 1005819180 /nfs/dbraw/zinc/81/91/80/1005819180.db2.gz MDKVNYWUFAYXMF-YJBOKZPZSA-N 2 0 356.466 2.818 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCN(c4ccccc4F)C3)cc2)CC1 ZINC000813791420 1006039685 /nfs/dbraw/zinc/03/96/85/1006039685.db2.gz CWOBCRHFLFBMRB-IBGZPJMESA-N 2 0 368.500 2.946 20 10 FFCDRP CCOC(=O)[C@]1(C(C)C)CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775199884 1006735130 /nfs/dbraw/zinc/73/51/30/1006735130.db2.gz HEUBRONNNXPHRC-JOCHJYFZSA-N 2 0 373.541 2.850 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902532 1007804626 /nfs/dbraw/zinc/80/46/26/1007804626.db2.gz SPRADVLULSFUEL-CEWLAPEOSA-N 3 0 374.548 2.978 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555304 1007884802 /nfs/dbraw/zinc/88/48/02/1007884802.db2.gz ZLCONSAGUCNOAL-IBGZPJMESA-N 2 0 371.481 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCN3CCc4ccccc43)cc2)CC1 ZINC001177175305 1008519222 /nfs/dbraw/zinc/51/92/22/1008519222.db2.gz GUCRUFRVCNCXIC-UHFFFAOYSA-N 2 0 364.537 2.981 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3c(F)cccc3F)cc2)CC1 ZINC000886215174 1008603180 /nfs/dbraw/zinc/60/31/80/1008603180.db2.gz FMPUOKUITBWMOT-LJQANCHMSA-N 2 0 361.436 2.540 20 10 FFCDRP Fc1cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)ccc1N1CCOCC1 ZINC000925480694 1017763841 /nfs/dbraw/zinc/76/38/41/1017763841.db2.gz MZCAQGGMCHVBLM-ICSRJNTNSA-N 2 0 361.505 2.920 20 10 FFCDRP CC1(C)[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925505973 1017770072 /nfs/dbraw/zinc/77/00/72/1017770072.db2.gz UPRUVCGSELUVSO-QHAWAJNXSA-N 2 0 357.542 2.762 20 10 FFCDRP FC(F)Oc1ccc(N2CCC([NH2+][C@H]3[C@@H]4[NH2+]C[C@@H]5C[C@H]3C[C@@H]54)CC2)cc1 ZINC000925577442 1017793093 /nfs/dbraw/zinc/79/30/93/1017793093.db2.gz OQQOKVHIWUUKQV-WIOUJZMWSA-N 2 0 363.452 2.843 20 10 FFCDRP C[C@@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc2c(cc1O)CCCC2 ZINC000925855604 1017877921 /nfs/dbraw/zinc/87/79/21/1017877921.db2.gz LAHPXTVNWMQQKS-RHSMWYFYSA-N 2 0 358.482 2.607 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4ccccc4OC3)cc2)CC1 ZINC000800889580 1020630031 /nfs/dbraw/zinc/63/00/31/1020630031.db2.gz QURJYXPBMJURTQ-FQEVSTJZSA-N 2 0 351.494 2.922 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCCC[NH2+]4)C3)c(F)c2)CC1 ZINC001222394795 1032936841 /nfs/dbraw/zinc/93/68/41/1032936841.db2.gz BDRDGXGFYMPTHR-OAQYLSRUSA-N 2 0 360.521 2.686 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547800 1023727074 /nfs/dbraw/zinc/72/70/74/1023727074.db2.gz HPKIXVTXZCIKCG-MAUKXSAKSA-N 2 0 359.514 2.509 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+]C1CCN(C2CC2)CC1 ZINC000838983210 1026557978 /nfs/dbraw/zinc/55/79/78/1026557978.db2.gz ZELPOOBOTLRWBB-UHFFFAOYSA-N 2 0 368.569 2.935 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cc1 ZINC000092426230 1027314080 /nfs/dbraw/zinc/31/40/80/1027314080.db2.gz UHUJZZGIPWTWDS-UHFFFAOYSA-N 2 0 374.573 2.669 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)cc1 ZINC000843058450 1031166830 /nfs/dbraw/zinc/16/68/30/1031166830.db2.gz SLJCAKOKHUPWLK-PZJWPPBQSA-N 2 0 372.557 2.613 20 10 FFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205582048 1031851135 /nfs/dbraw/zinc/85/11/35/1031851135.db2.gz WHGHKZLSXZNJCL-GOSISDBHSA-N 2 0 355.885 2.830 20 10 FFCDRP Nc1ccc(N(C(=O)[C@H]([NH3+])CCC[NH3+])c2ccc3ccccc3c2N)cc1 ZINC001219471363 1033659751 /nfs/dbraw/zinc/65/97/51/1033659751.db2.gz BVLRJRNSDXRTBH-GOSISDBHSA-N 2 0 363.465 2.735 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)CC[C@H]([NH3+])CC2CCCCC2)cc1 ZINC000832282019 1034699302 /nfs/dbraw/zinc/69/93/02/1034699302.db2.gz XHMAOAZMUGFFHI-ICSRJNTNSA-N 2 0 360.546 2.947 20 10 FFCDRP CC(C)c1nc(CC[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)no1 ZINC001139408650 1035092554 /nfs/dbraw/zinc/09/25/54/1035092554.db2.gz OHVIFCOHEBENAH-UHFFFAOYSA-N 2 0 357.502 2.619 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@](O)(C(F)(F)F)C3)cc2)CC1 ZINC001139407700 1035092599 /nfs/dbraw/zinc/09/25/99/1035092599.db2.gz AUDJPTWFFOJKSR-SFHVURJKSA-N 2 0 371.447 2.718 20 10 FFCDRP COC(=O)c1cccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001139411113 1035095748 /nfs/dbraw/zinc/09/57/48/1035095748.db2.gz VRQRRLMOMDMZLH-UHFFFAOYSA-N 2 0 367.493 2.857 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3cnccn3)cc2)CC1 ZINC001140303789 1035426242 /nfs/dbraw/zinc/42/62/42/1035426242.db2.gz ASBIMFYEYSEKLE-NRFANRHFSA-N 2 0 351.498 2.956 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC([N@H+](C)C4CC4)CC3)cc2)CC1 ZINC001140306053 1035427712 /nfs/dbraw/zinc/42/77/12/1035427712.db2.gz MJDFVCCUBHJAQY-UHFFFAOYSA-N 2 0 356.558 2.887 20 10 FFCDRP Cc1c(O)ccc(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c1O ZINC001140744952 1036035431 /nfs/dbraw/zinc/03/54/31/1036035431.db2.gz QQJTUKMSMZESKJ-WIYYLYMNSA-N 2 0 360.498 2.587 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[NH2+]CC4)CC3)c(F)c2)CC1 ZINC001235131808 1037379204 /nfs/dbraw/zinc/37/92/04/1037379204.db2.gz CFKLWQSORKUSDQ-UHFFFAOYSA-N 2 0 360.521 2.543 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCCN(C[C@H]4CCCC[NH2+]4)C3)C2)cc1 ZINC001235494940 1037586155 /nfs/dbraw/zinc/58/61/55/1037586155.db2.gz UKDSXUBVDOECMR-DENIHFKCSA-N 2 0 373.541 2.756 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)cc2)CC1 ZINC001236599663 1038147888 /nfs/dbraw/zinc/14/78/88/1038147888.db2.gz USOHISQHHILCSQ-HXUWFJFHSA-N 3 0 356.558 2.793 20 10 FFCDRP CCc1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001236788992 1038271753 /nfs/dbraw/zinc/27/17/53/1038271753.db2.gz YUTTWUQRFZBSBD-UHFFFAOYSA-N 2 0 354.498 2.805 20 10 FFCDRP Cc1nc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)no1 ZINC001236933617 1038366021 /nfs/dbraw/zinc/36/60/21/1038366021.db2.gz YWIGKYWFRNEZJK-KRWDZBQOSA-N 2 0 373.476 2.649 20 10 FFCDRP COc1ccc(N2CC[NH+](C3CCC([NH+]4CCOCC4)CC3)CC2)c(C)c1 ZINC001256696563 1038606638 /nfs/dbraw/zinc/60/66/38/1038606638.db2.gz IFQOLDXBOMCVJT-UHFFFAOYSA-N 2 0 373.541 2.769 20 10 FFCDRP Oc1cc(O)c(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4ccc[nH]4)(C2)CCC3)c(O)c1 ZINC001278427935 1039226067 /nfs/dbraw/zinc/22/60/67/1039226067.db2.gz GQADRBBAKRCPNH-UXHICEINSA-N 2 0 357.454 2.856 20 10 FFCDRP Oc1ccc([C@@H](O)C[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255382895 1041311408 /nfs/dbraw/zinc/31/14/08/1041311408.db2.gz YDJYRHVAUKMVSE-RXVVDRJESA-N 2 0 356.466 2.776 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)COc2cccc(F)c2)CC1 ZINC001250828784 1041388245 /nfs/dbraw/zinc/38/82/45/1041388245.db2.gz MDLKTUURQNILRG-LJQANCHMSA-N 2 0 374.456 2.525 20 10 FFCDRP Cc1c(O)ccc(C[NH+]2CCC3(CCC[N@@H+](CCN(C)C)C3)CC2)c1O ZINC001279313073 1042995813 /nfs/dbraw/zinc/99/58/13/1042995813.db2.gz KLUUEYXBLJHUSU-UHFFFAOYSA-N 2 0 361.530 2.646 20 10 FFCDRP Cc1cc(O)c(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1Cl ZINC001279432435 1043106330 /nfs/dbraw/zinc/10/63/30/1043106330.db2.gz FMYPNOFMBOMAPO-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001237489342 1043202475 /nfs/dbraw/zinc/20/24/75/1043202475.db2.gz WRWINMWZXQMOMC-DENIHFKCSA-N 2 0 367.493 2.819 20 10 FFCDRP CCOc1ccc(C[NH+]2CCC3(CC[N@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001279672066 1043441179 /nfs/dbraw/zinc/44/11/79/1043441179.db2.gz LNRGCSVRTTZCKD-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP Cc1cc(F)cc(C[N@H+]2C[C@@H]3CC[NH+](Cc4cn[nH]c4)CC[C@@H]3C2)c1O ZINC001280033687 1044110162 /nfs/dbraw/zinc/11/01/62/1044110162.db2.gz QCATYTDABMGEMO-CALCHBBNSA-N 2 0 358.461 2.907 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)cc2F)CC1 ZINC001318620826 1044775840 /nfs/dbraw/zinc/77/58/40/1044775840.db2.gz HFWHVNXPYLAVOI-UHFFFAOYSA-N 2 0 362.537 2.976 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc([C@@H]4C[NH2+]CCO4)cc3)cc2)CC1 ZINC000849351940 1056836955 /nfs/dbraw/zinc/83/69/55/1056836955.db2.gz GAJWBOGTFQVCFS-QFIPXVFZSA-N 2 0 366.509 2.711 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)Nc1ccccc1 ZINC001473995119 1065436354 /nfs/dbraw/zinc/43/63/54/1065436354.db2.gz DAMIRUZDHRCJNO-KRWDZBQOSA-N 2 0 352.482 2.555 20 10 FFCDRP CC[C@@](C)(C[NH3+])C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948329 1078288512 /nfs/dbraw/zinc/28/85/12/1078288512.db2.gz IXVHPRVBRMPKRH-YJBOKZPZSA-N 2 0 353.894 2.501 20 10 FFCDRP C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560330040 1076264302 /nfs/dbraw/zinc/26/43/02/1076264302.db2.gz BJQIWQHDCXTWJO-AVRDEDQJSA-N 2 0 353.510 2.693 20 10 FFCDRP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155739386 509062410 /nfs/dbraw/zinc/06/24/10/509062410.db2.gz LTYBGQVKVVOBCE-BBRMVZONSA-N 2 0 370.335 2.831 20 10 FFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000121239984 509155415 /nfs/dbraw/zinc/15/54/15/509155415.db2.gz BETYFEZBCHWSLW-LJQANCHMSA-N 2 0 374.573 2.527 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c1O ZINC000187167744 510098126 /nfs/dbraw/zinc/09/81/26/510098126.db2.gz TVWAQDQTBLIKJS-KGLIPLIRSA-N 2 0 370.335 2.750 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@H](C)N2CC[NH+](C)CC2)c1O ZINC000187167779 510098042 /nfs/dbraw/zinc/09/80/42/510098042.db2.gz TVWAQDQTBLIKJS-KBPBESRZSA-N 2 0 370.335 2.750 20 10 FFCDRP Cc1cccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c1O ZINC000182202644 510812664 /nfs/dbraw/zinc/81/26/64/510812664.db2.gz NGGAJGLEHOSENP-HXUWFJFHSA-N 2 0 367.493 2.688 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000289183115 511094319 /nfs/dbraw/zinc/09/43/19/511094319.db2.gz AQSSAHHAJSCOHF-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc(Cl)ccc1O ZINC000925857981 738538295 /nfs/dbraw/zinc/53/82/95/738538295.db2.gz RCVGMZMILWBBCD-ZFWWWQNUSA-N 2 0 352.862 2.772 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000725846017 734395899 /nfs/dbraw/zinc/39/58/99/734395899.db2.gz UMFJXVVGZYUDFZ-KBPBESRZSA-N 2 0 355.276 2.880 20 10 FFCDRP CC(C)[NH+]1CCC(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC000891250704 962598076 /nfs/dbraw/zinc/59/80/76/962598076.db2.gz ZCPQGHWHCRPFMO-FQEVSTJZSA-N 2 0 360.546 2.592 20 10 FFCDRP C[NH+](C)/C=C/c1ccncc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167441939 963420851 /nfs/dbraw/zinc/42/08/51/963420851.db2.gz ZDXHIELTKUEGMI-PKNBQFBNSA-N 2 0 351.498 2.978 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(F)c(F)cc3[O-])(C1)CCC2 ZINC001279108650 963971236 /nfs/dbraw/zinc/97/12/36/963971236.db2.gz UWFYFZNYHAZFCT-MOPGFXCFSA-N 2 0 370.440 2.816 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895558225 970742336 /nfs/dbraw/zinc/74/23/36/970742336.db2.gz UGEAQJNPVPOZSQ-GOSISDBHSA-N 2 0 366.509 2.753 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(O)cc1Br ZINC001206025655 1032111749 /nfs/dbraw/zinc/11/17/49/1032111749.db2.gz OPQHEGFPEZRGIR-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879650586 1015626107 /nfs/dbraw/zinc/62/61/07/1015626107.db2.gz IKETWWAAGJMAIB-JENIJYKNSA-N 2 0 367.493 2.822 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)c3ccc(Cl)cc3)cc2)CC1 ZINC000808431671 994127912 /nfs/dbraw/zinc/12/79/12/994127912.db2.gz XFSSMTVTEZBQLF-IBGZPJMESA-N 2 0 373.928 2.958 20 10 FFCDRP COc1ccc(N2CC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000826844940 1016100446 /nfs/dbraw/zinc/10/04/46/1016100446.db2.gz CIYLZQFGIKEQGV-GOSISDBHSA-N 2 0 352.482 2.928 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@](C)(O)c1ccccc1 ZINC000846036456 1000196428 /nfs/dbraw/zinc/19/64/28/1000196428.db2.gz JSTXPCZJNVHALT-GCJKJVERSA-N 2 0 353.510 2.824 20 10 FFCDRP CCOc1ccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c(O)c1 ZINC000769537527 1000544838 /nfs/dbraw/zinc/54/48/38/1000544838.db2.gz LPZGVLYLIRLGAG-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP CC(C)N(C)C(=O)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775656395 1004963551 /nfs/dbraw/zinc/96/35/51/1004963551.db2.gz SNUIZAMEBAPSSL-UHFFFAOYSA-N 2 0 372.557 2.517 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775662435 1004985832 /nfs/dbraw/zinc/98/58/32/1004985832.db2.gz XKAYQHDXTKCKTR-SFHVURJKSA-N 2 0 374.529 2.537 20 10 FFCDRP COc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc(OC)c1 ZINC000883284138 1006732804 /nfs/dbraw/zinc/73/28/04/1006732804.db2.gz FYWNGEPVDISDJA-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000817940702 1007818085 /nfs/dbraw/zinc/81/80/85/1007818085.db2.gz GXCOZLAVTIMJCC-FOIQADDNSA-N 2 0 354.498 2.805 20 10 FFCDRP CN(C)c1cc(F)c(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)cc1F ZINC000858153224 1008312601 /nfs/dbraw/zinc/31/26/01/1008312601.db2.gz IXDDJYFLANFEES-UHFFFAOYSA-N 2 0 361.440 2.790 20 10 FFCDRP COc1ccc(C[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC000390870202 1019896629 /nfs/dbraw/zinc/89/66/29/1019896629.db2.gz OOTNNFKXVUZQLX-UHFFFAOYSA-N 2 0 353.510 2.911 20 10 FFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1 ZINC001118006904 1022016091 /nfs/dbraw/zinc/01/60/91/1022016091.db2.gz PQUFAUKIQWACRV-ROUUACIJSA-N 2 0 373.541 2.635 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C[S@](C)=O)c3ccccc3)cc2)CC1 ZINC000780895455 1028852989 /nfs/dbraw/zinc/85/29/89/1028852989.db2.gz UOUJFVOWETWNRF-LVXARBLLSA-N 2 0 371.550 2.648 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000840948240 1029942095 /nfs/dbraw/zinc/94/20/95/1029942095.db2.gz FYCQHXPWCUFCFF-CBQGHPETSA-N 2 0 356.558 2.804 20 10 FFCDRP CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000840956284 1029944448 /nfs/dbraw/zinc/94/44/48/1029944448.db2.gz OYFUROZGHRWDMF-YADHBBJMSA-N 2 0 351.494 2.840 20 10 FFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(OC)c1O)C2 ZINC001203592676 1030776776 /nfs/dbraw/zinc/77/67/76/1030776776.db2.gz VSJMHQXZFBKCKC-NQIIRXRSSA-N 2 0 360.498 2.581 20 10 FFCDRP C[N@@H+]1C[C@@H](C[NH2+]Cc2ccc(N3CCOCC3)cc2)[C@H](c2ccccc2)C1 ZINC000842765052 1030948019 /nfs/dbraw/zinc/94/80/19/1030948019.db2.gz UCZRPHBQSQTBKK-GGAORHGYSA-N 2 0 365.521 2.958 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCc4cc(C[NH3+])ccc43)cc2)CC1 ZINC000843058578 1031165010 /nfs/dbraw/zinc/16/50/10/1031165010.db2.gz VLWIXIFCMYZSEK-UHFFFAOYSA-N 2 0 350.510 2.850 20 10 FFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001205591725 1031855842 /nfs/dbraw/zinc/85/58/42/1031855842.db2.gz OIRRZAWIFNGNPX-OAHLLOKOSA-N 2 0 350.356 2.986 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1O ZINC001205627464 1031884891 /nfs/dbraw/zinc/88/48/91/1031884891.db2.gz PQZLSFPWICTYQZ-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@@H]2C1 ZINC001138343245 1034174712 /nfs/dbraw/zinc/17/47/12/1034174712.db2.gz ZJOMQWAUYLTQIS-OALUTQOASA-N 2 0 355.526 2.865 20 10 FFCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@H]2C1 ZINC001138343254 1034175398 /nfs/dbraw/zinc/17/53/98/1034175398.db2.gz ZJOMQWAUYLTQIS-RTBURBONSA-N 2 0 355.526 2.865 20 10 FFCDRP C[N@H+](Cc1cccc(OCCN2CCOCC2)c1)Cc1ccccc1O ZINC001139764105 1035224901 /nfs/dbraw/zinc/22/49/01/1035224901.db2.gz FMIUBRUCZMWOFL-UHFFFAOYSA-N 2 0 356.466 2.735 20 10 FFCDRP C[C@@H](Cc1cnccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000834698437 1035431578 /nfs/dbraw/zinc/43/15/78/1035431578.db2.gz ZOAXBHGUGHFYEP-SFHVURJKSA-N 2 0 365.525 2.729 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)cc1O ZINC001233486426 1036656131 /nfs/dbraw/zinc/65/61/31/1036656131.db2.gz MSYSSWVMEWJXEL-UHFFFAOYSA-N 2 0 354.450 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3C[C@H]4c5ccccc5C[NH2+][C@@H]4C3)cc2)CC1 ZINC001235221917 1037422648 /nfs/dbraw/zinc/42/26/48/1037422648.db2.gz TUGPSTDRWSQXHH-XZOQPEGZSA-N 2 0 362.521 2.510 20 10 FFCDRP COc1cc2c(cc1OC)C[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001235718150 1037707116 /nfs/dbraw/zinc/70/71/16/1037707116.db2.gz FGRWNSXHSWWHBI-UHFFFAOYSA-N 2 0 367.493 2.672 20 10 FFCDRP COc1cccc(CCC[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2O)c1 ZINC001236043060 1037905888 /nfs/dbraw/zinc/90/58/88/1037905888.db2.gz UAKDJCNGFWNZHA-UHFFFAOYSA-N 2 0 369.509 2.875 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cc(N)ccc4C3)c(F)c2)CC1 ZINC001236104980 1037933465 /nfs/dbraw/zinc/93/34/65/1037933465.db2.gz DUJQPVUTYHDYFZ-UHFFFAOYSA-N 2 0 354.473 2.718 20 10 FFCDRP NC(=O)C1CC[NH+](C2CC[NH+](Cc3cc4ccccc4cc3O)CC2)CC1 ZINC001236835258 1038297906 /nfs/dbraw/zinc/29/79/06/1038297906.db2.gz FTXIIZRKKFEUQO-UHFFFAOYSA-N 2 0 367.493 2.707 20 10 FFCDRP COc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246172816 1039264866 /nfs/dbraw/zinc/26/48/66/1039264866.db2.gz IPKFINJDYDCHDT-LJQANCHMSA-N 2 0 351.494 2.752 20 10 FFCDRP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465263 1039474611 /nfs/dbraw/zinc/47/46/11/1039474611.db2.gz WHNDRRZDBQZLKO-JOCHJYFZSA-N 2 0 357.542 2.956 20 10 FFCDRP CCn1ccnc1CN1CC[C@H]2C[N@@H+](Cc3ccccc3O)C[C@H]2CC1 ZINC001278552532 1041120651 /nfs/dbraw/zinc/12/06/51/1041120651.db2.gz WZLCDRMIGNDZBA-HDICACEKSA-N 2 0 354.498 2.953 20 10 FFCDRP COc1cccc(C[NH+]2CCC3(CCC[N@H+](CCN(C)C)C3)CC2)c1O ZINC001278563214 1041182629 /nfs/dbraw/zinc/18/26/29/1041182629.db2.gz VHBAFFQYGFBYGY-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568746 1041204561 /nfs/dbraw/zinc/20/45/61/1041204561.db2.gz HUPQMYMWARPYIA-IYBDPMFKSA-N 2 0 368.905 2.810 20 10 FFCDRP Cc1ccc(C)c(C[NH+]2CCC3(C[NH+](CCn4ccnc4)C3)CC2)c1O ZINC001279235229 1042959048 /nfs/dbraw/zinc/95/90/48/1042959048.db2.gz NAOSVESWJSCWOS-UHFFFAOYSA-N 2 0 354.498 2.804 20 10 FFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cc(C(F)(F)F)ccc1O ZINC001279686050 1043467277 /nfs/dbraw/zinc/46/72/77/1043467277.db2.gz LVESWQGNHUOOHP-HOTGVXAUSA-N 2 0 357.420 2.621 20 10 FFCDRP CC[NH+](CC)CCN(C)C(=O)C12CC([NH2+]Cc3ccc(C)cc3O)(C1)C2 ZINC001280046338 1044132918 /nfs/dbraw/zinc/13/29/18/1044132918.db2.gz JKTIIUWAXPEKMD-UHFFFAOYSA-N 2 0 359.514 2.513 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@@H](O)c1ccccc1 ZINC001329836870 1048932465 /nfs/dbraw/zinc/93/24/65/1048932465.db2.gz YROIZRHEFKQYER-IIBYNOLFSA-N 2 0 357.473 2.789 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCC[N@@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769726 1051690285 /nfs/dbraw/zinc/69/02/85/1051690285.db2.gz ZFVHTKKODYQKHE-RTWAWAEBSA-N 2 0 372.557 2.879 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CC[C@@H](Oc4ccncc4)C3)cc2F)CC1 ZINC001344074107 1052580272 /nfs/dbraw/zinc/58/02/72/1052580272.db2.gz BCTCKLXIVYUQNK-LJQANCHMSA-N 2 0 370.472 2.626 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(CN2CC[NH2+]CC2)cc1 ZINC001579616661 1078650917 /nfs/dbraw/zinc/65/09/17/1078650917.db2.gz CTUUPAFEKPGYQG-UHFFFAOYSA-N 2 0 352.526 2.756 20 10 FFCDRP CC(C)[C@@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[NH+]1CCCCC1 ZINC001558723821 1076063502 /nfs/dbraw/zinc/06/35/02/1076063502.db2.gz WIZIHRLOEUPOQX-RTWAWAEBSA-N 2 0 374.573 2.982 20 10 FFCDRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001560985551 1076316737 /nfs/dbraw/zinc/31/67/37/1076316737.db2.gz FIBMVZFBBZWJQJ-FBBABVLZSA-N 2 0 373.541 2.896 20 10 FFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000186590832 509788719 /nfs/dbraw/zinc/78/87/19/509788719.db2.gz GHHHDOIYZUUVPR-ZIAGYGMSSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1 ZINC000186060273 509504665 /nfs/dbraw/zinc/50/46/65/509504665.db2.gz HETAUWKESPSPEE-INIZCTEOSA-N 2 0 355.482 2.843 20 10 FFCDRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1O ZINC000183503969 509831307 /nfs/dbraw/zinc/83/13/07/509831307.db2.gz OPKVOEGOMNDLBM-LPHOPBHVSA-N 2 0 367.493 2.940 20 10 FFCDRP OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297592586 511000774 /nfs/dbraw/zinc/00/07/74/511000774.db2.gz HQQNLENNUUCNLM-XUVXKRRUSA-N 2 0 352.478 2.852 20 10 FFCDRP CC[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000274941525 511994594 /nfs/dbraw/zinc/99/45/94/511994594.db2.gz SXAJECOVRTVYCV-UKRRQHHQSA-N 2 0 357.292 2.652 20 10 FFCDRP CC(C)(O)C[NH+]1CCC([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC000876944137 732300930 /nfs/dbraw/zinc/30/09/30/732300930.db2.gz ZXVDUPMOWXNSBN-UHFFFAOYSA-N 2 0 363.571 2.565 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000725849329 734396328 /nfs/dbraw/zinc/39/63/28/734396328.db2.gz KNUNCRHANJIZNF-LBPRGKRZSA-N 2 0 357.292 2.983 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3OCCc4sccc43)cc2)CC1 ZINC000922438109 738145157 /nfs/dbraw/zinc/14/51/57/738145157.db2.gz QABUWVAPQSRYGZ-LJQANCHMSA-N 2 0 357.523 2.904 20 10 FFCDRP CCN(CC)c1ccc(C[N@H+](C)CCCN2CC[NH+](C)CC2)cc1F ZINC000809743562 741339324 /nfs/dbraw/zinc/33/93/24/741339324.db2.gz VMFXXGTZMWAZQT-UHFFFAOYSA-N 2 0 350.526 2.741 20 10 FFCDRP Cc1cc(O)c(C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825916455 743342979 /nfs/dbraw/zinc/34/29/79/743342979.db2.gz ORDKQUNWGYPIFT-KRWDZBQOSA-N 2 0 351.922 2.954 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H]3OCCC[C@@H]3[NH3+])CC2)c1O ZINC000841099874 747269088 /nfs/dbraw/zinc/26/90/88/747269088.db2.gz PTGNWCIPQXVQRW-YJBOKZPZSA-N 2 0 354.878 2.773 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)cc1 ZINC000873218477 1013430402 /nfs/dbraw/zinc/43/04/02/1013430402.db2.gz HRKFDNUWBPOAOJ-UHFFFAOYSA-N 2 0 364.497 2.862 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000877643622 1014659136 /nfs/dbraw/zinc/65/91/36/1014659136.db2.gz LKORYPVVNRFNGC-FQEVSTJZSA-N 2 0 357.542 2.859 20 10 FFCDRP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729683851 981289100 /nfs/dbraw/zinc/28/91/00/981289100.db2.gz CZGJPPKYLKUJBT-IBGZPJMESA-N 2 0 367.493 2.736 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnn(CC4CCC4)c3)cc2)CC1 ZINC000922332339 988426108 /nfs/dbraw/zinc/42/61/08/988426108.db2.gz DMJBLSMYONVQJA-UHFFFAOYSA-N 2 0 353.514 2.725 20 10 FFCDRP CCOC(=O)N1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001169645688 1000065649 /nfs/dbraw/zinc/06/56/49/1000065649.db2.gz AWCUWYRKPLYXLO-LJQANCHMSA-N 2 0 374.529 2.539 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205601770 1004166383 /nfs/dbraw/zinc/16/63/83/1004166383.db2.gz GGJUQYJJIIDQBK-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(Br)c1 ZINC001205654890 1004668750 /nfs/dbraw/zinc/66/87/50/1004668750.db2.gz XZRQWSXLBAELNQ-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(C[NH2+]CCCN2CCC[N@H+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850118835 1005787416 /nfs/dbraw/zinc/78/74/16/1005787416.db2.gz KERBFGHRLAENTF-UHFFFAOYSA-N 2 0 363.546 2.816 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000850344492 1005808935 /nfs/dbraw/zinc/80/89/35/1005808935.db2.gz KMFSXTDQILOEKM-UHFFFAOYSA-N 2 0 373.541 2.504 20 10 FFCDRP Cn1cc(C[C@@H]2CCC[C@@H]2[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000850384899 1005812228 /nfs/dbraw/zinc/81/22/28/1005812228.db2.gz SRQZLUYODRJSHU-UNMCSNQZSA-N 2 0 367.541 2.673 20 10 FFCDRP Cc1cc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)ccc1N(C)C ZINC000815092500 1006516064 /nfs/dbraw/zinc/51/60/64/1006516064.db2.gz ISIIGGONGXXWBL-UHFFFAOYSA-N 2 0 358.574 2.911 20 10 FFCDRP CC(=O)Nc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000883284799 1006732704 /nfs/dbraw/zinc/73/27/04/1006732704.db2.gz XNFITYKUSCMQSO-UHFFFAOYSA-N 2 0 352.482 2.687 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883290208 1006735614 /nfs/dbraw/zinc/73/56/14/1006735614.db2.gz OBHUNQYLCFVABN-HNNXBMFYSA-N 2 0 369.469 2.780 20 10 FFCDRP CC(=O)N(C)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000858249970 1008332961 /nfs/dbraw/zinc/33/29/61/1008332961.db2.gz FGLNWMFPPLYSKI-UHFFFAOYSA-N 2 0 366.509 2.711 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(F)c1OC ZINC000886185817 1008598533 /nfs/dbraw/zinc/59/85/33/1008598533.db2.gz ISDYPMHGWRHLJS-UHFFFAOYSA-N 2 0 373.472 2.885 20 10 FFCDRP C[C@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc2c(cc1O)CCCC2 ZINC000925855607 1017877253 /nfs/dbraw/zinc/87/72/53/1017877253.db2.gz LAHPXTVNWMQQKS-YOEHRIQHSA-N 2 0 358.482 2.607 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222173537 1032801573 /nfs/dbraw/zinc/80/15/73/1032801573.db2.gz UPSGPZOKFZGAAO-NRFANRHFSA-N 2 0 360.498 2.854 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222173538 1032802215 /nfs/dbraw/zinc/80/22/15/1032802215.db2.gz UPSGPZOKFZGAAO-OAQYLSRUSA-N 2 0 360.498 2.854 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C(=O)Nc4ccccc4)CC3)cc2)CC1 ZINC000778218117 1021135078 /nfs/dbraw/zinc/13/50/78/1021135078.db2.gz OLSAWYZBENRTAI-UHFFFAOYSA-N 2 0 364.493 2.699 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001122414013 1023253520 /nfs/dbraw/zinc/25/35/20/1023253520.db2.gz ITNDQLOPGIFQTO-WOJBJXKFSA-N 2 0 354.498 2.562 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c(O)c1 ZINC000756644173 1023739751 /nfs/dbraw/zinc/73/97/51/1023739751.db2.gz ZBKNQDJTGZLOHB-INIZCTEOSA-N 2 0 361.530 2.978 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cc(N)c(C)c[nH+]3)CC2)cc1 ZINC001156260507 1029116731 /nfs/dbraw/zinc/11/67/31/1029116731.db2.gz FYIWWJNCCSJSIA-UHFFFAOYSA-N 2 0 355.486 2.605 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000840932364 1029931653 /nfs/dbraw/zinc/93/16/53/1029931653.db2.gz FYMRUHMLMQWBLY-UHFFFAOYSA-N 2 0 367.541 2.758 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000840935488 1029933455 /nfs/dbraw/zinc/93/34/55/1029933455.db2.gz QZPFCCKIHOOKQY-UHFFFAOYSA-N 2 0 374.573 2.777 20 10 FFCDRP Cc1ccc(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)cc1C ZINC001204621351 1031392795 /nfs/dbraw/zinc/39/27/95/1031392795.db2.gz DNMPRTWQWRWVJU-UHFFFAOYSA-N 2 0 367.493 2.813 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c(Br)c1 ZINC001205592315 1031859321 /nfs/dbraw/zinc/85/93/21/1031859321.db2.gz SKRKVZJTKXJKLM-OAHLLOKOSA-N 2 0 361.255 2.816 20 10 FFCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@@H]2C1 ZINC001138343235 1034174639 /nfs/dbraw/zinc/17/46/39/1034174639.db2.gz ZJOMQWAUYLTQIS-KDURUIRLSA-N 2 0 355.526 2.865 20 10 FFCDRP Cc1cc(N2CC[NH+](Cc3ccc(N4CCOCC4)cc3)CC2)cc[nH+]1 ZINC001138499252 1034341249 /nfs/dbraw/zinc/34/12/49/1034341249.db2.gz ACVDNWQFPBBRAT-UHFFFAOYSA-N 2 0 352.482 2.549 20 10 FFCDRP Cc1ccc2c(n1)N(C)CC[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001139407523 1035093199 /nfs/dbraw/zinc/09/31/99/1035093199.db2.gz FRSJXRWHWAYOLC-UHFFFAOYSA-N 2 0 365.525 2.594 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCN(c4cccc(F)c4)CC3)cc2)CC1 ZINC001139410792 1035094884 /nfs/dbraw/zinc/09/48/84/1035094884.db2.gz FHJQNMAGOVUKEV-UHFFFAOYSA-N 2 0 368.500 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4nc(C)no4)C3)cc2)CC1 ZINC001140306690 1035428263 /nfs/dbraw/zinc/42/82/63/1035428263.db2.gz VIJMFCSBPQEXKO-SFHVURJKSA-N 2 0 355.486 2.509 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429448 1037544068 /nfs/dbraw/zinc/54/40/68/1037544068.db2.gz UENRAZQRDUTYKQ-RTBURBONSA-N 2 0 374.548 2.789 20 10 FFCDRP Fc1cccc(CN2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001235670167 1037674030 /nfs/dbraw/zinc/67/40/30/1037674030.db2.gz RKOYNNIICKELPC-UHFFFAOYSA-N 2 0 368.500 2.553 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1c1ccccc1 ZINC001235675509 1037676787 /nfs/dbraw/zinc/67/67/87/1037676787.db2.gz YURQAWQOOPHJHB-JOCHJYFZSA-N 2 0 350.510 2.585 20 10 FFCDRP Cc1ccccc1O[C@H]1CC[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001235674555 1037677732 /nfs/dbraw/zinc/67/77/32/1037677732.db2.gz KADJVWZNMPTZSP-SFHVURJKSA-N 2 0 354.450 2.836 20 10 FFCDRP CNC(=O)CN1CCCC12CC[NH+](Cc1c(O)ccc3ccccc31)CC2 ZINC001231586941 1037703036 /nfs/dbraw/zinc/70/30/36/1037703036.db2.gz NLQLSLOXEYPTMX-UHFFFAOYSA-N 2 0 367.493 2.722 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4c(N)cccc4C3)c(F)c2)CC1 ZINC001236365799 1038058474 /nfs/dbraw/zinc/05/84/74/1038058474.db2.gz WOILQLXBBHQXKT-UHFFFAOYSA-N 2 0 354.473 2.718 20 10 FFCDRP COc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1O)CCC2 ZINC001236432696 1038087489 /nfs/dbraw/zinc/08/74/89/1038087489.db2.gz AWAVFSQWOFDJDR-UHFFFAOYSA-N 2 0 367.493 2.759 20 10 FFCDRP Cc1cccnc1O[C@H]1CCC[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001236535603 1038121858 /nfs/dbraw/zinc/12/18/58/1038121858.db2.gz IMUZUSQDPQUGFF-SFHVURJKSA-N 2 0 369.465 2.621 20 10 FFCDRP CCC[N@H+]1C[C@H]2CN(Cc3c(O)cc(OC)cc3Br)C[C@H]2C1 ZINC001237063941 1038430206 /nfs/dbraw/zinc/43/02/06/1038430206.db2.gz APWHNHAQMANSEE-BETUJISGSA-N 2 0 369.303 2.937 20 10 FFCDRP C[NH2+]CC[C@@H](C)[N@@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246701001 1039442442 /nfs/dbraw/zinc/44/24/42/1039442442.db2.gz HYRWZTYYOYSABC-WIYYLYMNSA-N 2 0 361.530 2.612 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001249208638 1040629497 /nfs/dbraw/zinc/62/94/97/1040629497.db2.gz ZNFDMJOUIHSPRQ-RBUKOAKNSA-N 2 0 360.498 2.947 20 10 FFCDRP COc1ccc(O)c(C[N@@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1 ZINC001278571424 1041216944 /nfs/dbraw/zinc/21/69/44/1041216944.db2.gz RLAXYPYPVJCPCW-NRFANRHFSA-N 2 0 361.530 2.640 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCN(CCN2CCOCC2)C1 ZINC001262031704 1041521299 /nfs/dbraw/zinc/52/12/99/1041521299.db2.gz ZKEIKTCSYVVJJU-CEXWTWQISA-N 2 0 373.541 2.635 20 10 FFCDRP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237645887 1043290478 /nfs/dbraw/zinc/29/04/78/1043290478.db2.gz MEXNTAPGIASXSH-UHFFFAOYSA-N 2 0 357.473 2.878 20 10 FFCDRP Cn1ccnc1C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001320203249 1045368138 /nfs/dbraw/zinc/36/81/38/1045368138.db2.gz PVFKJMITBHQIDS-HXUWFJFHSA-N 2 0 367.541 2.627 20 10 FFCDRP C[C@H](CO)[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001323451743 1045595605 /nfs/dbraw/zinc/59/56/05/1045595605.db2.gz JNSQAPUSOPURCO-LJQANCHMSA-N 2 0 353.510 2.821 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cccnc3N(C)C)cc2F)CC1 ZINC001324105717 1045866836 /nfs/dbraw/zinc/86/68/36/1045866836.db2.gz JVFWFAKCIJEVAR-UHFFFAOYSA-N 2 0 371.504 2.718 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104156 1052259584 /nfs/dbraw/zinc/25/95/84/1052259584.db2.gz KCGOBNANNGNAKD-AZUAARDMSA-N 2 0 360.521 2.542 20 10 FFCDRP COC(=O)c1c(C[NH2+]CC2(C)CC[NH+](C)CC2)c2cc(F)ccc2n1C ZINC001474386940 1065508186 /nfs/dbraw/zinc/50/81/86/1065508186.db2.gz JINGNWSDQJGKFB-UHFFFAOYSA-N 2 0 361.461 2.926 20 10 FFCDRP CC[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000274970453 512002009 /nfs/dbraw/zinc/00/20/09/512002009.db2.gz YDRXMVGFCGCFQZ-AWEZNQCLSA-N 2 0 357.292 2.652 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)c2c1c(F)ccc2O ZINC000817973238 742225314 /nfs/dbraw/zinc/22/53/14/742225314.db2.gz RJPVQNNHHNXBOW-MPKXVKKWSA-N 2 0 361.383 2.505 20 10 FFCDRP CC[C@@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817972134 742225654 /nfs/dbraw/zinc/22/56/54/742225654.db2.gz KBYRPZONMAYCID-UKRRQHHQSA-N 2 0 365.827 2.922 20 10 FFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000825275481 743239393 /nfs/dbraw/zinc/23/93/93/743239393.db2.gz PKUPYAFPSPMGPU-UHFFFAOYSA-N 2 0 370.335 2.660 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125306 747777311 /nfs/dbraw/zinc/77/73/11/747777311.db2.gz RUHHKOOHCFBBLU-CHWSQXEVSA-N 2 0 369.303 2.985 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1O ZINC000844910435 748134486 /nfs/dbraw/zinc/13/44/86/748134486.db2.gz IBKRXVCHAFMWRK-OAGGEKHMSA-N 2 0 354.878 2.915 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1O ZINC000895607676 970783029 /nfs/dbraw/zinc/78/30/29/970783029.db2.gz AEPIZZCNJHBNMZ-UHFFFAOYSA-N 2 0 355.482 2.751 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)Nc2ccc(C[NH3+])cc2)[NH+](C)C)cc1 ZINC000904510438 980289991 /nfs/dbraw/zinc/28/99/91/980289991.db2.gz LYFPQPXDBYJKMC-IBGZPJMESA-N 2 0 355.486 2.636 20 10 FFCDRP C[NH+](C)C[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1C[NH+](C)C ZINC000877668190 1014668677 /nfs/dbraw/zinc/66/86/77/1014668677.db2.gz FYCIAMCOTQQNKK-NHCUHLMSSA-N 2 0 358.574 2.848 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000184887420 993066134 /nfs/dbraw/zinc/06/61/34/993066134.db2.gz CVXCWAYMPJDTHK-SFHVURJKSA-N 2 0 369.509 2.869 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CO[C@@H](C2CC2)C1 ZINC000825379284 997351435 /nfs/dbraw/zinc/35/14/35/997351435.db2.gz MMZTZQRXNNHRGR-RBBKRZOGSA-N 2 0 355.526 2.876 20 10 FFCDRP Oc1ccc2ccncc2c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000738110954 999618261 /nfs/dbraw/zinc/61/82/61/999618261.db2.gz LEDYTDQHURQUFI-UHFFFAOYSA-N 2 0 355.482 2.875 20 10 FFCDRP CCOC(=O)N1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001169645687 1000065619 /nfs/dbraw/zinc/06/56/19/1000065619.db2.gz AWCUWYRKPLYXLO-IBGZPJMESA-N 2 0 374.529 2.539 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1O ZINC000846153758 1000210918 /nfs/dbraw/zinc/21/09/18/1000210918.db2.gz IAUXQCFVIVVAGW-HNNXBMFYSA-N 2 0 371.481 2.543 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](O)c1cccc(F)c1 ZINC000771842023 1001211248 /nfs/dbraw/zinc/21/12/48/1001211248.db2.gz HNVAFIWTGQUEAL-KKSFZXQISA-N 2 0 357.473 2.789 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1n1ccnc1 ZINC000775738148 1003929251 /nfs/dbraw/zinc/92/92/51/1003929251.db2.gz UFXMLDGXRQWLFC-WIYYLYMNSA-N 2 0 353.514 2.718 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@@H]([NH+]4CCCC4)C3)cc2)CC1 ZINC000775669472 1005023838 /nfs/dbraw/zinc/02/38/38/1005023838.db2.gz KCHWDKWTVNAPCS-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN[C@@H]3CC[N@@H+](C4CCCCC4)C3)cc2)CC1 ZINC000850382278 1005811947 /nfs/dbraw/zinc/81/19/47/1005811947.db2.gz QKNPIXGBANOTCK-HXUWFJFHSA-N 2 0 356.558 2.935 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCN(c4ccccc4F)C3)cc2)CC1 ZINC000813791421 1006040057 /nfs/dbraw/zinc/04/00/57/1006040057.db2.gz CWOBCRHFLFBMRB-LJQANCHMSA-N 2 0 368.500 2.946 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnn(-c4ccccc4)c3)cc2)CC1 ZINC000883284576 1006733062 /nfs/dbraw/zinc/73/30/62/1006733062.db2.gz QPPGJLMTSIFTEN-UHFFFAOYSA-N 2 0 361.493 2.914 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817893874 1007800066 /nfs/dbraw/zinc/80/00/66/1007800066.db2.gz JLMUZRKULZESAN-YZGWKJHDSA-N 2 0 361.505 2.797 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cnccc1N ZINC000817916905 1007807790 /nfs/dbraw/zinc/80/77/90/1007807790.db2.gz MHHXPVWIXZQNLO-QGZVFWFLSA-N 2 0 365.525 2.877 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CNC(=[NH2+])N3CCC(C)CC3)cc2F)CC1 ZINC000304025965 1012567659 /nfs/dbraw/zinc/56/76/59/1012567659.db2.gz ZHEUVELCGJAZIN-UHFFFAOYSA-N 2 0 361.509 2.724 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C[C@H]3C3CCCC3)cc2)CC1 ZINC000925715300 1017822184 /nfs/dbraw/zinc/82/21/84/1017822184.db2.gz GFEIIXRQTBFJPQ-VXKWHMMOSA-N 2 0 357.542 2.906 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(N(CC)CC)cc3)C[C@@H]1C[NH2+]CCC2 ZINC001222125490 1032769621 /nfs/dbraw/zinc/76/96/21/1032769621.db2.gz NIBJDJYOOIWVOR-UGKGYDQZSA-N 2 0 373.541 2.898 20 10 FFCDRP Oc1cccc2c1[C@@H]([NH2+]CC1(O)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000397491095 1020291210 /nfs/dbraw/zinc/29/12/10/1020291210.db2.gz JBBJFSPIQSRPRK-IBGZPJMESA-N 2 0 352.478 2.996 20 10 FFCDRP Cc1cc(C)cc([C@@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000800896597 1020632066 /nfs/dbraw/zinc/63/20/66/1020632066.db2.gz NOLZNXBEGYQGHQ-QFIPXVFZSA-N 2 0 353.510 2.878 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C[S@](C)=O)c3ccccc3)cc2)CC1 ZINC000780895457 1028854390 /nfs/dbraw/zinc/85/43/90/1028854390.db2.gz UOUJFVOWETWNRF-RLWLMLJZSA-N 2 0 371.550 2.648 20 10 FFCDRP Cc1nc(N2CCCC2)cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]1 ZINC001156656091 1029290008 /nfs/dbraw/zinc/29/00/08/1029290008.db2.gz OOLMHSIEWGNIDI-UHFFFAOYSA-N 2 0 366.513 2.749 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CC2)C[N@H+](Cc2ccccc2)CCO3)cc1O ZINC001203878087 1030951563 /nfs/dbraw/zinc/95/15/63/1030951563.db2.gz BBIWDICMKBAMFG-UHFFFAOYSA-N 2 0 368.477 2.965 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c(C(F)(F)F)c1 ZINC000843125237 1031193451 /nfs/dbraw/zinc/19/34/51/1031193451.db2.gz OSFRWHGVBBRHQV-HNNXBMFYSA-N 2 0 371.447 2.959 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@H]1COC2(C1)CC[NH+](Cc1ccc(O)cc1O)CC2 ZINC001204272584 1031198833 /nfs/dbraw/zinc/19/88/33/1031198833.db2.gz CYTPQWUGTDWQDW-QGZVFWFLSA-N 2 0 372.465 2.946 20 10 FFCDRP Cc1ccccc1N1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001204863241 1031456018 /nfs/dbraw/zinc/45/60/18/1031456018.db2.gz GYJYEWFGOIDEIP-UHFFFAOYSA-N 2 0 350.510 2.727 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCC[C@H](C[NH2+]C)C2)c(O)c1 ZINC001205016908 1031486409 /nfs/dbraw/zinc/48/64/09/1031486409.db2.gz LNBJXPBRAUYBOA-MRXNPFEDSA-N 2 0 364.486 2.546 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000832273012 1034694091 /nfs/dbraw/zinc/69/40/91/1034694091.db2.gz LHRFOBGPUZVZTB-OAQYLSRUSA-N 2 0 366.509 2.778 20 10 FFCDRP Cc1cnccc1O[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411645 1035095052 /nfs/dbraw/zinc/09/50/52/1035095052.db2.gz WMRXPTVCUJPGKQ-OAQYLSRUSA-N 2 0 366.509 2.795 20 10 FFCDRP Cc1ccc(C)c(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c1O ZINC001140181233 1035370870 /nfs/dbraw/zinc/37/08/70/1035370870.db2.gz QVZGIGOIOLEDRV-UHFFFAOYSA-N 2 0 354.498 2.860 20 10 FFCDRP C[C@@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000835027015 1035490014 /nfs/dbraw/zinc/49/00/14/1035490014.db2.gz AMWWEHWDWUPANB-VDXKNXLBSA-N 2 0 356.558 2.724 20 10 FFCDRP Clc1ccc([C@@H]2C[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001235789627 1037745974 /nfs/dbraw/zinc/74/59/74/1037745974.db2.gz DKGYRGQCUBSKAU-NRFANRHFSA-N 2 0 370.928 2.896 20 10 FFCDRP C[C@H](c1ccccc1)[NH+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235864506 1037802097 /nfs/dbraw/zinc/80/20/97/1037802097.db2.gz RWBRPKHVWJXZIL-HXUWFJFHSA-N 2 0 364.537 2.975 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC(N3CC[NH2+]CC3)CC2)c2ccccc21 ZINC001236130886 1037945642 /nfs/dbraw/zinc/94/56/42/1037945642.db2.gz XQLSZAPPKXYHSJ-UHFFFAOYSA-N 2 0 352.526 2.775 20 10 FFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1c(C)cc(OC)cc1O)C2 ZINC001236809861 1038283897 /nfs/dbraw/zinc/28/38/97/1038283897.db2.gz SVXHNRZGTJDHNG-AVRDEDQJSA-N 2 0 374.525 2.890 20 10 FFCDRP Cc1nnc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)CC2)o1 ZINC001236943124 1038370160 /nfs/dbraw/zinc/37/01/60/1038370160.db2.gz PVDCALCOSVFBAX-UHFFFAOYSA-N 2 0 373.476 2.649 20 10 FFCDRP Cc1noc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)CC2)n1 ZINC001236941635 1038371520 /nfs/dbraw/zinc/37/15/20/1038371520.db2.gz FAVPTOFDYNNTDO-UHFFFAOYSA-N 2 0 373.476 2.649 20 10 FFCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCOCC4)cc3F)CC2)C1 ZINC001278624220 1038924064 /nfs/dbraw/zinc/92/40/64/1038924064.db2.gz XIQXSQISZUESOX-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP FC(F)(F)Oc1ccc(N2CC[NH+]([C@@H]3C[C@H]4C[NH2+]C[C@H]4C3)CC2)cc1 ZINC001246993561 1039568323 /nfs/dbraw/zinc/56/83/23/1039568323.db2.gz HUFFRCGPHIPUGK-FOLVSLTJSA-N 2 0 355.404 2.705 20 10 FFCDRP Oc1ccc(O)c(C[N@@H+]2CCC[C@@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278751422 1040474432 /nfs/dbraw/zinc/47/44/32/1040474432.db2.gz ZTRDTBSCOHSGGC-HXUWFJFHSA-N 2 0 356.470 2.699 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC[N@@H+]1C1CCCCC1 ZINC001237247920 1043075263 /nfs/dbraw/zinc/07/52/63/1043075263.db2.gz KLPTYDUCCXAHMD-IBGZPJMESA-N 2 0 356.558 2.935 20 10 FFCDRP COc1cccc2c1OC[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001308243938 1052436045 /nfs/dbraw/zinc/43/60/45/1052436045.db2.gz IFNVDMSZLUNZLY-IBGZPJMESA-N 2 0 367.493 2.540 20 10 FFCDRP COc1cccc(CNC(=[NH2+])NC2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000849073279 1055629799 /nfs/dbraw/zinc/62/97/99/1055629799.db2.gz CDYVBDFYNJFPIU-UHFFFAOYSA-N 2 0 368.481 2.679 20 10 FFCDRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001461036740 1061193565 /nfs/dbraw/zinc/19/35/65/1061193565.db2.gz UQRVWXDHNMZFBN-UHFFFAOYSA-N 3 0 352.526 2.790 20 10 FFCDRP COC(=O)c1c(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2cc(F)ccc2n1C ZINC001462327273 1061584219 /nfs/dbraw/zinc/58/42/19/1061584219.db2.gz OPWVZXVUXUJQJQ-AWEZNQCLSA-N 2 0 361.461 2.926 20 10 FFCDRP COc1c([O-])c(C[N@@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463777 1061634354 /nfs/dbraw/zinc/63/43/54/1061634354.db2.gz WHQWJVJERGETJW-ZFWWWQNUSA-N 2 0 351.447 2.861 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2CCN(C)CC2)cc1F ZINC001473930311 1065422058 /nfs/dbraw/zinc/42/20/58/1065422058.db2.gz VHXLMISJGIMJMS-UHFFFAOYSA-N 2 0 350.526 2.789 20 10 FFCDRP CC[C@](C)(C[NH3+])C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948323 1078288544 /nfs/dbraw/zinc/28/85/44/1078288544.db2.gz IXVHPRVBRMPKRH-CRAIPNDOSA-N 2 0 353.894 2.501 20 10 FFCDRP CC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000192924173 509699713 /nfs/dbraw/zinc/69/97/13/509699713.db2.gz PNAJCTNISUZQDQ-MRXNPFEDSA-N 2 0 370.335 2.833 20 10 FFCDRP CCOCc1cc(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)ccc1OC ZINC000268417170 509916622 /nfs/dbraw/zinc/91/66/22/509916622.db2.gz KDTMFDQUXABGOR-UHFFFAOYSA-N 2 0 350.503 2.557 20 10 FFCDRP OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297592584 511000483 /nfs/dbraw/zinc/00/04/83/511000483.db2.gz HQQNLENNUUCNLM-UFYCRDLUSA-N 2 0 352.478 2.852 20 10 FFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1c(O)cccc1Br ZINC000862367092 730692679 /nfs/dbraw/zinc/69/26/79/730692679.db2.gz VZCFYQVTOIYHNQ-UHFFFAOYSA-N 2 0 372.351 2.860 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000779987080 738504281 /nfs/dbraw/zinc/50/42/81/738504281.db2.gz UHOGPGXKEZRNPN-UHFFFAOYSA-N 2 0 357.292 2.985 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000883283697 733359686 /nfs/dbraw/zinc/35/96/86/733359686.db2.gz PCSNAKKGLFQCSL-NVXWUHKLSA-N 2 0 357.420 2.638 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2Cc1ccc(Br)cc1O ZINC000824938766 743182266 /nfs/dbraw/zinc/18/22/66/743182266.db2.gz LUULCDPFYKWNSI-VYDXJSESSA-N 2 0 369.303 2.838 20 10 FFCDRP CN(CC[N@H+](C)Cc1ccc(Br)cc1O)C1CC[NH+](C)CC1 ZINC000825903316 743341141 /nfs/dbraw/zinc/34/11/41/743341141.db2.gz CXYVPBOOCFYTGS-UHFFFAOYSA-N 2 0 370.335 2.613 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1O ZINC000841090499 747266524 /nfs/dbraw/zinc/26/65/24/747266524.db2.gz ZPQLABPGGVTLTL-ZDUSSCGKSA-N 2 0 355.276 2.928 20 10 FFCDRP COc1cc(Br)cc(C[N@H+](C2CC2)C2CC[NH2+]CC2)c1O ZINC000843043932 747755222 /nfs/dbraw/zinc/75/52/22/747755222.db2.gz QPEQWQMNTPXVOF-UHFFFAOYSA-N 2 0 355.276 2.880 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000854231273 750265944 /nfs/dbraw/zinc/26/59/44/750265944.db2.gz IKBLCSPCIQNDKK-AWEZNQCLSA-N 2 0 367.921 2.995 20 10 FFCDRP COC(C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1)OC ZINC001205923350 1032067713 /nfs/dbraw/zinc/06/77/13/1032067713.db2.gz NHXWSKJEQNRQDI-UHFFFAOYSA-N 2 0 369.509 2.717 20 10 FFCDRP CC(=O)c1cc(F)cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1O ZINC000175785806 960311636 /nfs/dbraw/zinc/31/16/36/960311636.db2.gz QRUOIHUOYNIWBB-UHFFFAOYSA-N 2 0 364.461 2.811 20 10 FFCDRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 ZINC000728572333 967623314 /nfs/dbraw/zinc/62/33/14/967623314.db2.gz YHVPSPXFWFHQNY-UHFFFAOYSA-N 2 0 374.573 2.763 20 10 FFCDRP Cc1cccc(O)c1C[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000876633597 1014333758 /nfs/dbraw/zinc/33/37/58/1014333758.db2.gz CNTVANHJDBPWOS-UHFFFAOYSA-N 2 0 361.530 2.617 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206011532 1032108179 /nfs/dbraw/zinc/10/81/79/1032108179.db2.gz DGPJJNKOOHXZKZ-WBVHZDCISA-N 2 0 351.922 2.983 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CN(C(=O)[C@H](C(C)C)[NH+](C)C)C[C@H]2C)cc1C ZINC001082575422 994998607 /nfs/dbraw/zinc/99/86/07/994998607.db2.gz FBRZJZNFBVCNAY-POAQFYNOSA-N 2 0 361.530 2.526 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C3CC[NH+]([C@H]4CCC[C@H]4O)CC3)CC2)cc1 ZINC000812839132 995549346 /nfs/dbraw/zinc/54/93/46/995549346.db2.gz HZWLUTIRACPKJL-FCHUYYIVSA-N 2 0 373.541 2.631 20 10 FFCDRP Cc1c(C[C@@H](C[NH3+])C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cnn1C ZINC000903884284 1016287856 /nfs/dbraw/zinc/28/78/56/1016287856.db2.gz WPRJLINZOJGLQG-IBGZPJMESA-N 2 0 357.546 2.823 20 10 FFCDRP CC(C)[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC1 ZINC000734057860 999186120 /nfs/dbraw/zinc/18/61/20/999186120.db2.gz BEFFEGOIXMTDCL-UHFFFAOYSA-N 2 0 372.557 2.706 20 10 FFCDRP C[N@@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465834 1000262691 /nfs/dbraw/zinc/26/26/91/1000262691.db2.gz MHIJMCKXQBVYNB-UTKZUKDTSA-N 2 0 368.477 2.772 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCCc4ccccc43)cc2)CC1 ZINC000771819517 1001218235 /nfs/dbraw/zinc/21/82/35/1001218235.db2.gz RADBMRXTAIVFFC-UHFFFAOYSA-N 2 0 364.537 2.981 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](OCC(F)(F)F)C3)cc2)CC1 ZINC000771824643 1001220792 /nfs/dbraw/zinc/22/07/92/1001220792.db2.gz OZEAUIHTBOADEO-GOSISDBHSA-N 2 0 371.447 2.982 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CCC(C)(C)C(=O)OC)cc2F)CC1 ZINC000792965667 1003250574 /nfs/dbraw/zinc/25/05/74/1003250574.db2.gz ORDYEACKFWJREM-UHFFFAOYSA-N 2 0 365.493 2.647 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712917 1003758375 /nfs/dbraw/zinc/75/83/75/1003758375.db2.gz RZABXNCDNMCAIT-OAQYLSRUSA-N 3 0 356.558 2.889 20 10 FFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](CC)CN1C(C)=O ZINC000775720213 1003786468 /nfs/dbraw/zinc/78/64/68/1003786468.db2.gz IRRJOAJGLRUHGR-NHCUHLMSSA-N 2 0 372.557 2.660 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000078459472 1004103451 /nfs/dbraw/zinc/10/34/51/1004103451.db2.gz ROOOZZHUUDREMD-UHFFFAOYSA-N 2 0 367.541 2.969 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCN(c4nccs4)CC3)cc2)CC1 ZINC000775661799 1004986106 /nfs/dbraw/zinc/98/61/06/1004986106.db2.gz OYVRTRYELXKEDT-UHFFFAOYSA-N 2 0 371.554 2.607 20 10 FFCDRP COC(=O)[C@@H]1C[C@@H]1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000850235106 1005797332 /nfs/dbraw/zinc/79/73/32/1005797332.db2.gz RQHXWOHIDRDAHQ-MAODMQOUSA-N 2 0 371.525 2.506 20 10 FFCDRP CCOc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c(O)c1 ZINC000850357474 1005811055 /nfs/dbraw/zinc/81/10/55/1005811055.db2.gz KPEVXRLUHVQXHT-LJQANCHMSA-N 2 0 356.466 2.647 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3cccc4c3CC[NH2+]C4)CC2)cc1F ZINC000852746608 1006166300 /nfs/dbraw/zinc/16/63/00/1006166300.db2.gz MALLOKAZXGDMLL-UHFFFAOYSA-N 2 0 355.457 2.802 20 10 FFCDRP C[C@@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+](C)Cc1ccccc1O ZINC000111235257 1006362659 /nfs/dbraw/zinc/36/26/59/1006362659.db2.gz WFDKFFHSEQJUSC-FXAWDEMLSA-N 2 0 367.493 2.603 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3c[nH]nc3-c3cccnc3)cc2)CC1 ZINC000883283749 1006730310 /nfs/dbraw/zinc/73/03/10/1006730310.db2.gz RKIHKLQIDYYLHB-UHFFFAOYSA-N 2 0 362.481 2.513 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817890557 1007786296 /nfs/dbraw/zinc/78/62/96/1007786296.db2.gz ZZKFWIIAHUVXAX-AWEZNQCLSA-N 2 0 358.461 2.675 20 10 FFCDRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893840 1007800518 /nfs/dbraw/zinc/80/05/18/1007800518.db2.gz IZXCZAWIFWHQOD-JPYJTQIMSA-N 2 0 367.537 2.943 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898486 1007802728 /nfs/dbraw/zinc/80/27/28/1007802728.db2.gz HGIGSYUHNAUKDV-IHETXDGRSA-N 2 0 369.456 2.599 20 10 FFCDRP C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000827786316 1018664195 /nfs/dbraw/zinc/66/41/95/1018664195.db2.gz ISUSUIIAXZBZCT-CRAIPNDOSA-N 2 0 371.447 2.980 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)c1O ZINC001118246009 1022141867 /nfs/dbraw/zinc/14/18/67/1022141867.db2.gz LMUFGQLLIHVPNH-KRWDZBQOSA-N 2 0 369.509 2.999 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3Cc4ccccc4[C@@H]4C[NH2+]C[C@@H]43)cc2)CC1 ZINC001222558439 1033052498 /nfs/dbraw/zinc/05/24/98/1033052498.db2.gz KPVIFIGQABOKGS-GOTSBHOMSA-N 2 0 362.521 2.510 20 10 FFCDRP Cc1ccnc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000757928270 1023885395 /nfs/dbraw/zinc/88/53/95/1023885395.db2.gz QYMGLEQWAIWLAA-UHFFFAOYSA-N 2 0 365.525 2.916 20 10 FFCDRP COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000779605186 1024255299 /nfs/dbraw/zinc/25/52/99/1024255299.db2.gz RLEQGCFPSNMJGN-IBGZPJMESA-N 2 0 373.541 2.850 20 10 FFCDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000248041125 1027371909 /nfs/dbraw/zinc/37/19/09/1027371909.db2.gz SUTAWWNUVAWWAJ-SIKLNZKXSA-N 2 0 374.573 2.527 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CN1C1CC1 ZINC000092856001 1027477913 /nfs/dbraw/zinc/47/79/13/1027477913.db2.gz XWJMLOGVISOBEP-NQIIRXRSSA-N 2 0 368.569 2.933 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1ccc(OC)cc1O ZINC001203628924 1030796537 /nfs/dbraw/zinc/79/65/37/1030796537.db2.gz KWQFLHVIHIDBOK-UHFFFAOYSA-N 2 0 351.535 2.886 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1cc(OC)ccc1O ZINC001203680128 1030823427 /nfs/dbraw/zinc/82/34/27/1030823427.db2.gz GFWWJNWBNUFSNC-UHFFFAOYSA-N 2 0 351.535 2.886 20 10 FFCDRP Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000798960956 1031595855 /nfs/dbraw/zinc/59/58/55/1031595855.db2.gz ONCHFOFHACCDAK-OAQYLSRUSA-N 2 0 353.514 2.899 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@H]1C[NH3+] ZINC001205654153 1031908772 /nfs/dbraw/zinc/90/87/72/1031908772.db2.gz WOHLPRFDPMFMDS-HOTGVXAUSA-N 2 0 351.922 2.983 20 10 FFCDRP CC[N@H+](C)[C@@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281724 1034698743 /nfs/dbraw/zinc/69/87/43/1034698743.db2.gz VWJSDHRARUKKQD-VQTJNVASSA-N 2 0 354.498 2.562 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](c3nnc(C)o3)C2)cc(C[NH+](C)C)c1O ZINC001139259292 1035031789 /nfs/dbraw/zinc/03/17/89/1035031789.db2.gz PMEGWTCNYWKRRL-OAHLLOKOSA-N 2 0 360.458 2.533 20 10 FFCDRP COC(=O)[C@H]1CCC[N@@H+](C2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673249 1035194445 /nfs/dbraw/zinc/19/44/45/1035194445.db2.gz FJPAYOKCRZTHMT-IBGZPJMESA-N 2 0 373.541 2.910 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ncccn4)CC3)cc2)CC1 ZINC001140304554 1035426083 /nfs/dbraw/zinc/42/60/83/1035426083.db2.gz UMNKQQMNWFQUBP-UHFFFAOYSA-N 2 0 365.525 2.998 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C(=O)OC)CC3)cc2)CC1 ZINC001140309424 1035429667 /nfs/dbraw/zinc/42/96/67/1035429667.db2.gz GCGCPWKHXMKMNS-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001232203118 1035498793 /nfs/dbraw/zinc/49/87/93/1035498793.db2.gz PPZZZQXEMITFBW-UHFFFAOYSA-N 2 0 351.922 2.950 20 10 FFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CC[C@H]([NH+]4CCOCC4)CC3)cc2)CC1 ZINC001234657753 1037126797 /nfs/dbraw/zinc/12/67/97/1037126797.db2.gz HKNIDEYVONCJSG-AQYVVDRMSA-N 2 0 373.541 2.851 20 10 FFCDRP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@H+](Cc1cccc(C)c1O)C2 ZINC001235322552 1037475912 /nfs/dbraw/zinc/47/59/12/1037475912.db2.gz ZDVANFHSFWXFIA-PGRDOPGGSA-N 2 0 372.509 2.846 20 10 FFCDRP C[NH+]1CCC(C2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)CC1 ZINC001235725195 1037710250 /nfs/dbraw/zinc/71/02/50/1037710250.db2.gz JBPZMQRPQHUZKM-UHFFFAOYSA-N 3 0 356.558 2.650 20 10 FFCDRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c1O ZINC001231594143 1037713723 /nfs/dbraw/zinc/71/37/23/1037713723.db2.gz ZNWFGBSZHDKDML-TZIWHRDSSA-N 2 0 367.493 2.819 20 10 FFCDRP Clc1ccc([C@H]2C[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001235789629 1037746839 /nfs/dbraw/zinc/74/68/39/1037746839.db2.gz DKGYRGQCUBSKAU-OAQYLSRUSA-N 2 0 370.928 2.896 20 10 FFCDRP CC1(C)C=Cc2c(O)c(C[NH+]3CCN(C4(C)CC[NH2+]CC4)CC3)ccc2O1 ZINC001235820491 1037767253 /nfs/dbraw/zinc/76/72/53/1037767253.db2.gz OBXSPKBHASHPGQ-UHFFFAOYSA-N 2 0 371.525 2.836 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]1C[NH2+]CC2 ZINC001236039618 1037901623 /nfs/dbraw/zinc/90/16/23/1037901623.db2.gz WMSYDIOYTMVCII-IIBYNOLFSA-N 2 0 360.498 2.664 20 10 FFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236274257 1038014691 /nfs/dbraw/zinc/01/46/91/1038014691.db2.gz DUBMTTSZBJNAKK-UHFFFAOYSA-N 2 0 355.482 2.962 20 10 FFCDRP COc1ccc(Br)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236321138 1038043698 /nfs/dbraw/zinc/04/36/98/1038043698.db2.gz GAAMZPLUSGBOBT-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP CCOC(=O)c1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c2ccccc2n1C ZINC001236321373 1038046476 /nfs/dbraw/zinc/04/64/76/1038046476.db2.gz IXLMHPWELMGBKW-IYBDPMFKSA-N 2 0 355.482 2.786 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374570 1038061826 /nfs/dbraw/zinc/06/18/26/1038061826.db2.gz FDWHFLRVBGVRIQ-HXUWFJFHSA-N 2 0 356.558 2.840 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(Br)c1 ZINC001237060466 1038428463 /nfs/dbraw/zinc/42/84/63/1038428463.db2.gz BHLASTQXWBOAJS-NEPJUHHUSA-N 2 0 355.276 2.547 20 10 FFCDRP Cc1ccc(OC[C@H](O)C[NH2+]C2CC[NH+](Cc3ccccc3O)CC2)cc1 ZINC001253846743 1040409519 /nfs/dbraw/zinc/40/95/19/1040409519.db2.gz DXVWFTSEVPKUMJ-HXUWFJFHSA-N 2 0 370.493 2.695 20 10 FFCDRP O=c1cccc(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4O)C[C@H]3CC2)[nH]1 ZINC001278552736 1041119810 /nfs/dbraw/zinc/11/98/10/1041119810.db2.gz YBFHHGCIPXMOKW-CALCHBBNSA-N 2 0 353.466 2.837 20 10 FFCDRP CCOC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237485311 1043199079 /nfs/dbraw/zinc/19/90/79/1043199079.db2.gz NVGWVKPEERMTOD-KRWDZBQOSA-N 2 0 360.498 2.940 20 10 FFCDRP Oc1cc(O)c(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4ccc[nH]4)(C2)CCC3)cc1O ZINC001279514054 1043210339 /nfs/dbraw/zinc/21/03/39/1043210339.db2.gz FWTJDQZGBCOGAO-VQTJNVASSA-N 2 0 357.454 2.856 20 10 FFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001279523165 1043221089 /nfs/dbraw/zinc/22/10/89/1043221089.db2.gz NLDUHNBRYXROCY-GJZGRUSLSA-N 2 0 373.419 2.501 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)cc2F)CC1 ZINC001324438608 1046030721 /nfs/dbraw/zinc/03/07/21/1046030721.db2.gz NVBPVXKNBLEHQM-UHFFFAOYSA-N 2 0 350.526 2.788 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1F ZINC001308231505 1052433684 /nfs/dbraw/zinc/43/36/84/1052433684.db2.gz KWHQNJMHDAMRAJ-UHFFFAOYSA-N 2 0 356.489 2.933 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(N(C)C)cc1 ZINC000130465686 508820976 /nfs/dbraw/zinc/82/09/76/508820976.db2.gz SZSNPVGPZUQCGJ-QGZVFWFLSA-N 2 0 353.514 2.750 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1C ZINC000265619471 510142053 /nfs/dbraw/zinc/14/20/53/510142053.db2.gz PPTCZKAKQUODSG-UHFFFAOYSA-N 2 0 355.482 2.585 20 10 FFCDRP C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1c(O)cccc1Br ZINC000858187693 730419250 /nfs/dbraw/zinc/41/92/50/730419250.db2.gz XZXLAOYRLKVILE-ZDUSSCGKSA-N 2 0 358.324 2.516 20 10 FFCDRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(Br)cc2O)CC1 ZINC000824768227 743145312 /nfs/dbraw/zinc/14/53/12/743145312.db2.gz HCWWSPMIOSWENV-UHFFFAOYSA-N 2 0 357.292 2.697 20 10 FFCDRP COc1ccc(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1Cn1cccn1 ZINC000873114315 1013390670 /nfs/dbraw/zinc/39/06/70/1013390670.db2.gz AGGQVLVXICVZJP-GOSISDBHSA-N 2 0 372.513 2.531 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)Nc2ccc(C[NH3+])cc2)[NH+](C)C)cc1 ZINC000904510440 980290134 /nfs/dbraw/zinc/29/01/34/980290134.db2.gz LYFPQPXDBYJKMC-LJQANCHMSA-N 2 0 355.486 2.636 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)Nc2ccc3c(c2)C[NH2+]C3)[NH+](C)C)cc1 ZINC000904515940 980291252 /nfs/dbraw/zinc/29/12/52/980291252.db2.gz RMUXTFWNBTVRTP-FQEVSTJZSA-N 2 0 367.497 2.780 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1O ZINC001205996037 1032101058 /nfs/dbraw/zinc/10/10/58/1032101058.db2.gz UBZLOASGUMMLBV-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(O)cc1Br ZINC001206025647 1032112045 /nfs/dbraw/zinc/11/20/45/1032112045.db2.gz OPQHEGFPEZRGIR-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921979183 987430456 /nfs/dbraw/zinc/43/04/56/987430456.db2.gz DECPIWHOVHJUAO-OAQYLSRUSA-N 2 0 352.478 2.868 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000922391157 988547269 /nfs/dbraw/zinc/54/72/69/988547269.db2.gz UCYGIXDYAVJXDK-VZHGDBGRSA-N 2 0 357.542 2.835 20 10 FFCDRP COc1ccc(C[NH2+]C[C@@H]2CN(C(=O)C[N@H+](C)C(C)C)C[C@H]2C)cc1C ZINC001107042592 993296322 /nfs/dbraw/zinc/29/63/22/993296322.db2.gz UFANCLYMBQIMLZ-IEBWSBKVSA-N 2 0 361.530 2.528 20 10 FFCDRP Cc1cccc(C[N@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000809694630 994571171 /nfs/dbraw/zinc/57/11/71/994571171.db2.gz RCVWSENNQFXPHC-UHFFFAOYSA-N 2 0 353.510 2.950 20 10 FFCDRP CCO[C@@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@H]1C[NH3+] ZINC000844903929 998214668 /nfs/dbraw/zinc/21/46/68/998214668.db2.gz SDCXWFWBLRQAJZ-WIYYLYMNSA-N 2 0 356.466 2.767 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1O ZINC000846143282 1000218098 /nfs/dbraw/zinc/21/80/98/1000218098.db2.gz DGCOUJAEUACWHA-OAHLLOKOSA-N 2 0 371.481 2.543 20 10 FFCDRP COc1cc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c(O)cc1C ZINC000768465018 1000263907 /nfs/dbraw/zinc/26/39/07/1000263907.db2.gz JFSYIKJVENLDBG-UHFFFAOYSA-N 2 0 361.530 2.700 20 10 FFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CN1C(C)=O ZINC000775720211 1003786933 /nfs/dbraw/zinc/78/69/33/1003786933.db2.gz IRRJOAJGLRUHGR-LEWJYISDSA-N 2 0 372.557 2.660 20 10 FFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@H]1COc2ccccc2O1 ZINC000775643575 1004909555 /nfs/dbraw/zinc/90/95/55/1004909555.db2.gz RFWNUVSRPXSWEY-FQEVSTJZSA-N 2 0 367.493 2.710 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775676347 1005071709 /nfs/dbraw/zinc/07/17/09/1005071709.db2.gz RGCGOJCUZUOLGU-UHFFFAOYSA-N 2 0 350.510 2.890 20 10 FFCDRP COc1cc(C[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850119793 1005787379 /nfs/dbraw/zinc/78/73/79/1005787379.db2.gz SUKZLKQKZFGHCP-INIZCTEOSA-N 2 0 363.546 2.671 20 10 FFCDRP COc1ccc(N2CC[C@H]([NH2+]Cc3cn(-c4cc[nH+]cc4)nc3C)C2)cc1 ZINC000850346748 1005808919 /nfs/dbraw/zinc/80/89/19/1005808919.db2.gz IXOYPKCQJNAQDG-SFHVURJKSA-N 2 0 363.465 2.953 20 10 FFCDRP C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850411955 1005813616 /nfs/dbraw/zinc/81/36/16/1005813616.db2.gz PETOUHDXXILRKS-XMSQKQJNSA-N 2 0 353.510 2.693 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(OC)c1 ZINC000883284286 1006733050 /nfs/dbraw/zinc/73/30/50/1006733050.db2.gz JXLCMHJUARFARG-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP CCOc1ccc(O)c(C[N@@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c1 ZINC000817414410 1007593027 /nfs/dbraw/zinc/59/30/27/1007593027.db2.gz YUKTUEQLUJCJLV-UHFFFAOYSA-N 2 0 361.530 2.783 20 10 FFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000817893795 1007800430 /nfs/dbraw/zinc/80/04/30/1007800430.db2.gz HYORPLQHUIMVNT-BHDDXSALSA-N 2 0 357.542 2.906 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902535 1007804969 /nfs/dbraw/zinc/80/49/69/1007804969.db2.gz SPRADVLULSFUEL-SESVDKBCSA-N 3 0 374.548 2.978 20 10 FFCDRP C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NC[C@@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@@H+]2C1 ZINC001180179476 1009573293 /nfs/dbraw/zinc/57/32/93/1009573293.db2.gz PDBWXWQGUNSRQV-LMQGHGSNSA-N 2 0 372.557 2.592 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167811 1032797773 /nfs/dbraw/zinc/79/77/73/1032797773.db2.gz RUZSKRXHGMSXNU-QFIPXVFZSA-N 3 0 356.558 2.842 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167516 1032800480 /nfs/dbraw/zinc/80/04/80/1032800480.db2.gz NALGAQXTMSMXER-JOCHJYFZSA-N 3 0 372.557 2.548 20 10 FFCDRP Oc1cccc2c1[C@H]([NH2+]CC1(O)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000397491096 1020291239 /nfs/dbraw/zinc/29/12/39/1020291239.db2.gz JBBJFSPIQSRPRK-LJQANCHMSA-N 2 0 352.478 2.996 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)cc2)CC1 ZINC000903217559 1020746914 /nfs/dbraw/zinc/74/69/14/1020746914.db2.gz XFDTVRBYSBPULD-CZAFVFSZSA-N 3 0 354.542 2.686 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)cc2F)CC1 ZINC000155321478 1022240214 /nfs/dbraw/zinc/24/02/14/1022240214.db2.gz TVLNOZVBUKECAA-QGZVFWFLSA-N 3 0 362.537 2.788 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)C[C@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001122414012 1023253298 /nfs/dbraw/zinc/25/32/98/1023253298.db2.gz ITNDQLOPGIFQTO-VQTJNVASSA-N 2 0 354.498 2.562 20 10 FFCDRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000756643480 1023739904 /nfs/dbraw/zinc/73/99/04/1023739904.db2.gz UYASSVJRTQZFSO-CQSZACIVSA-N 2 0 365.493 2.809 20 10 FFCDRP CC[N@@H+]1CC[C@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000248041127 1027371832 /nfs/dbraw/zinc/37/18/32/1027371832.db2.gz SUTAWWNUVAWWAJ-UGKGYDQZSA-N 2 0 374.573 2.527 20 10 FFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CN1C1CC1 ZINC000092856003 1027478225 /nfs/dbraw/zinc/47/82/25/1027478225.db2.gz XWJMLOGVISOBEP-RXVVDRJESA-N 2 0 368.569 2.933 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000780542510 1028730198 /nfs/dbraw/zinc/73/01/98/1028730198.db2.gz QZYXUKYCUMFOMN-UHFFFAOYSA-N 2 0 366.509 2.912 20 10 FFCDRP CC(C)N(CCC[NH3+])c1ccc(CN2CC[NH+](C(C)C)CC2)cc1F ZINC001164129105 1029180086 /nfs/dbraw/zinc/18/00/86/1029180086.db2.gz YDMNNFJRBBYCNU-UHFFFAOYSA-N 2 0 350.526 2.915 20 10 FFCDRP c1cc(N2CCCCC2)ccc1C[NH2+]C1CCC([NH+]2CCNCC2)CC1 ZINC000841087734 1030027286 /nfs/dbraw/zinc/02/72/86/1030027286.db2.gz RYFWSZWZKZBGHF-UHFFFAOYSA-N 2 0 356.558 2.983 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C(C)(C)[C@H]([NH3+])c2ccccc2)cc1 ZINC000841846536 1030499366 /nfs/dbraw/zinc/49/93/66/1030499366.db2.gz PLECOQQOOIJKEV-RBUKOAKNSA-N 2 0 354.498 2.595 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CCO)c3ccccc3F)cc2)CC1 ZINC000842762369 1030945444 /nfs/dbraw/zinc/94/54/44/1030945444.db2.gz DXROVDVDAPBTHE-NRFANRHFSA-N 2 0 357.473 2.791 20 10 FFCDRP Fc1ccc(CN2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001204646338 1031398911 /nfs/dbraw/zinc/39/89/11/1031398911.db2.gz PRXOQAMYCXHRRD-UHFFFAOYSA-N 2 0 368.500 2.553 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139257103 1035030520 /nfs/dbraw/zinc/03/05/20/1035030520.db2.gz RMSJKBAFHJASKP-GOSISDBHSA-N 2 0 357.454 2.511 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139259180 1035031322 /nfs/dbraw/zinc/03/13/22/1035031322.db2.gz LPEDXHVTSWCVRZ-GOSISDBHSA-N 2 0 357.454 2.511 20 10 FFCDRP CCc1noc([C@@H]2CCC[N@H+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)C2)n1 ZINC001139258629 1035032259 /nfs/dbraw/zinc/03/22/59/1035032259.db2.gz VFBWCCKQIDHPCB-OAHLLOKOSA-N 2 0 374.485 2.787 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@]1(O)C(F)(F)F ZINC001139408743 1035094029 /nfs/dbraw/zinc/09/40/29/1035094029.db2.gz PWFNIOSZSKAOSX-YJBOKZPZSA-N 2 0 371.447 2.574 20 10 FFCDRP CCOC(=O)C1(C)CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140304448 1035426149 /nfs/dbraw/zinc/42/61/49/1035426149.db2.gz QAPJXANFIALFMQ-UHFFFAOYSA-N 2 0 373.541 2.994 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000835039838 1035491790 /nfs/dbraw/zinc/49/17/90/1035491790.db2.gz KIQABTTXOFDTLO-FBQZBAQISA-N 2 0 365.521 2.992 20 10 FFCDRP CN(C)c1ccc(/C=C/C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052733 1035493516 /nfs/dbraw/zinc/49/35/16/1035493516.db2.gz HIESVNJOSZHDHE-BDNZGDGKSA-N 2 0 356.558 2.866 20 10 FFCDRP CC(C)N1CCOC[C@]2(CCC[N@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836974 1036091211 /nfs/dbraw/zinc/09/12/11/1036091211.db2.gz XZLWSNBWMSGTTB-NRFANRHFSA-N 2 0 361.530 2.781 20 10 FFCDRP COc1cc(Cl)cc(CN(CCC[NH+](C)C)CCC[NH+](C)C)c1O ZINC001233290052 1036494974 /nfs/dbraw/zinc/49/49/74/1036494974.db2.gz FMOQAFQLCWBTFC-UHFFFAOYSA-N 2 0 357.926 2.760 20 10 FFCDRP Oc1cc(O)c(CN2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487294 1036655022 /nfs/dbraw/zinc/65/50/22/1036655022.db2.gz XWAHNSRBHGLXHL-AEFFLSMTSA-N 2 0 354.450 2.757 20 10 FFCDRP COc1cc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc(OC)c1 ZINC001235662544 1037669270 /nfs/dbraw/zinc/66/92/70/1037669270.db2.gz DNFGUYLRWULRMB-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP c1ccc(CO[C@@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688110 1037682533 /nfs/dbraw/zinc/68/25/33/1037682533.db2.gz NJJVQDQFDDAASI-JOCHJYFZSA-N 2 0 351.494 2.887 20 10 FFCDRP CN(CC[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1)Cc1ccccc1 ZINC001236306706 1038035674 /nfs/dbraw/zinc/03/56/74/1038035674.db2.gz BKCJILACBOSMIC-UHFFFAOYSA-N 2 0 352.526 2.660 20 10 FFCDRP COc1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)cc1Br ZINC001236321087 1038044256 /nfs/dbraw/zinc/04/42/56/1038044256.db2.gz OVKHNTDBQZNYDU-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP CO[C@H]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C[C@@H]21 ZINC001236937752 1038367273 /nfs/dbraw/zinc/36/72/73/1038367273.db2.gz DUKQBXFOJXJIEL-PBEJRMEISA-N 2 0 361.505 2.824 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4ccccn4)C3)c(F)c2)CC1 ZINC001236944090 1038372917 /nfs/dbraw/zinc/37/29/17/1038372917.db2.gz ZNZQMKCQBQXEEN-IBGZPJMESA-N 2 0 370.472 2.626 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CN1Cc1ccccc1 ZINC001246173805 1039266476 /nfs/dbraw/zinc/26/64/76/1039266476.db2.gz MRIBFKKYYFTDTO-DENIHFKCSA-N 2 0 364.537 2.849 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CC[NH+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552020 /nfs/dbraw/zinc/55/20/20/1039552020.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 3 0 356.558 2.746 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001249201221 1040625718 /nfs/dbraw/zinc/62/57/18/1040625718.db2.gz LBDDXYPMAOKXEI-IBGZPJMESA-N 2 0 360.498 2.948 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)c(Cl)c1 ZINC001279333651 1043007809 /nfs/dbraw/zinc/00/78/09/1043007809.db2.gz JQSNTGRLEYHQFO-UHFFFAOYSA-N 2 0 364.965 2.865 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)cc2F)CC1 ZINC001327006134 1047159202 /nfs/dbraw/zinc/15/92/02/1047159202.db2.gz XBBMUOXBSRLWRR-UHFFFAOYSA-N 2 0 360.521 2.543 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)CC[C@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001343047088 1051664012 /nfs/dbraw/zinc/66/40/12/1051664012.db2.gz IVEFZUUJMRHHRZ-SFTDATJTSA-N 2 0 368.525 2.952 20 10 FFCDRP C[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[C@@H]([NH3+])c1ccccc1 ZINC001343048104 1051664760 /nfs/dbraw/zinc/66/47/60/1051664760.db2.gz SSEITVYFIFBHHD-ZLGUVYLKSA-N 2 0 368.525 2.808 20 10 FFCDRP Fc1cc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)ccc1N1CCOCC1 ZINC000849350709 1056835910 /nfs/dbraw/zinc/83/59/10/1056835910.db2.gz SHYQEPRXDMQPGY-IBGZPJMESA-N 2 0 361.505 2.874 20 10 FFCDRP Cc1nn(C)c(C)c1C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001461242292 1061262783 /nfs/dbraw/zinc/26/27/83/1061262783.db2.gz PKLBLZIMYINTQH-INIZCTEOSA-N 2 0 355.530 2.510 20 10 FFCDRP COC(=O)c1c(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c2cc(F)ccc2n1C ZINC001462327274 1061585888 /nfs/dbraw/zinc/58/58/88/1061585888.db2.gz OPWVZXVUXUJQJQ-CQSZACIVSA-N 2 0 361.461 2.926 20 10 FFCDRP C[NH2+]CCc1ccccc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC001523575966 1062526487 /nfs/dbraw/zinc/52/64/87/1062526487.db2.gz CIOOBYWJDORRFF-OAQYLSRUSA-N 2 0 368.525 2.547 20 10 FFCDRP CC[C@](C)(C[NH3+])C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948325 1078288753 /nfs/dbraw/zinc/28/87/53/1078288753.db2.gz IXVHPRVBRMPKRH-MAUKXSAKSA-N 2 0 353.894 2.501 20 10 FFCDRP CCCOc1ncccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560293088 1076260907 /nfs/dbraw/zinc/26/09/07/1076260907.db2.gz NCRVNOYVBLPKDG-UHFFFAOYSA-N 2 0 354.498 2.912 20 10 FFCDRP CC[C@@H]1[C@@H](C(=O)N(C)C[C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@@H+]1C ZINC001571388426 1077249733 /nfs/dbraw/zinc/24/97/33/1077249733.db2.gz PYBNYYMDMXOBTH-YTQUADARSA-N 2 0 361.530 2.670 20 10 FFCDRP C[N@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccccc1O ZINC000109828559 507990824 /nfs/dbraw/zinc/99/08/24/507990824.db2.gz DNTFMFBLZXKHSM-UHFFFAOYSA-N 2 0 367.493 2.736 20 10 FFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000186601898 509795865 /nfs/dbraw/zinc/79/58/65/509795865.db2.gz NOWRIQVTCKONRS-KBPBESRZSA-N 2 0 370.335 2.831 20 10 FFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000186601952 509796792 /nfs/dbraw/zinc/79/67/92/509796792.db2.gz NOWRIQVTCKONRS-ZIAGYGMSSA-N 2 0 370.335 2.831 20 10 FFCDRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(Br)ccc1O ZINC000282357495 510944029 /nfs/dbraw/zinc/94/40/29/510944029.db2.gz PNJQHGLLYOCJKZ-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000273596476 511546519 /nfs/dbraw/zinc/54/65/19/511546519.db2.gz QWQPBLKUHYCMAJ-KRWDZBQOSA-N 2 0 370.497 2.659 20 10 FFCDRP Oc1cccc(Br)c1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000862220066 730677595 /nfs/dbraw/zinc/67/75/95/730677595.db2.gz LHEVOHLULXDVRA-UHFFFAOYSA-N 2 0 369.303 2.699 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)cc1F ZINC000760703083 736661940 /nfs/dbraw/zinc/66/19/40/736661940.db2.gz NPKWUDMSRFJTSQ-UHFFFAOYSA-N 2 0 351.510 2.997 20 10 FFCDRP CC(C)[C@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391141 738135977 /nfs/dbraw/zinc/13/59/77/738135977.db2.gz SWKFEMZFDMTBCV-UWIFEVILSA-N 2 0 356.869 2.754 20 10 FFCDRP CC[C@H](COCC(F)(F)F)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824556086 743104244 /nfs/dbraw/zinc/10/42/44/743104244.db2.gz ZTZQFXIUIOVJSH-MRXNPFEDSA-N 2 0 359.436 2.886 20 10 FFCDRP C[C@@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)C1CC[NH+](C)CC1 ZINC000840761002 747175933 /nfs/dbraw/zinc/17/59/33/747175933.db2.gz MZYQGWYAEMBNTC-CQSZACIVSA-N 2 0 353.457 2.621 20 10 FFCDRP Cc1cc(Br)cc(C[N@@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c1O ZINC000843125510 747777401 /nfs/dbraw/zinc/77/74/01/747777401.db2.gz XLQKPDYSNUOYFO-AWEZNQCLSA-N 2 0 369.303 2.650 20 10 FFCDRP CC(C)C[N@@H+](CC(=O)NCc1ccc(N(C)C)cc1)CC1CC[NH+](C)CC1 ZINC001175601276 1013508223 /nfs/dbraw/zinc/50/82/23/1013508223.db2.gz ITZPTEKFLJIMEX-UHFFFAOYSA-N 2 0 374.573 2.669 20 10 FFCDRP COc1cc(O)c(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1OC ZINC000904472384 980282755 /nfs/dbraw/zinc/28/27/55/980282755.db2.gz FTEZBKODIKPMSO-HRAATJIYSA-N 2 0 370.449 2.755 20 10 FFCDRP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4c(O)cc(O)cc4O)C[C@@H]3C2)cc1 ZINC001144509680 998622687 /nfs/dbraw/zinc/62/26/87/998622687.db2.gz IAHCBODPQHNKNR-CALCHBBNSA-N 2 0 354.450 2.676 20 10 FFCDRP C[C@@H](O)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1F ZINC000846017369 1000193910 /nfs/dbraw/zinc/19/39/10/1000193910.db2.gz NTOLWEIYQXSECM-IIBYNOLFSA-N 2 0 357.473 2.789 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712916 1003758509 /nfs/dbraw/zinc/75/85/09/1003758509.db2.gz RZABXNCDNMCAIT-NRFANRHFSA-N 3 0 356.558 2.889 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc([S@](C)=O)cc1 ZINC000775726557 1003860094 /nfs/dbraw/zinc/86/00/94/1003860094.db2.gz VLHXEIWTYJRMOU-SANMLTNESA-N 2 0 371.550 2.808 20 10 FFCDRP C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775659058 1004974791 /nfs/dbraw/zinc/97/47/91/1004974791.db2.gz UNCODFSCEAXNJW-IBGZPJMESA-N 2 0 353.510 2.821 20 10 FFCDRP CCOc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850357402 1005810560 /nfs/dbraw/zinc/81/05/60/1005810560.db2.gz IMIAPLGRRACHLQ-LJQANCHMSA-N 2 0 356.466 2.647 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000853093068 1006292679 /nfs/dbraw/zinc/29/26/79/1006292679.db2.gz AUEFUQKXLMOKAT-NRFANRHFSA-N 3 0 356.558 2.650 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)n1 ZINC000883283623 1006730247 /nfs/dbraw/zinc/73/02/47/1006730247.db2.gz MCGTVICBTORZIH-UHFFFAOYSA-N 2 0 354.498 2.749 20 10 FFCDRP C[NH+]1CCN(c2ncccc2C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816544705 1007104128 /nfs/dbraw/zinc/10/41/28/1007104128.db2.gz QIGGPURWQFTBCR-UHFFFAOYSA-N 2 0 362.477 2.982 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[N@H+](C)Cc4ccccc43)cc2)CC1 ZINC000816618506 1007139189 /nfs/dbraw/zinc/13/91/89/1007139189.db2.gz ZMUOAVQSGBJHJK-UHFFFAOYSA-N 2 0 350.510 2.890 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817893871 1007800470 /nfs/dbraw/zinc/80/04/70/1007800470.db2.gz JLMUZRKULZESAN-DFQSSKMNSA-N 2 0 361.505 2.797 20 10 FFCDRP C[C@@H]1OC[C@]2(CC[C@H](C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)O2)[C@H]1C ZINC000886338484 1008642128 /nfs/dbraw/zinc/64/21/28/1008642128.db2.gz LSZTXCKCBKWZQW-MOXQZVSFSA-N 2 0 373.541 2.501 20 10 FFCDRP Fc1cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)ccc1N1CCOCC1 ZINC000925480697 1017764006 /nfs/dbraw/zinc/76/40/06/1017764006.db2.gz MZCAQGGMCHVBLM-QUCCMNQESA-N 2 0 361.505 2.920 20 10 FFCDRP COc1cc(CN2CCC([N@@H+]3CC[C@H](O)C3)CC2)c(O)c(C(C)(C)C)c1 ZINC000827698697 1018618904 /nfs/dbraw/zinc/61/89/04/1018618904.db2.gz AXZILOJZUJYIAW-KRWDZBQOSA-N 2 0 362.514 2.729 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)c(O)c1 ZINC000756854917 1023759852 /nfs/dbraw/zinc/75/98/52/1023759852.db2.gz BQQMSXSIFTXSTM-PXNSSMCTSA-N 2 0 369.509 2.640 20 10 FFCDRP COc1cc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(O)cc1C ZINC000758265302 1024007565 /nfs/dbraw/zinc/00/75/65/1024007565.db2.gz QLSQEWINRJVEKZ-UHFFFAOYSA-N 2 0 361.530 2.559 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cccc(N(C)C)[nH+]3)CC2)cc1 ZINC001156256818 1029114674 /nfs/dbraw/zinc/11/46/74/1029114674.db2.gz IHOVRDLJEBCELA-UHFFFAOYSA-N 2 0 369.513 2.780 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(CO)C4CC5CC(C4)CC3C5)cc2)CC1 ZINC000840964690 1029948723 /nfs/dbraw/zinc/94/87/23/1029948723.db2.gz ZMRHGYKCKISKJF-UHFFFAOYSA-N 2 0 369.553 2.715 20 10 FFCDRP Cc1cccc2nc(CC[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cn21 ZINC000842783217 1030957246 /nfs/dbraw/zinc/95/72/46/1030957246.db2.gz XSONTUFWQQINDM-UHFFFAOYSA-N 2 0 363.509 2.727 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCN(c3ccc(Cl)cc3)CC1)C[NH2+]CCO2 ZINC001204621984 1031393309 /nfs/dbraw/zinc/39/33/09/1031393309.db2.gz UPYRROBHFQMYHD-UHFFFAOYSA-N 2 0 373.884 2.850 20 10 FFCDRP Cc1ccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001204621843 1031393401 /nfs/dbraw/zinc/39/34/01/1031393401.db2.gz OSRZTXPXRPKUNQ-UHFFFAOYSA-N 2 0 350.510 2.727 20 10 FFCDRP CCOC(=O)C[C@@H]1CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139254572 1035030152 /nfs/dbraw/zinc/03/01/52/1035030152.db2.gz ITPOGJBQPQAHMO-HNNXBMFYSA-N 2 0 364.486 2.628 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](CO)(C(F)(F)F)C3)cc2)CC1 ZINC001140302102 1035424839 /nfs/dbraw/zinc/42/48/39/1035424839.db2.gz JTZUEJKWKIVBOY-SFHVURJKSA-N 2 0 371.447 2.575 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3cnccn3)cc2)CC1 ZINC001140303791 1035426299 /nfs/dbraw/zinc/42/62/99/1035426299.db2.gz ASBIMFYEYSEKLE-OAQYLSRUSA-N 2 0 351.498 2.956 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CCC(=O)O4)C3)cc2)CC1 ZINC001140305576 1035427321 /nfs/dbraw/zinc/42/73/21/1035427321.db2.gz CRCDAOWSIKOWSF-NRFANRHFSA-N 2 0 357.498 2.500 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(c4nnc(C)o4)CC3)cc2)CC1 ZINC001140306215 1035427427 /nfs/dbraw/zinc/42/74/27/1035427427.db2.gz POHWSCHXZGSYAF-UHFFFAOYSA-N 2 0 369.513 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](CC(=O)OC)C3CCCC3)cc2)CC1 ZINC001140305593 1035427677 /nfs/dbraw/zinc/42/76/77/1035427677.db2.gz DEEMDVWDWCMBSK-UHFFFAOYSA-N 2 0 359.514 2.746 20 10 FFCDRP CCN(CC)c1ccc(C[N@H+](CCC[NH+](C)C)CCC(=O)OC)c(O)c1 ZINC001140855002 1036290586 /nfs/dbraw/zinc/29/05/86/1036290586.db2.gz JOPWNPCLADDOJR-UHFFFAOYSA-N 2 0 365.518 2.555 20 10 FFCDRP CC1CCC([NH+]2CCN(Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)CC1 ZINC001235669703 1037675323 /nfs/dbraw/zinc/67/53/23/1037675323.db2.gz HWLCJWNHXMWEDO-UHFFFAOYSA-N 2 0 359.514 2.571 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3cc4ccccc4cc3O)C[C@H]1C[NH2+]CC2 ZINC001236041980 1037906651 /nfs/dbraw/zinc/90/66/51/1037906651.db2.gz ZAROASVSQZTOID-WIYYLYMNSA-N 2 0 354.450 2.520 20 10 FFCDRP COc1cc(C)c(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c(O)c1 ZINC001236809456 1038284176 /nfs/dbraw/zinc/28/41/76/1038284176.db2.gz RYWNZWCEEIULCT-HDICACEKSA-N 2 0 353.466 2.668 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4ccccn4)C3)c(F)c2)CC1 ZINC001236938783 1038369371 /nfs/dbraw/zinc/36/93/71/1038369371.db2.gz NHAHSUMEXZFHDR-GOSISDBHSA-N 2 0 354.473 2.962 20 10 FFCDRP CCOc1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001237043039 1038420535 /nfs/dbraw/zinc/42/05/35/1038420535.db2.gz MZHLWSGOBWTGKA-UHFFFAOYSA-N 2 0 370.497 2.642 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC4(CCC[NH2+]C4)CC3)cc2)CC1 ZINC001246185163 1039268319 /nfs/dbraw/zinc/26/83/19/1039268319.db2.gz SZZNCTOFBHHISM-UHFFFAOYSA-N 3 0 356.558 2.840 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)COc2ccc(F)cc2)CC1 ZINC001251946855 1039374538 /nfs/dbraw/zinc/37/45/38/1039374538.db2.gz FEUFRALHKHFSEL-LJQANCHMSA-N 2 0 374.456 2.525 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCC[N@@H+]([C@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701976 1039441725 /nfs/dbraw/zinc/44/17/25/1039441725.db2.gz JQPWEGGSBQMSNI-KAGYGMCKSA-N 2 0 373.541 2.755 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490137 1039840940 /nfs/dbraw/zinc/84/09/40/1039840940.db2.gz APFKDYLWNFBJKT-IYBDPMFKSA-N 2 0 368.905 2.810 20 10 FFCDRP Oc1ccc([C@H](O)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1O ZINC001255122683 1041157802 /nfs/dbraw/zinc/15/78/02/1041157802.db2.gz IUXLKTFVRDREAA-NXWNEQKCSA-N 2 0 368.477 2.916 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(CN(CC[NH+](C)C)C3)C2)cc1 ZINC001279282607 1042982222 /nfs/dbraw/zinc/98/22/22/1042982222.db2.gz SPACAZRBYDLQBO-UHFFFAOYSA-N 2 0 352.526 2.773 20 10 FFCDRP Cc1cccc(C[N@@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c1O ZINC001279290440 1042985843 /nfs/dbraw/zinc/98/58/43/1042985843.db2.gz OPMHYLOZLAVPTD-OAQYLSRUSA-N 2 0 354.498 2.885 20 10 FFCDRP CN1CCN(c2ccc(C[N@H+](CCCO)CC(C)(C)C)cc2F)CC1 ZINC001319822972 1045278776 /nfs/dbraw/zinc/27/87/76/1045278776.db2.gz JGFRULFKAHGJQI-UHFFFAOYSA-N 2 0 351.510 2.808 20 10 FFCDRP Cc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)ccc2c[nH+]cn21 ZINC001289600295 1047707163 /nfs/dbraw/zinc/70/71/63/1047707163.db2.gz PXWZYLFMQQEXHN-FQEVSTJZSA-N 2 0 365.481 2.741 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104159 1052259951 /nfs/dbraw/zinc/25/99/51/1052259951.db2.gz KCGOBNANNGNAKD-UYAOXDASSA-N 2 0 360.521 2.542 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)N2CC[NH+](CC)CC2)cc1F ZINC001308199222 1052431099 /nfs/dbraw/zinc/43/10/99/1052431099.db2.gz HTKBJMCTWLRXAZ-QGZVFWFLSA-N 2 0 350.526 2.788 20 10 FFCDRP CCc1cccc(C[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1O ZINC000848896079 1055324528 /nfs/dbraw/zinc/32/45/28/1055324528.db2.gz ZRARJQZKBPMJMH-UHFFFAOYSA-N 2 0 354.498 2.652 20 10 FFCDRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccccc1O ZINC000156633230 508453869 /nfs/dbraw/zinc/45/38/69/508453869.db2.gz MPZBXBZCODEMKI-LJQANCHMSA-N 2 0 355.482 2.925 20 10 FFCDRP COc1cccc(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)c1O ZINC000192357987 509479616 /nfs/dbraw/zinc/47/96/16/509479616.db2.gz UGQYTVQOSFBHNF-LJQANCHMSA-N 2 0 356.466 2.782 20 10 FFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000186590781 509788836 /nfs/dbraw/zinc/78/88/36/509788836.db2.gz GHHHDOIYZUUVPR-KBPBESRZSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000187182055 510107640 /nfs/dbraw/zinc/10/76/40/510107640.db2.gz AOCVTVKNZBRKED-UONOGXRCSA-N 2 0 370.335 2.750 20 10 FFCDRP CCCOc1ccc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)c(O)c1 ZINC000289399956 511099360 /nfs/dbraw/zinc/09/93/60/511099360.db2.gz GGPGEBNIATXPMG-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000858245389 730420749 /nfs/dbraw/zinc/42/07/49/730420749.db2.gz RVZDVVLCJROWEA-GFCCVEGCSA-N 2 0 357.292 2.985 20 10 FFCDRP C[C@H]([NH2+]CCCCCN1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000925843985 738535420 /nfs/dbraw/zinc/53/54/20/738535420.db2.gz HQVPQBJJEUXCJU-AWEZNQCLSA-N 2 0 370.335 2.881 20 10 FFCDRP CC[C@@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc(Cl)ccc1O ZINC000925857978 738538237 /nfs/dbraw/zinc/53/82/37/738538237.db2.gz RCVGMZMILWBBCD-DZGCQCFKSA-N 2 0 352.862 2.772 20 10 FFCDRP C[N@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc(N2CCOCC2)cc1 ZINC000873200599 731889913 /nfs/dbraw/zinc/88/99/13/731889913.db2.gz HDXRHRVEQBHIFF-UHFFFAOYSA-N 2 0 357.523 2.862 20 10 FFCDRP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000756400053 736327711 /nfs/dbraw/zinc/32/77/11/736327711.db2.gz ULHZPVUDJZJXRR-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H](C(N)=O)C2)c1O ZINC000808693097 741252458 /nfs/dbraw/zinc/25/24/58/741252458.db2.gz WAPVYKFEGHJBID-KGLIPLIRSA-N 2 0 353.894 2.592 20 10 FFCDRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898519 742221374 /nfs/dbraw/zinc/22/13/74/742221374.db2.gz IEMRKNKZDLOIRA-GJZGRUSLSA-N 2 0 357.445 2.600 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902497 748132301 /nfs/dbraw/zinc/13/23/01/748132301.db2.gz OABNKSZPCOYCAH-VBNZEHGJSA-N 2 0 354.878 2.773 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(OC)nc3)cc2F)CC1 ZINC000780519142 969192248 /nfs/dbraw/zinc/19/22/48/969192248.db2.gz NTEMJQHATDPDJJ-UHFFFAOYSA-N 2 0 358.461 2.661 20 10 FFCDRP COc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001168236742 981124627 /nfs/dbraw/zinc/12/46/27/981124627.db2.gz ZBZOKTVRZMYGSY-FQEVSTJZSA-N 2 0 351.494 2.704 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@H](C(F)(F)F)O1 ZINC000877824054 1014743304 /nfs/dbraw/zinc/74/33/04/1014743304.db2.gz ONVKVJNICKYFIE-MAUKXSAKSA-N 2 0 371.447 2.980 20 10 FFCDRP CCc1noc([C@H]2CC[C@@H]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000922865099 988966107 /nfs/dbraw/zinc/96/61/07/988966107.db2.gz TVWQFLOKVOAPOQ-ZWKOTPCHSA-N 2 0 369.513 2.810 20 10 FFCDRP CN(CCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccco1 ZINC000809717885 994592578 /nfs/dbraw/zinc/59/25/78/994592578.db2.gz CAGMBTVCQBBLFW-UHFFFAOYSA-N 2 0 370.541 2.985 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCC4)[C@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811518197 995162057 /nfs/dbraw/zinc/16/20/57/995162057.db2.gz GSDMGGMAYZBFTC-NHCUHLMSSA-N 2 0 355.526 2.972 20 10 FFCDRP Oc1ccccc1C[N@H+](C[C@H]1CCCO1)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719174 1016149859 /nfs/dbraw/zinc/14/98/59/1016149859.db2.gz WJRCFTNDNHXMLX-MOPGFXCFSA-N 2 0 360.498 2.532 20 10 FFCDRP C[C@H](O)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1F ZINC000846017367 1000194097 /nfs/dbraw/zinc/19/40/97/1000194097.db2.gz NTOLWEIYQXSECM-HRAATJIYSA-N 2 0 357.473 2.789 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)cc1F ZINC000846219988 1000232815 /nfs/dbraw/zinc/23/28/15/1000232815.db2.gz HVSMRAKKGIHFNG-UHFFFAOYSA-N 2 0 355.457 2.802 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)C(=O)NCC3CCCC3)cc2)CC1 ZINC000771855293 1001230841 /nfs/dbraw/zinc/23/08/41/1001230841.db2.gz IKDPNEZEZKPJJY-UHFFFAOYSA-N 2 0 372.557 2.613 20 10 FFCDRP Cc1cccc(C[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)c1O ZINC000775681274 1003635448 /nfs/dbraw/zinc/63/54/48/1003635448.db2.gz OJRRCDFAHHRQON-UHFFFAOYSA-N 2 0 353.510 2.950 20 10 FFCDRP C[C@@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000775833494 1004546046 /nfs/dbraw/zinc/54/60/46/1004546046.db2.gz JZUXNHTUYWMBGU-UTKZUKDTSA-N 2 0 368.525 2.822 20 10 FFCDRP C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677365 1005003640 /nfs/dbraw/zinc/00/36/40/1005003640.db2.gz ALYUPMOOZROXIG-HSALFYBXSA-N 2 0 358.574 2.894 20 10 FFCDRP Cn1cc(C[C@H]2CCC[C@H]2[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000850384896 1005812296 /nfs/dbraw/zinc/81/22/96/1005812296.db2.gz SRQZLUYODRJSHU-IFMALSPDSA-N 2 0 367.541 2.673 20 10 FFCDRP C[C@@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+](C)Cc1ccccc1O ZINC000111235260 1006363454 /nfs/dbraw/zinc/36/34/54/1006363454.db2.gz WFDKFFHSEQJUSC-PXNSSMCTSA-N 2 0 367.493 2.603 20 10 FFCDRP CC(=O)Nc1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283803 1006730199 /nfs/dbraw/zinc/73/01/99/1006730199.db2.gz UDXXJFAUBNKQNO-UHFFFAOYSA-N 2 0 352.482 2.687 20 10 FFCDRP COC(=O)CC1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000883290635 1006735971 /nfs/dbraw/zinc/73/59/71/1006735971.db2.gz ATWNYBHFSQGUHQ-UHFFFAOYSA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893839 1007799766 /nfs/dbraw/zinc/79/97/66/1007799766.db2.gz IZXCZAWIFWHQOD-FDDCHVKYSA-N 2 0 367.537 2.943 20 10 FFCDRP C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000817940703 1007818719 /nfs/dbraw/zinc/81/87/19/1007818719.db2.gz GXCOZLAVTIMJCC-MGPUTAFESA-N 2 0 354.498 2.805 20 10 FFCDRP C[NH+]1CCN(c2ccc(CC[NH2+]Cc3ccc4c(c3)CCO4)cc2)CC1 ZINC001179830360 1009464258 /nfs/dbraw/zinc/46/42/58/1009464258.db2.gz PHWXLHXSRRRXLL-UHFFFAOYSA-N 2 0 351.494 2.706 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@@H+]1C ZINC000773145611 1009667848 /nfs/dbraw/zinc/66/78/48/1009667848.db2.gz KELGADJYXUYIDH-NQIIRXRSSA-N 3 0 356.558 2.791 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC(C4CC4)(C4CC4)C3)cc2)CC1 ZINC000827537665 1018447537 /nfs/dbraw/zinc/44/75/37/1018447537.db2.gz GROBCXFZHYUAAE-UHFFFAOYSA-N 2 0 355.526 2.829 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]CC4)cc2)CC1 ZINC001222314084 1032886990 /nfs/dbraw/zinc/88/69/90/1032886990.db2.gz BXHGMCQMWCXYDA-JOCHJYFZSA-N 3 0 356.558 2.937 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c(O)c1 ZINC000756531619 1023724088 /nfs/dbraw/zinc/72/40/88/1023724088.db2.gz AUHFWMKSENSXST-GOSISDBHSA-N 2 0 369.513 2.744 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C[S@@](C)=O)c3ccccc3)cc2)CC1 ZINC000780895456 1028853324 /nfs/dbraw/zinc/85/33/24/1028853324.db2.gz UOUJFVOWETWNRF-QFQXNSOFSA-N 2 0 371.550 2.648 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(N(C)C)cc3C)cn2)CC1 ZINC000840931359 1029931492 /nfs/dbraw/zinc/93/14/92/1029931492.db2.gz SLWHYQWOIPAYJB-UHFFFAOYSA-N 2 0 367.541 2.888 20 10 FFCDRP CCOc1cccc(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c1O ZINC000841103867 1030039231 /nfs/dbraw/zinc/03/92/31/1030039231.db2.gz LKYIQOKNQRYVAJ-UHFFFAOYSA-N 2 0 369.509 2.874 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@H]1COC2(C1)CC[NH+](Cc1ccc(O)c(O)c1)CC2 ZINC001203878354 1030953821 /nfs/dbraw/zinc/95/38/21/1030953821.db2.gz SCNJEVNKNJIEEM-QGZVFWFLSA-N 2 0 372.465 2.946 20 10 FFCDRP O=C(Nc1cccc(N2CC[NH2+]CC2)c1)c1ccccc1C1CC[NH2+]CC1 ZINC001219119842 1033523604 /nfs/dbraw/zinc/52/36/04/1033523604.db2.gz KWCQTVKHEUECEA-UHFFFAOYSA-N 2 0 364.493 2.816 20 10 FFCDRP COC(=O)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001139409953 1035094391 /nfs/dbraw/zinc/09/43/91/1035094391.db2.gz WYKSJDIDVRJATE-UHFFFAOYSA-N 2 0 359.514 2.746 20 10 FFCDRP CCOC(=O)[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305832 1035427653 /nfs/dbraw/zinc/42/76/53/1035427653.db2.gz IAEXHPGHFAUBCV-HXUWFJFHSA-N 2 0 373.541 2.994 20 10 FFCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCOC[C@]4(CCC[NH2+]C4)C3)c2c1 ZINC001235021754 1037310151 /nfs/dbraw/zinc/31/01/51/1037310151.db2.gz JJKGDKSOBKOULP-NRFANRHFSA-N 2 0 356.466 2.756 20 10 FFCDRP Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235423695 1037541548 /nfs/dbraw/zinc/54/15/48/1037541548.db2.gz GJFKMRLIVCSYRZ-QZTJIDSGSA-N 2 0 361.505 2.874 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001235676700 1037676502 /nfs/dbraw/zinc/67/65/02/1037676502.db2.gz DFMYWBJLJTWXRO-NRFANRHFSA-N 3 0 356.558 2.937 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001235676704 1037677950 /nfs/dbraw/zinc/67/79/50/1037677950.db2.gz DFMYWBJLJTWXRO-OAQYLSRUSA-N 3 0 356.558 2.937 20 10 FFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC[NH+](C)C)c(O)c1 ZINC001277976881 1037861624 /nfs/dbraw/zinc/86/16/24/1037861624.db2.gz ZIFYJRYEXVHXRU-RTBURBONSA-N 2 0 359.514 2.643 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCSc2ccccc2C1 ZINC001236240583 1037999825 /nfs/dbraw/zinc/99/98/25/1037999825.db2.gz NGFQXXVGKUGPTE-UHFFFAOYSA-N 2 0 355.507 2.910 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)COCc2ccccc2)CC1 ZINC001252306292 1039489874 /nfs/dbraw/zinc/48/98/74/1039489874.db2.gz YTRNFRNLCIMYKI-OAQYLSRUSA-N 2 0 370.493 2.524 20 10 FFCDRP Cc1c(O)ccc(C[N@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001279313695 1042996395 /nfs/dbraw/zinc/99/63/95/1042996395.db2.gz PMJADAWZUXWTRW-NRFANRHFSA-N 2 0 361.530 2.646 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279672003 1043441586 /nfs/dbraw/zinc/44/15/86/1043441586.db2.gz KGBBRRZAKPHSSW-OAQYLSRUSA-N 2 0 361.530 2.640 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC001319717849 1045250897 /nfs/dbraw/zinc/25/08/97/1045250897.db2.gz LTHHCIHSRLCCRA-UGKGYDQZSA-N 2 0 356.558 2.745 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349778 1056835627 /nfs/dbraw/zinc/83/56/27/1056835627.db2.gz HBPZKGIWRRGIII-OAQYLSRUSA-N 3 0 356.558 2.650 20 10 FFCDRP CN(C)c1ccc(C[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1F ZINC001461149694 1061226288 /nfs/dbraw/zinc/22/62/88/1061226288.db2.gz MWHPNPWHJZVBDA-OAQYLSRUSA-N 2 0 370.516 2.970 20 10 FFCDRP CC(C)Oc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC001473934284 1065421844 /nfs/dbraw/zinc/42/18/44/1065421844.db2.gz YGHKYASYFVKOGR-UHFFFAOYSA-N 2 0 354.498 2.910 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)Nc1ccccc1 ZINC001473995120 1065436560 /nfs/dbraw/zinc/43/65/60/1065436560.db2.gz DAMIRUZDHRCJNO-QGZVFWFLSA-N 2 0 352.482 2.555 20 10 FFCDRP CC[C@@](C)(C[NH3+])C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948327 1078288499 /nfs/dbraw/zinc/28/84/99/1078288499.db2.gz IXVHPRVBRMPKRH-QAPCUYQASA-N 2 0 353.894 2.501 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c(O)c1 ZINC001560751240 1076295988 /nfs/dbraw/zinc/29/59/88/1076295988.db2.gz QIZBKAMYTXKAFP-GOSISDBHSA-N 2 0 356.466 2.566 20 10 FFCDRP Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)CC2 ZINC000297524006 510978122 /nfs/dbraw/zinc/97/81/22/510978122.db2.gz DDWQTMLPKCTQHA-IBGZPJMESA-N 2 0 368.477 2.880 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCCCC[NH+](C)C)C1 ZINC000444239189 514163231 /nfs/dbraw/zinc/16/32/31/514163231.db2.gz LTAGCHNTPBFTFZ-UHFFFAOYSA-N 2 0 370.541 2.866 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH2+]C(C)(C)C2)C1 ZINC000444286269 514181418 /nfs/dbraw/zinc/18/14/18/514181418.db2.gz ZPRIUZYPSHNQCK-UHFFFAOYSA-N 2 0 368.525 2.618 20 10 FFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@]2(CC[NH2+]C2)CO1 ZINC000903732239 736161420 /nfs/dbraw/zinc/16/14/20/736161420.db2.gz DLZILQSMORGGCX-WBVHZDCISA-N 2 0 369.303 2.745 20 10 FFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)cc1 ZINC000817973549 742225500 /nfs/dbraw/zinc/22/55/00/742225500.db2.gz VAXFSFLALWEOMW-WMLDXEAASA-N 2 0 358.452 2.629 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)c1O ZINC000842478995 747613737 /nfs/dbraw/zinc/61/37/37/747613737.db2.gz NFJIUDNITMXKNM-WMZOPIPTSA-N 2 0 366.889 2.967 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)c2sccc2C[NH+](C)C)[NH+](C)C)cc1 ZINC000891251845 962604766 /nfs/dbraw/zinc/60/47/66/962604766.db2.gz HMBACEAIRWARKF-SFHVURJKSA-N 2 0 374.554 2.908 20 10 FFCDRP CCCNc1cc(C)[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC001167422817 963010676 /nfs/dbraw/zinc/01/06/76/963010676.db2.gz CKSKYZFCMQIGKP-UHFFFAOYSA-N 2 0 354.502 2.971 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000840759666 972960172 /nfs/dbraw/zinc/96/01/72/972960172.db2.gz ZTVNWQMKRAVLJQ-MNEFBYGVSA-N 2 0 365.468 2.764 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000840759668 972960650 /nfs/dbraw/zinc/96/06/50/972960650.db2.gz ZTVNWQMKRAVLJQ-ZYSHUDEJSA-N 2 0 365.468 2.764 20 10 FFCDRP Cc1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c(O)c1 ZINC000877028373 1014454969 /nfs/dbraw/zinc/45/49/69/1014454969.db2.gz VYBQPSARJOWPFI-FQEVSTJZSA-N 2 0 367.493 2.688 20 10 FFCDRP CN(C)CC[N@@H+]1CCCC2(CC[NH+](Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001279149871 980691909 /nfs/dbraw/zinc/69/19/09/980691909.db2.gz NFACKMLAYNXMOU-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1 ZINC000922391237 988549216 /nfs/dbraw/zinc/54/92/16/988549216.db2.gz AEVNPGIDRYPAOH-AYWYSENESA-N 2 0 362.514 2.750 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)cc2)CC1 ZINC000809149319 994427521 /nfs/dbraw/zinc/42/75/21/994427521.db2.gz ZLLOUTYGLPTGOE-UHFFFAOYSA-N 2 0 370.463 2.555 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCc4ccccc43)cc2)CC1 ZINC000771819432 1001218613 /nfs/dbraw/zinc/21/86/13/1001218613.db2.gz OWEIBZCMTYVYIB-UHFFFAOYSA-N 2 0 350.510 2.591 20 10 FFCDRP COc1c([O-])c(C[NH2+]CCCN2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000774953696 1003105233 /nfs/dbraw/zinc/10/52/33/1003105233.db2.gz XXXDFOUMYYDOKZ-UHFFFAOYSA-N 2 0 371.437 2.847 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH+](C4CCCCC4)CC3)cc2)CC1 ZINC000775647803 1004922180 /nfs/dbraw/zinc/92/21/80/1004922180.db2.gz ALQOUUZTNMTVNJ-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP COc1ccc(N2CC[C@@H](C[NH2+]Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC000850330325 1005807390 /nfs/dbraw/zinc/80/73/90/1005807390.db2.gz MSDPHVRUKLSLSN-KRWDZBQOSA-N 2 0 363.465 2.892 20 10 FFCDRP COC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(OC)c1 ZINC000850362596 1005811378 /nfs/dbraw/zinc/81/13/78/1005811378.db2.gz QEAOUTNTMQVIFT-JOCHJYFZSA-N 2 0 369.509 2.924 20 10 FFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc2c1CC[NH2+]C2 ZINC000852746182 1006166990 /nfs/dbraw/zinc/16/69/90/1006166990.db2.gz JIDNEQRLOAKBGN-UHFFFAOYSA-N 2 0 351.494 2.801 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230106 1006733157 /nfs/dbraw/zinc/73/31/57/1006733157.db2.gz GXNRDKBTOSNXFZ-OAHLLOKOSA-N 2 0 354.498 2.661 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC(O)(C(F)(F)F)CC3)cc2)CC1 ZINC000883289498 1006734788 /nfs/dbraw/zinc/73/47/88/1006734788.db2.gz QJOLFRHXENNGEI-UHFFFAOYSA-N 2 0 371.447 2.764 20 10 FFCDRP C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(N2CCNC2=O)cc1 ZINC000817941539 1007818991 /nfs/dbraw/zinc/81/89/91/1007818991.db2.gz KLSKFGUTIIDBKU-YWZLYKJASA-N 2 0 367.497 2.633 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)[NH+](C)C)cc1 ZINC001180178843 1009573809 /nfs/dbraw/zinc/57/38/09/1009573809.db2.gz GGXIFKTVHUOJFQ-HXUWFJFHSA-N 2 0 374.573 2.984 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCCN2CCC[N@H+](C)CC2)c(C(F)(F)F)c1 ZINC000794715821 1010564312 /nfs/dbraw/zinc/56/43/12/1010564312.db2.gz YMCOKCZTHCJISW-UHFFFAOYSA-N 2 0 372.479 2.889 20 10 FFCDRP CCOC(=O)C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173622024 1012778533 /nfs/dbraw/zinc/77/85/33/1012778533.db2.gz ITPCGODFOLUKFH-OALUTQOASA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cn2c(n1)CCCC2 ZINC000926855508 1018271197 /nfs/dbraw/zinc/27/11/97/1018271197.db2.gz VFGIJBSAHSHABF-QGZVFWFLSA-N 2 0 353.514 2.822 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2F)CC1 ZINC001118628166 1022324605 /nfs/dbraw/zinc/32/46/05/1022324605.db2.gz JBZKDIIRYBCBFY-UHFFFAOYSA-N 2 0 374.548 2.789 20 10 FFCDRP C[NH+](C)CCCC[C@H]([NH3+])C(=O)n1c(=N)ccc(/N=N/c2ccccc2)c1N ZINC001218582115 1033231909 /nfs/dbraw/zinc/23/19/09/1033231909.db2.gz UJZLGMMSURJMCY-VQXXRVQLSA-N 2 0 369.473 2.665 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001157435662 1029585854 /nfs/dbraw/zinc/58/58/54/1029585854.db2.gz UUKLSYLLPZVZDY-LPHOPBHVSA-N 2 0 371.525 2.623 20 10 FFCDRP COc1cccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001203592325 1030775311 /nfs/dbraw/zinc/77/53/11/1030775311.db2.gz SMFRWTDFXINPEC-WIYYLYMNSA-N 2 0 360.498 2.581 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccc(=O)[nH]n1 ZINC000796854754 1030936516 /nfs/dbraw/zinc/93/65/16/1030936516.db2.gz CFBUVIBVYQFSIT-MRXNPFEDSA-N 2 0 367.497 2.565 20 10 FFCDRP COc1cc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(O)cc1Br ZINC001205653039 1031907213 /nfs/dbraw/zinc/90/72/13/1031907213.db2.gz SFAHNZSWDHFGFM-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP Nc1ccc(N(Cc2ccccc2)C(=O)[C@@H]2CCC3(CC[NH2+]CC3)[NH2+]2)cc1 ZINC001218955445 1033427356 /nfs/dbraw/zinc/42/73/56/1033427356.db2.gz LHPYOVLZPLGKCN-FQEVSTJZSA-N 2 0 364.493 2.676 20 10 FFCDRP COc1cc(C[N@H+](C)C[C@H]2Cc3ccccc3O2)cc(C[NH+](C)C)c1O ZINC001139259459 1035032155 /nfs/dbraw/zinc/03/21/55/1035032155.db2.gz BUODTFOVSAVUDC-GOSISDBHSA-N 2 0 356.466 2.898 20 10 FFCDRP CCOC(=O)C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139407749 1035092779 /nfs/dbraw/zinc/09/27/79/1035092779.db2.gz CLIWVYYCPDKITR-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ncccn4)CC3)cc2)CC1 ZINC001139409669 1035093774 /nfs/dbraw/zinc/09/37/74/1035093774.db2.gz PJFNOLMDKBVVEJ-UHFFFAOYSA-N 2 0 351.498 2.608 20 10 FFCDRP Oc1ccc(F)cc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001140055524 1035325175 /nfs/dbraw/zinc/32/51/75/1035325175.db2.gz JJXMQAPWLFAVHC-DYESRHJHSA-N 2 0 371.456 2.649 20 10 FFCDRP CCCNC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304702 1035426273 /nfs/dbraw/zinc/42/62/73/1035426273.db2.gz YSJMIHPGFXQIKO-OAQYLSRUSA-N 2 0 372.557 2.709 20 10 FFCDRP CN(C)c1ccc(/C=C\CN2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028823 1035489760 /nfs/dbraw/zinc/48/97/60/1035489760.db2.gz SRTFUQUTRSVFCS-ICTHTSFCSA-N 2 0 356.558 2.868 20 10 FFCDRP CN(C)c1ccc(/C=C\C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052743 1035494099 /nfs/dbraw/zinc/49/40/99/1035494099.db2.gz HIESVNJOSZHDHE-LXHZQTKUSA-N 2 0 356.558 2.866 20 10 FFCDRP CCC[NH+](CCC)CCN1CC[NH+](Cc2ccc(N(C)C)cc2O)CC1 ZINC001232838592 1036094834 /nfs/dbraw/zinc/09/48/34/1036094834.db2.gz ANFPCLASRXGKHL-UHFFFAOYSA-N 2 0 362.562 2.698 20 10 FFCDRP COc1cc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)cc(C[NH+](C)C)c1O ZINC001235231555 1037426780 /nfs/dbraw/zinc/42/67/80/1037426780.db2.gz ZYUIJCQZJVDLTH-LJQANCHMSA-N 3 0 361.530 2.817 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(N(CC)CC)cc3)C[C@@H]1CC[NH2+]CC2 ZINC001235350833 1037497192 /nfs/dbraw/zinc/49/71/92/1037497192.db2.gz UWCROQKUAVCXQT-UGKGYDQZSA-N 2 0 373.541 2.898 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccc(F)cc3)cc2)CC1 ZINC001236125024 1037941373 /nfs/dbraw/zinc/94/13/73/1037941373.db2.gz JEPRIEUDUWTMLB-QFIPXVFZSA-N 2 0 368.500 2.724 20 10 FFCDRP COc1cc(C)c(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001236807054 1038281266 /nfs/dbraw/zinc/28/12/66/1038281266.db2.gz BTBXXBRZSOGCMQ-UHFFFAOYSA-N 2 0 370.497 2.560 20 10 FFCDRP Cc1cc(Br)cc(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c1O ZINC001236931644 1038363262 /nfs/dbraw/zinc/36/32/62/1038363262.db2.gz HUOLHLHZWFORRM-INIZCTEOSA-N 2 0 370.335 2.579 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@@H](F)CO4)CC3)c(F)c2)CC1 ZINC001236943976 1038372316 /nfs/dbraw/zinc/37/23/16/1038372316.db2.gz XZBIIHQLDCCBTK-QGZVFWFLSA-N 2 0 365.468 2.671 20 10 FFCDRP CCOC(=O)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001237114165 1038447446 /nfs/dbraw/zinc/44/74/46/1038447446.db2.gz CKAKZFZITGDDBQ-IEBWSBKVSA-N 2 0 359.514 2.507 20 10 FFCDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175059 1039265525 /nfs/dbraw/zinc/26/55/25/1039265525.db2.gz RXFWBGORYRWSBZ-INIZCTEOSA-N 2 0 354.454 2.725 20 10 FFCDRP COC(=O)c1ccc(C[C@@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001246173754 1039266032 /nfs/dbraw/zinc/26/60/32/1039266032.db2.gz MEYSJJIBYFSPDE-QGZVFWFLSA-N 2 0 367.493 2.604 20 10 FFCDRP Oc1ccc(O)c(C[NH+]2CCC3(CCC[N@H+](Cc4cn[nH]c4)C3)CC2)c1 ZINC001278751072 1040472749 /nfs/dbraw/zinc/47/27/49/1040472749.db2.gz SZMKXPSYPHTNEY-UHFFFAOYSA-N 2 0 356.470 2.699 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N(C)C)cc3)(C1)CCC2 ZINC001279149193 1042919859 /nfs/dbraw/zinc/91/98/59/1042919859.db2.gz ANVFDAWNESKTSZ-RTWAWAEBSA-N 2 0 361.530 2.898 20 10 FFCDRP Oc1ccc(F)cc1C[NH+]1CCC2(CC[N@H+](CCn3ccnc3)C2)CC1 ZINC001279197323 1042941535 /nfs/dbraw/zinc/94/15/35/1042941535.db2.gz QRCJKXKAXVEEPW-UHFFFAOYSA-N 2 0 358.461 2.716 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CCC[N@H+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001279225770 1042952947 /nfs/dbraw/zinc/95/29/47/1042952947.db2.gz RWCAFLSLIBHTRR-UHFFFAOYSA-N 2 0 356.470 2.699 20 10 FFCDRP Cc1c(O)ccc(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4cn[nH]c4)(C2)CCC3)c1O ZINC001279314400 1042996863 /nfs/dbraw/zinc/99/68/63/1042996863.db2.gz TXEXRKGUDPZWCI-UXHICEINSA-N 2 0 356.470 2.854 20 10 FFCDRP c1ccc(COc2ccc(N3CC[NH+](C[C@H]4[C@@H]5C[NH2+]C[C@H]45)CC3)cc2)cc1 ZINC001237246173 1043073852 /nfs/dbraw/zinc/07/38/52/1043073852.db2.gz BKQIPUWTOMQAKU-JKHIJQBDSA-N 2 0 363.505 2.853 20 10 FFCDRP CN1CCCc2cc(C[NH+]3CCC4(CN(CC[NH+](C)C)C4)CC3)ccc21 ZINC001279551592 1043247320 /nfs/dbraw/zinc/24/73/20/1043247320.db2.gz PXIYCXUJKXKBJD-UHFFFAOYSA-N 2 0 356.558 2.528 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202859 1046808467 /nfs/dbraw/zinc/80/84/67/1046808467.db2.gz WFSYWIFDXYJWBG-WOJBJXKFSA-N 3 0 374.548 2.789 20 10 FFCDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001200244512 1056140873 /nfs/dbraw/zinc/14/08/73/1056140873.db2.gz VAQVQCARGLENRS-IBGZPJMESA-N 2 0 362.537 2.788 20 10 FFCDRP [NH3+][C@H](CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccccc1 ZINC001580127859 1078753415 /nfs/dbraw/zinc/75/34/15/1078753415.db2.gz NXZRYSCYORPDPN-HXUWFJFHSA-N 2 0 353.510 2.697 20 10 FFCDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000185647639 509283447 /nfs/dbraw/zinc/28/34/47/509283447.db2.gz UHYWLWFXAUMHOY-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@]4(CCSC4)C3)cc2)CC1 ZINC000771846929 737760667 /nfs/dbraw/zinc/76/06/67/737760667.db2.gz NXDNZAUWVVXIMH-AZUAARDMSA-N 2 0 361.555 2.583 20 10 FFCDRP CC[C@@H](COCC(F)(F)F)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824556085 743103889 /nfs/dbraw/zinc/10/38/89/743103889.db2.gz ZTZQFXIUIOVJSH-INIZCTEOSA-N 2 0 359.436 2.886 20 10 FFCDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901917 748131919 /nfs/dbraw/zinc/13/19/19/748131919.db2.gz IWIDOMYMRZTBGS-VMGRFDJRSA-N 2 0 369.303 2.873 20 10 FFCDRP [O-]c1cccc(F)c1C[NH2+]Cc1ccc(OCCN2CCOCC2)cc1 ZINC000896642337 971642290 /nfs/dbraw/zinc/64/22/90/971642290.db2.gz PZAWHCPPIXHVCY-UHFFFAOYSA-N 2 0 360.429 2.532 20 10 FFCDRP CC[C@H]([NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1)c1ccc(C)cc1O ZINC000840830373 973397048 /nfs/dbraw/zinc/39/70/48/973397048.db2.gz FBFFVTBYMBKNBI-IBGZPJMESA-N 2 0 361.530 2.538 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(=O)Nc3ccccc3F)cc2)CC1 ZINC000905426252 980438599 /nfs/dbraw/zinc/43/85/99/980438599.db2.gz GPLHILDNPPINIZ-UHFFFAOYSA-N 2 0 370.472 2.696 20 10 FFCDRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC000921758667 986938514 /nfs/dbraw/zinc/93/85/14/986938514.db2.gz DHJLSTSBNXKKFY-UHFFFAOYSA-N 2 0 367.493 2.593 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC(CCC[NH+]3CCCC3)CC1)[C@@H](O)CO2 ZINC000768461866 1000261405 /nfs/dbraw/zinc/26/14/05/1000261405.db2.gz GQTXMHPZFOAMFE-FQEVSTJZSA-N 2 0 360.498 2.906 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC(CCC[NH+]3CCCC3)CC1)[C@H](O)CO2 ZINC000768461867 1000261473 /nfs/dbraw/zinc/26/14/73/1000261473.db2.gz GQTXMHPZFOAMFE-HXUWFJFHSA-N 2 0 360.498 2.906 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850031083 1005779939 /nfs/dbraw/zinc/77/99/39/1005779939.db2.gz PUEQORXCGJWIOD-UHFFFAOYSA-N 2 0 363.546 2.816 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnn3CC3CC3)cc2F)CC1 ZINC000850126703 1005787940 /nfs/dbraw/zinc/78/79/40/1005787940.db2.gz QBFUQQQUSMEABE-UHFFFAOYSA-N 2 0 371.504 2.864 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccnc3N3CCCC3)cc2)CC1 ZINC000850353056 1005809642 /nfs/dbraw/zinc/80/96/42/1005809642.db2.gz RCVJGWFJAYOGGX-UHFFFAOYSA-N 2 0 365.525 2.723 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850357367 1005810924 /nfs/dbraw/zinc/81/09/24/1005810924.db2.gz HDEGZZWSKRHNIU-LJQANCHMSA-N 2 0 356.466 2.647 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCN3Cc3ccccc3)cc2)CC1 ZINC000850416656 1005813971 /nfs/dbraw/zinc/81/39/71/1005813971.db2.gz NMUJTSZEXFHTSJ-QHCPKHFHSA-N 2 0 364.537 2.803 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2ccc3c(c2)[C@H](C[NH3+])CCC3)cc1 ZINC000852790759 1006184862 /nfs/dbraw/zinc/18/48/62/1006184862.db2.gz BBEAKZYTWSYKNE-RXVVDRJESA-N 2 0 366.509 2.561 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000853247472 1006349806 /nfs/dbraw/zinc/34/98/06/1006349806.db2.gz QOEJLBNWXAQZKG-UHFFFAOYSA-N 2 0 372.557 2.757 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cn4cccc(F)c4n3)cc2)CC1 ZINC000883283904 1006731821 /nfs/dbraw/zinc/73/18/21/1006731821.db2.gz XVDJDEUAQCDPBP-UHFFFAOYSA-N 2 0 353.445 2.515 20 10 FFCDRP FC(F)(F)c1cc(N2CCOCC2)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000817887691 1007785162 /nfs/dbraw/zinc/78/51/62/1007785162.db2.gz CERHKIIQUAHTEX-XYPWUTKMSA-N 2 0 369.431 2.915 20 10 FFCDRP C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(N2CCNC2=O)cc1 ZINC000817941537 1007818686 /nfs/dbraw/zinc/81/86/86/1007818686.db2.gz KLSKFGUTIIDBKU-QRWLVFNGSA-N 2 0 367.497 2.633 20 10 FFCDRP C[C@@](O)(C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)C(F)(F)F ZINC000819200070 1008065249 /nfs/dbraw/zinc/06/52/49/1008065249.db2.gz IYNVKFQHOKIPLD-GOSISDBHSA-N 2 0 371.447 2.622 20 10 FFCDRP Cc1cc(C2([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)CCOCC2)on1 ZINC000858326500 1008346762 /nfs/dbraw/zinc/34/67/62/1008346762.db2.gz RQIWABOXJMQGCE-UHFFFAOYSA-N 2 0 370.497 2.530 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3OCCc4ccccc43)cc2)CC1 ZINC001177816162 1008756772 /nfs/dbraw/zinc/75/67/72/1008756772.db2.gz GBMNRPOONQDCEU-JOCHJYFZSA-N 2 0 351.494 2.842 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001179502714 1009356324 /nfs/dbraw/zinc/35/63/24/1009356324.db2.gz XJKDNLVJFKXROK-IYARVYRRSA-N 2 0 359.514 2.648 20 10 FFCDRP C[C@@H]1C[C@@H]2CC[C@H](C(=O)NC[C@@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@@H+]2C1 ZINC001180179475 1009573160 /nfs/dbraw/zinc/57/31/60/1009573160.db2.gz PDBWXWQGUNSRQV-LGYWMIHWSA-N 2 0 372.557 2.592 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(CN3CC[NH2+]CC3)cc2)c1 ZINC000925812930 1017858069 /nfs/dbraw/zinc/85/80/69/1017858069.db2.gz DJQPTTFCZWNHEV-INIZCTEOSA-N 2 0 355.482 2.657 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272428 1032861137 /nfs/dbraw/zinc/86/11/37/1032861137.db2.gz UFNCIZXAKIKHST-JOCHJYFZSA-N 3 0 356.558 2.794 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)C[C@@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001122414011 1023253592 /nfs/dbraw/zinc/25/35/92/1023253592.db2.gz ITNDQLOPGIFQTO-UXHICEINSA-N 2 0 354.498 2.562 20 10 FFCDRP CCOc1cccc(C[N@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000190315056 1023614465 /nfs/dbraw/zinc/61/44/65/1023614465.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 0 370.493 2.860 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c(O)c1 ZINC000756531620 1023723919 /nfs/dbraw/zinc/72/39/19/1023723919.db2.gz AUHFWMKSENSXST-SFHVURJKSA-N 2 0 369.513 2.744 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045361 1030001280 /nfs/dbraw/zinc/00/12/80/1030001280.db2.gz KGLCABMQESXADY-WTNAPCKOSA-N 2 0 352.526 2.863 20 10 FFCDRP Cc1cccc2c1C[NH2+]CCN2Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841088663 1030028036 /nfs/dbraw/zinc/02/80/36/1030028036.db2.gz BBRXXDGIBPVICL-UHFFFAOYSA-N 2 0 350.510 2.857 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cc1Br ZINC001205638275 1031897365 /nfs/dbraw/zinc/89/73/65/1031897365.db2.gz LVAZEYYOJNZBHH-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205654155 1031908578 /nfs/dbraw/zinc/90/85/78/1031908578.db2.gz WOHLPRFDPMFMDS-HZPDHXFCSA-N 2 0 351.922 2.983 20 10 FFCDRP COc1cc(C[N@@H+]2CCCN(c3cccnc3)CC2)cc(C[NH+](C)C)c1O ZINC001139260380 1035031651 /nfs/dbraw/zinc/03/16/51/1035031651.db2.gz LIYLSCOBYSFZGQ-UHFFFAOYSA-N 2 0 370.497 2.570 20 10 FFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745159 1036036795 /nfs/dbraw/zinc/03/67/95/1036036795.db2.gz YKKVWESVDDAGPJ-NQIIRXRSSA-N 2 0 360.498 2.587 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3c(C)n(C)c4ccccc43)C[C@@H]1CC[NH2+]CC2 ZINC001235350752 1037496889 /nfs/dbraw/zinc/49/68/89/1037496889.db2.gz XPPDSMCEEKDTOR-JTSKRJEESA-N 2 0 369.509 2.851 20 10 FFCDRP Clc1ccc([C@H]2C[NH2+]CCN2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235816357 1037765118 /nfs/dbraw/zinc/76/51/18/1037765118.db2.gz RXYQKDWXLCFFAJ-OAQYLSRUSA-N 2 0 370.928 2.896 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3c(O)ccc4ccccc43)C[C@H]1C[NH2+]CC2 ZINC001236039923 1037903661 /nfs/dbraw/zinc/90/36/61/1037903661.db2.gz BAKCRTIFOHQZKT-IIBYNOLFSA-N 2 0 354.450 2.520 20 10 FFCDRP CC[NH+](CC)C1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236940731 1038370556 /nfs/dbraw/zinc/37/05/56/1038370556.db2.gz SYQINFOPAAOBAL-UHFFFAOYSA-N 2 0 362.537 2.884 20 10 FFCDRP Cc1nnc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)o1 ZINC001236943476 1038370628 /nfs/dbraw/zinc/37/06/28/1038370628.db2.gz RWAQKBKHIZHAEJ-KRWDZBQOSA-N 2 0 373.476 2.649 20 10 FFCDRP Cc1ccc(O)c(C[N@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c1 ZINC001278617164 1038844080 /nfs/dbraw/zinc/84/40/80/1038844080.db2.gz UBHOTKQBSDGFNQ-KDURUIRLSA-N 2 0 354.498 2.741 20 10 FFCDRP COCCOC[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1O ZINC001278557632 1041148208 /nfs/dbraw/zinc/14/82/08/1041148208.db2.gz LYQSUXNZZOITTB-ALOPSCKCSA-N 2 0 354.878 2.751 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CC3(CN(CC[NH+](C)C)C3)C2)c2ccccc21 ZINC001279220945 1042950379 /nfs/dbraw/zinc/95/03/79/1042950379.db2.gz FOLSCGARLQEPBB-UHFFFAOYSA-N 2 0 352.526 2.585 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC001326037774 1046737058 /nfs/dbraw/zinc/73/70/58/1046737058.db2.gz YAPDTALBJNXZTH-UMVBOHGHSA-N 2 0 357.420 2.675 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[NH+](C)C)cc1 ZINC001342292243 1050884593 /nfs/dbraw/zinc/88/45/93/1050884593.db2.gz MRSXWVGJRPPAOS-HDXVLLOASA-N 2 0 372.557 2.625 20 10 FFCDRP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc(N3CCCC3)cc2)ccn1 ZINC001308355542 1052449818 /nfs/dbraw/zinc/44/98/18/1052449818.db2.gz WMVKSHROPZISNQ-UHFFFAOYSA-N 2 0 354.498 2.912 20 10 FFCDRP COc1ccc(O)c(CNC(=[NH2+])NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000849099077 1056758797 /nfs/dbraw/zinc/75/87/97/1056758797.db2.gz GWUDMHKDFDFSCA-UHFFFAOYSA-N 2 0 368.481 2.679 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349777 1056835401 /nfs/dbraw/zinc/83/54/01/1056835401.db2.gz HBPZKGIWRRGIII-NRFANRHFSA-N 3 0 356.558 2.650 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)ccc1N1CCOCC1 ZINC000849349681 1056835935 /nfs/dbraw/zinc/83/59/35/1056835935.db2.gz DUEATMBAGDBGBD-LJQANCHMSA-N 2 0 361.505 2.874 20 10 FFCDRP C[NH+]1CCN(c2cc[nH+]cc2NCc2cc(Cl)cc(F)c2O)CC1 ZINC001474097970 1065457424 /nfs/dbraw/zinc/45/74/24/1065457424.db2.gz SCQYLVVEVKAZJA-UHFFFAOYSA-N 2 0 350.825 2.944 20 10 FFCDRP CC[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC001474275740 1065483241 /nfs/dbraw/zinc/48/32/41/1065483241.db2.gz WHAXQINNLMTSMV-GOSISDBHSA-N 2 0 361.530 2.896 20 10 FFCDRP CC(C)[C@@H](C(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1)[NH+]1CCCCC1 ZINC001558123408 1075946699 /nfs/dbraw/zinc/94/66/99/1075946699.db2.gz DXAYTPKUTPDXDB-NRFANRHFSA-N 2 0 372.557 2.565 20 10 FFCDRP CC(C)[C@@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[NH+]1CCCCC1 ZINC001558723822 1076063294 /nfs/dbraw/zinc/06/32/94/1076063294.db2.gz WIZIHRLOEUPOQX-SFTDATJTSA-N 2 0 374.573 2.982 20 10 FFCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1)c1cnn(C)c1 ZINC000155259610 508960678 /nfs/dbraw/zinc/96/06/78/508960678.db2.gz HUWNITGFPBQSQH-LJQANCHMSA-N 2 0 359.493 2.942 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000161228155 509089009 /nfs/dbraw/zinc/08/90/09/509089009.db2.gz YZOFYXVKSIEZHP-QGZVFWFLSA-N 2 0 368.525 2.895 20 10 FFCDRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(F)ccc3O)c2)C1 ZINC000180704591 510063619 /nfs/dbraw/zinc/06/36/19/510063619.db2.gz ZBNQOYQLEXCTJV-KRWDZBQOSA-N 2 0 371.456 2.518 20 10 FFCDRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc(N(C)C)c(F)c3)CC2)CC1 ZINC000271240555 511134054 /nfs/dbraw/zinc/13/40/54/511134054.db2.gz YOQHLCZYVZEBMA-UHFFFAOYSA-N 2 0 362.537 2.882 20 10 FFCDRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000295938884 511561779 /nfs/dbraw/zinc/56/17/79/511561779.db2.gz KSVIWDQRCONHPN-HXUWFJFHSA-N 2 0 351.494 2.917 20 10 FFCDRP Cc1cc(Br)cc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)c1O ZINC000894378956 734849000 /nfs/dbraw/zinc/84/90/00/734849000.db2.gz ZDKQKWSQIGKYGI-UHFFFAOYSA-N 2 0 370.335 2.580 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@@]4(CCSC4)C3)cc2)CC1 ZINC000771846934 737760716 /nfs/dbraw/zinc/76/07/16/737760716.db2.gz NXDNZAUWVVXIMH-QUCCMNQESA-N 2 0 361.555 2.583 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](n4cc(Cl)cn4)C3)cc2)CC1 ZINC000811520146 741533261 /nfs/dbraw/zinc/53/32/61/741533261.db2.gz KILMKNHTZDESNI-LJQANCHMSA-N 2 0 359.905 2.735 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)c1O ZINC000842479182 747613662 /nfs/dbraw/zinc/61/36/62/747613662.db2.gz PDYKHGKZRZXMHX-MJGOQNOKSA-N 2 0 366.889 2.967 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902494 748132026 /nfs/dbraw/zinc/13/20/26/748132026.db2.gz OABNKSZPCOYCAH-APHBMKBZSA-N 2 0 354.878 2.773 20 10 FFCDRP CCc1nccn1[C@H](C)CC(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891245344 962556974 /nfs/dbraw/zinc/55/69/74/962556974.db2.gz CVQTWQJTIUUSSC-VQIMIIECSA-N 2 0 371.529 2.882 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(CO)C[C@H]3c3ccccc3)cc2)CC1 ZINC000810165259 994715026 /nfs/dbraw/zinc/71/50/26/994715026.db2.gz NCYZHGXCACNDJR-GOTSBHOMSA-N 2 0 365.521 2.694 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C3CC[NH+]([C@H]4CCC[C@@H]4O)CC3)CC2)cc1 ZINC000812839134 995548942 /nfs/dbraw/zinc/54/89/42/995548942.db2.gz HZWLUTIRACPKJL-VXKWHMMOSA-N 2 0 373.541 2.631 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000846144558 1000218761 /nfs/dbraw/zinc/21/87/61/1000218761.db2.gz LFUIFQMOXYZWAO-IERDGZPVSA-N 2 0 356.466 2.688 20 10 FFCDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768450106 1000250630 /nfs/dbraw/zinc/25/06/30/1000250630.db2.gz HVLKDBIHFQOTTF-HXUWFJFHSA-N 2 0 356.466 2.902 20 10 FFCDRP Cc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000768670890 1000322852 /nfs/dbraw/zinc/32/28/52/1000322852.db2.gz RUUWLCUTBUYDGF-UHFFFAOYSA-N 2 0 351.498 2.607 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCCC[NH+]2CCN(C)CC2)c(C(F)(F)F)c1 ZINC000792912815 1003228078 /nfs/dbraw/zinc/22/80/78/1003228078.db2.gz OLYKZVILOYLDDE-UHFFFAOYSA-N 2 0 372.479 2.889 20 10 FFCDRP Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737499 1003899962 /nfs/dbraw/zinc/89/99/62/1003899962.db2.gz NKKVCWNCFAOSSW-OAQYLSRUSA-N 2 0 353.514 2.817 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205601773 1004166311 /nfs/dbraw/zinc/16/63/11/1004166311.db2.gz GGJUQYJJIIDQBK-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc2c(c1)OCCO2 ZINC000775641919 1004906810 /nfs/dbraw/zinc/90/68/10/1004906810.db2.gz DTDJBBOKPNHJDO-UHFFFAOYSA-N 2 0 367.493 2.842 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC([NH+]4CCCCC4)CC3)cc2)CC1 ZINC000775648028 1004921851 /nfs/dbraw/zinc/92/18/51/1004921851.db2.gz MZBCLBWWEWPWPU-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP CC1CCC2(CC1)OC[C@@H](C[NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)O2 ZINC001201728011 1005256590 /nfs/dbraw/zinc/25/65/90/1005256590.db2.gz WFXBZJJLANATGB-NFOQDIRWSA-N 2 0 373.541 2.850 20 10 FFCDRP COc1cc(C[NH2+]CCN2CCC([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850172348 1005792906 /nfs/dbraw/zinc/79/29/06/1005792906.db2.gz GZDZKMQZNAURSU-UHFFFAOYSA-N 2 0 363.546 2.814 20 10 FFCDRP COc1cc(C[NH2+][C@H](C)CCN2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850249459 1005799007 /nfs/dbraw/zinc/79/90/07/1005799007.db2.gz CJIIJRCRNSALQQ-MRXNPFEDSA-N 2 0 363.546 2.814 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902533 1007803999 /nfs/dbraw/zinc/80/39/99/1007803999.db2.gz SPRADVLULSFUEL-HLAWJBBLSA-N 3 0 374.548 2.978 20 10 FFCDRP [NH3+]CC1CCC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000817916822 1007808866 /nfs/dbraw/zinc/80/88/66/1007808866.db2.gz KXIBPYACBHRDPX-UHFFFAOYSA-N 3 0 356.558 2.826 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000817972019 1007835673 /nfs/dbraw/zinc/83/56/73/1007835673.db2.gz JGHLGJCABLZYHA-FZKQIMNGSA-N 2 0 371.447 2.758 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)CC2)cc1 ZINC000858090922 1008299760 /nfs/dbraw/zinc/29/97/60/1008299760.db2.gz VPQAAGLGJVPZEJ-LJQANCHMSA-N 2 0 374.573 2.670 20 10 FFCDRP C[C@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc2c(cc1O)CCCC2 ZINC000925855605 1017878039 /nfs/dbraw/zinc/87/80/39/1017878039.db2.gz LAHPXTVNWMQQKS-WMLDXEAASA-N 2 0 358.482 2.607 20 10 FFCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2CCNC3(CC[NH2+]CC3)C2)cc1Cl ZINC001222109896 1032764539 /nfs/dbraw/zinc/76/45/39/1032764539.db2.gz RACRIWVRUGHAIQ-UHFFFAOYSA-N 2 0 351.922 2.871 20 10 FFCDRP COC(=O)c1c(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c2ccccc2n1C ZINC001222457657 1032985244 /nfs/dbraw/zinc/98/52/44/1032985244.db2.gz VTSZHIPIUWQGIZ-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(F)ccc1O ZINC000756537299 1023724032 /nfs/dbraw/zinc/72/40/32/1023724032.db2.gz YDHVGTFMTURFOC-MRXNPFEDSA-N 2 0 373.476 2.574 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C(=O)NCC[NH+](C)C ZINC000756858416 1023759922 /nfs/dbraw/zinc/75/99/22/1023759922.db2.gz PGWHTHSCBSSOBL-BMFZPTHFSA-N 2 0 365.493 2.762 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001157435665 1029586472 /nfs/dbraw/zinc/58/64/72/1029586472.db2.gz UUKLSYLLPZVZDY-VQIMIIECSA-N 2 0 371.525 2.623 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205635920 1031894758 /nfs/dbraw/zinc/89/47/58/1031894758.db2.gz BGNCFBUENKCFOY-DOTOQJQBSA-N 2 0 351.922 2.983 20 10 FFCDRP COc1cc(C[N@@H+]2CCCN(c3ccccn3)CC2)cc(C[NH+](C)C)c1O ZINC001139253363 1035030192 /nfs/dbraw/zinc/03/01/92/1035030192.db2.gz SASJNODFCDMQIR-UHFFFAOYSA-N 2 0 370.497 2.570 20 10 FFCDRP COc1cc(C[NH+]2CCC3(C[C@@H](F)CO3)CC2)cc(C[NH+](C)C)c1O ZINC001139259100 1035032379 /nfs/dbraw/zinc/03/23/79/1035032379.db2.gz HZOTTWQKYRLFRH-MRXNPFEDSA-N 2 0 352.450 2.555 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[C@@H]([NH+]4CCCCC4)[C@@H](F)C3)cc2)CC1 ZINC001139411592 1035094919 /nfs/dbraw/zinc/09/49/19/1035094919.db2.gz USQLNYUWUKVGBR-FCHUYYIVSA-N 2 0 374.548 2.837 20 10 FFCDRP CCOC(=O)C1(CC)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139410845 1035095501 /nfs/dbraw/zinc/09/55/01/1035095501.db2.gz IHYIUPATYODMJQ-UHFFFAOYSA-N 2 0 373.541 2.994 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)[C@H]3CCC4(C3)OCCO4)cc2)CC1 ZINC001140309730 1035429262 /nfs/dbraw/zinc/42/92/62/1035429262.db2.gz RZMVPMFNZFUDDQ-FQEVSTJZSA-N 2 0 359.514 2.556 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235039976 1037322504 /nfs/dbraw/zinc/32/25/04/1037322504.db2.gz PSNIEUJRARMKAX-OAQYLSRUSA-N 2 0 360.521 2.686 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@H](Oc3ccccc3)C1)C[NH2+]CCO2 ZINC001235693212 1037688260 /nfs/dbraw/zinc/68/82/60/1037688260.db2.gz WCKMYSYLJFDBAM-IBGZPJMESA-N 2 0 354.450 2.918 20 10 FFCDRP [NH3+]C1CN([C@@H]2CCC[N@H+](Cc3ccc(OCc4ccccc4)cc3O)C2)C1 ZINC001236077622 1037921024 /nfs/dbraw/zinc/92/10/24/1037921024.db2.gz JCCQJIWEADDNHT-HXUWFJFHSA-N 2 0 367.493 2.579 20 10 FFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c(OC)c1 ZINC001236923896 1038358239 /nfs/dbraw/zinc/35/82/39/1038358239.db2.gz MQARXMPPXIVDEP-HXUWFJFHSA-N 2 0 362.562 2.657 20 10 FFCDRP CCN(CC[NH+](CC)CC)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236940466 1038368372 /nfs/dbraw/zinc/36/83/72/1038368372.db2.gz SEUNEYGJDGWEAK-UHFFFAOYSA-N 2 0 350.526 2.741 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4ccccn4)C3)c(F)c2)CC1 ZINC001236938784 1038369075 /nfs/dbraw/zinc/36/90/75/1038369075.db2.gz NHAHSUMEXZFHDR-SFHVURJKSA-N 2 0 354.473 2.962 20 10 FFCDRP c1ccc(C[C@@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173839 1039266260 /nfs/dbraw/zinc/26/62/60/1039266260.db2.gz MZGDPLDZJJLQDU-FGZHOGPDSA-N 3 0 364.537 2.549 20 10 FFCDRP CN(C)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1cc(Cl)ccc1O)CC2 ZINC001278568946 1041206394 /nfs/dbraw/zinc/20/63/94/1041206394.db2.gz KXBURGRTQLZCAR-UHFFFAOYSA-N 2 0 351.922 2.895 20 10 FFCDRP COc1cccc([C@@H](O)C[NH2+]C2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC001250737563 1041336486 /nfs/dbraw/zinc/33/64/86/1041336486.db2.gz XREZDWQACOASEP-NRFANRHFSA-N 2 0 356.466 2.688 20 10 FFCDRP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@H+](Cc1cc(Cl)c(O)cc1O)C2 ZINC001279573752 1043281189 /nfs/dbraw/zinc/28/11/89/1043281189.db2.gz YVTMXRPSYPVXPP-IBGZPJMESA-N 2 0 367.921 2.601 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CC[NH+](Cc1c(O)ccc(F)c1Cl)CC2 ZINC001279685592 1043465986 /nfs/dbraw/zinc/46/59/86/1043465986.db2.gz YLQOPBIFDUZRSC-UHFFFAOYSA-N 2 0 355.885 2.644 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(N(C)C)cc1 ZINC000090038696 507903554 /nfs/dbraw/zinc/90/35/54/507903554.db2.gz BUPCDZRFZBSVBD-KRWDZBQOSA-N 2 0 368.525 2.895 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(O)c1 ZINC000185322334 510806379 /nfs/dbraw/zinc/80/63/79/510806379.db2.gz HTERIGOOQNLDTK-INIZCTEOSA-N 2 0 355.482 2.843 20 10 FFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3CC(=O)N(C)C)cc1 ZINC000285533849 510945242 /nfs/dbraw/zinc/94/52/42/510945242.db2.gz CTXNPPQSNHZJQT-TYGFWLQKSA-N 2 0 372.557 2.877 20 10 FFCDRP CCOCc1cc(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)ccc1OC ZINC000277696785 510969075 /nfs/dbraw/zinc/96/90/75/510969075.db2.gz HTEPNUXFRYOUQE-KRWDZBQOSA-N 2 0 350.503 2.822 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000288535217 511079400 /nfs/dbraw/zinc/07/94/00/511079400.db2.gz KLMGVQDIFXSQTM-UHFFFAOYSA-N 2 0 359.470 2.806 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C[C@H]3CN(CC(C)C)CCO3)CC2)cc1 ZINC000362222060 511149529 /nfs/dbraw/zinc/14/95/29/511149529.db2.gz QERJJTJRBORRIC-NRFANRHFSA-N 2 0 361.530 2.610 20 10 FFCDRP Cc1cc(Br)cc(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)c1O ZINC000271780320 511321690 /nfs/dbraw/zinc/32/16/90/511321690.db2.gz DQBGWKSCAHEBRA-UHFFFAOYSA-N 2 0 371.319 2.788 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)c1O ZINC000925849025 738536034 /nfs/dbraw/zinc/53/60/34/738536034.db2.gz GJLAFVKIXXEXKM-OCCSQVGLSA-N 2 0 352.862 2.690 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](C(F)(F)F)CC3)cc2)CC1 ZINC000877819685 732440965 /nfs/dbraw/zinc/44/09/65/732440965.db2.gz IBKHZBVYVPXPER-QGZVFWFLSA-N 2 0 357.420 2.592 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C(=O)NCC[NH+](C)C ZINC000841749167 747448336 /nfs/dbraw/zinc/44/83/36/747448336.db2.gz AXWRLQHQSGPQMC-BBRMVZONSA-N 2 0 355.910 2.789 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)c1O ZINC000842479183 747613571 /nfs/dbraw/zinc/61/35/71/747613571.db2.gz PDYKHGKZRZXMHX-PKOBYXMFSA-N 2 0 366.889 2.967 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125307 747777912 /nfs/dbraw/zinc/77/79/12/747777912.db2.gz RUHHKOOHCFBBLU-OLZOCXBDSA-N 2 0 369.303 2.985 20 10 FFCDRP CCc1nccn1[C@@H](C)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891245341 962557177 /nfs/dbraw/zinc/55/71/77/962557177.db2.gz CVQTWQJTIUUSSC-LPHOPBHVSA-N 2 0 371.529 2.882 20 10 FFCDRP CC[C@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(C)cc1O ZINC000873242802 1013442415 /nfs/dbraw/zinc/44/24/15/1013442415.db2.gz FERSLCQRZAZFMD-IBGZPJMESA-N 2 0 351.454 2.981 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000127941295 975553816 /nfs/dbraw/zinc/55/38/16/975553816.db2.gz CCPZFBYICSNTBH-ICSRJNTNSA-N 2 0 372.557 2.915 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc(F)c3N)cc2F)CC1 ZINC000877012153 1014448779 /nfs/dbraw/zinc/44/87/79/1014448779.db2.gz PPGFDGTXRBPTEH-UHFFFAOYSA-N 2 0 360.452 2.979 20 10 FFCDRP [NH3+]Cc1ccc(C(=O)Nc2cccc(N3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC000178879101 978271874 /nfs/dbraw/zinc/27/18/74/978271874.db2.gz RUVRWDWNOTXFKY-UHFFFAOYSA-N 2 0 364.493 2.930 20 10 FFCDRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(C)cc2O)CC1 ZINC000877521972 1014611006 /nfs/dbraw/zinc/61/10/06/1014611006.db2.gz IZJCQXSEJGOBOA-UHFFFAOYSA-N 2 0 361.530 2.761 20 10 FFCDRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cc4c(cc3O)CCC4)CC2)CC1 ZINC000760285767 981775504 /nfs/dbraw/zinc/77/55/04/981775504.db2.gz OMVNTPUGPABOCJ-UHFFFAOYSA-N 2 0 357.542 2.871 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000922391155 988547356 /nfs/dbraw/zinc/54/73/56/988547356.db2.gz UCYGIXDYAVJXDK-NQPKCUPCSA-N 2 0 357.542 2.835 20 10 FFCDRP COC(=O)C1(C)CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001168754891 990089684 /nfs/dbraw/zinc/08/96/84/990089684.db2.gz LKIAZJROYWBWES-UHFFFAOYSA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@@H]([NH2+][C@H](C)c1ccccc1O)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879648284 1015623892 /nfs/dbraw/zinc/62/38/92/1015623892.db2.gz IKETWWAAGJMAIB-ZHALLVOQSA-N 2 0 367.493 2.822 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515481 998627725 /nfs/dbraw/zinc/62/77/25/998627725.db2.gz PZLQAGGYENWKOX-IRXDYDNUSA-N 2 0 354.450 2.757 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1O ZINC000846140930 1000217808 /nfs/dbraw/zinc/21/78/08/1000217808.db2.gz AGFCZBPAOSQIGW-KRWDZBQOSA-N 2 0 370.497 2.659 20 10 FFCDRP COC(=O)CC(C)(C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001183532933 1002310593 /nfs/dbraw/zinc/31/05/93/1002310593.db2.gz ILVAPSMYSFZMIE-KRWDZBQOSA-N 2 0 361.530 2.896 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@]3(C)Br)cc2)CC1 ZINC001183534572 1002312667 /nfs/dbraw/zinc/31/26/67/1002312667.db2.gz RANLEWXSLNSAGL-RDJZCZTQSA-N 2 0 352.320 2.702 20 10 FFCDRP CC(C)n1ncc2c1C[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CC2 ZINC000790995944 1002537621 /nfs/dbraw/zinc/53/76/21/1002537621.db2.gz PRZHQCGJNOYTCE-FQEVSTJZSA-N 2 0 367.541 2.863 20 10 FFCDRP CCOc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c(O)c1 ZINC000850357473 1005810662 /nfs/dbraw/zinc/81/06/62/1005810662.db2.gz KPEVXRLUHVQXHT-IBGZPJMESA-N 2 0 356.466 2.647 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@]3(c4ccccc4)C[C@@H](O)C3)cc2)CC1 ZINC000883234317 1006713572 /nfs/dbraw/zinc/71/35/72/1006713572.db2.gz BUGUJYHCUQDHAS-SZPZYZBQSA-N 2 0 351.494 2.578 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cnccc1N ZINC000817916901 1007807870 /nfs/dbraw/zinc/80/78/70/1007807870.db2.gz MHHXPVWIXZQNLO-KRWDZBQOSA-N 2 0 365.525 2.877 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000773147593 1009747283 /nfs/dbraw/zinc/74/72/83/1009747283.db2.gz SZDVCTHQCDGANH-GGAORHGYSA-N 3 0 368.569 2.935 20 10 FFCDRP Cc1cnn(C)c1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000796343561 1012233853 /nfs/dbraw/zinc/23/38/53/1012233853.db2.gz CSDGQRLIHLMBQI-UHFFFAOYSA-N 2 0 353.514 2.550 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC000756512445 1023721120 /nfs/dbraw/zinc/72/11/20/1023721120.db2.gz YNXDXUDQZJRJDJ-SFHVURJKSA-N 2 0 354.498 2.959 20 10 FFCDRP Oc1ccc(O)c(C[NH+]2CCC3(CC2)C[N@H+](Cc2ccccc2)CCO3)c1 ZINC001141158852 1025540777 /nfs/dbraw/zinc/54/07/77/1025540777.db2.gz PDWCGFAPRRVQBE-UHFFFAOYSA-N 2 0 368.477 2.965 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c(O)c1 ZINC001206649706 1027983539 /nfs/dbraw/zinc/98/35/39/1027983539.db2.gz YBUUFSSMPXXJNZ-MRXNPFEDSA-N 2 0 364.486 2.675 20 10 FFCDRP Cc1ccc(C[N@@H+](CCO)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000783603210 1030178353 /nfs/dbraw/zinc/17/83/53/1030178353.db2.gz MSPGVMZXOJEUJT-UHFFFAOYSA-N 2 0 353.510 2.741 20 10 FFCDRP COc1ccc(O)c(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1 ZINC001203673290 1030822462 /nfs/dbraw/zinc/82/24/62/1030822462.db2.gz UIEGZWDNHYTABB-UHFFFAOYSA-N 2 0 370.497 2.642 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000843341540 1031336948 /nfs/dbraw/zinc/33/69/48/1031336948.db2.gz UOFBLEWLWWXPAO-BHIFYINESA-N 3 0 368.569 2.696 20 10 FFCDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000798956819 1031595438 /nfs/dbraw/zinc/59/54/38/1031595438.db2.gz BKSYQKQTHDJFDN-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c(Br)c1 ZINC001205592314 1031859175 /nfs/dbraw/zinc/85/91/75/1031859175.db2.gz SKRKVZJTKXJKLM-HNNXBMFYSA-N 2 0 361.255 2.816 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3ccc(OCC[NH+](C)C)cc3)CC2)cc1 ZINC001138768812 1034635491 /nfs/dbraw/zinc/63/54/91/1034635491.db2.gz CAXFGRNZSSYSNY-UHFFFAOYSA-N 2 0 369.509 2.958 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139410969 1035094782 /nfs/dbraw/zinc/09/47/82/1035094782.db2.gz OAZBNVKWSPQZMG-NRFANRHFSA-N 2 0 359.514 2.604 20 10 FFCDRP C[NH+]1CCN(C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)c2ccccc2)CC1 ZINC000834562300 1035407945 /nfs/dbraw/zinc/40/79/45/1035407945.db2.gz IXKNOAAAQYWEEJ-VQTJNVASSA-N 2 0 351.494 2.958 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000835035728 1035490725 /nfs/dbraw/zinc/49/07/25/1035490725.db2.gz KIEXHTOPGGPTIL-PLNGDYQASA-N 2 0 365.525 2.702 20 10 FFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c1 ZINC001140620422 1035744385 /nfs/dbraw/zinc/74/43/85/1035744385.db2.gz NQSCZEZPJIHYRK-DENIHFKCSA-N 2 0 367.493 2.819 20 10 FFCDRP Cc1ccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c(O)c1 ZINC001140949557 1036546502 /nfs/dbraw/zinc/54/65/02/1036546502.db2.gz DRTGDTMEEPECDN-WOJBJXKFSA-N 2 0 371.525 2.608 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[NH2+]CC4)CC3)cc2)CC1 ZINC001235133155 1037379430 /nfs/dbraw/zinc/37/94/30/1037379430.db2.gz QMVLIVAMFHJLQN-UHFFFAOYSA-N 2 0 356.558 2.794 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3c(O)ccc4ccccc43)C[C@@H]1CC[NH2+]CC2 ZINC001235351661 1037498021 /nfs/dbraw/zinc/49/80/21/1037498021.db2.gz HFYCRJNGDKUYFX-JTSKRJEESA-N 2 0 368.477 2.910 20 10 FFCDRP Cc1cc(CN2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c(O)cc1Br ZINC001235402680 1037530094 /nfs/dbraw/zinc/53/00/94/1037530094.db2.gz XTIXIFMRGUYGDJ-HZPDHXFCSA-N 2 0 357.267 2.987 20 10 FFCDRP Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235423694 1037541611 /nfs/dbraw/zinc/54/16/11/1037541611.db2.gz GJFKMRLIVCSYRZ-MSOLQXFVSA-N 2 0 361.505 2.874 20 10 FFCDRP Cc1cc(C)c(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001231844827 1037943746 /nfs/dbraw/zinc/94/37/46/1037943746.db2.gz SFVNCWGSUWUCSG-UHFFFAOYSA-N 2 0 354.498 2.860 20 10 FFCDRP Fc1cccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001236433990 1038088943 /nfs/dbraw/zinc/08/89/43/1038088943.db2.gz NIWQJKSGAAUITM-UHFFFAOYSA-N 2 0 354.473 2.558 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)CC[C@@H]2C1 ZINC001236832379 1038294415 /nfs/dbraw/zinc/29/44/15/1038294415.db2.gz LSCASPSXHGPHOK-DENIHFKCSA-N 2 0 370.493 2.715 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](Oc4ccncc4)C3)c(F)c2)CC1 ZINC001236942641 1038370322 /nfs/dbraw/zinc/37/03/22/1038370322.db2.gz LEMVPLMHCJHDGF-HXUWFJFHSA-N 2 0 370.472 2.626 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](COCC4CC4)C3)c(F)c2)CC1 ZINC001236943152 1038371436 /nfs/dbraw/zinc/37/14/36/1038371436.db2.gz QAPUYRQGMCIOSS-SFHVURJKSA-N 2 0 361.505 2.826 20 10 FFCDRP CC[N@H+](CCn1ccnc1)Cc1c(O)cc(OC)cc1Br ZINC001237064114 1038430465 /nfs/dbraw/zinc/43/04/65/1038430465.db2.gz CDFLZYRQZXMHBW-UHFFFAOYSA-N 2 0 354.248 2.882 20 10 FFCDRP CCCCN(CCCC)c1ccc(C[NH+]2CCN(CC[NH3+])CC2)c(O)c1 ZINC001210029240 1039337969 /nfs/dbraw/zinc/33/79/69/1039337969.db2.gz SIVJWCOSVMZWLR-UHFFFAOYSA-N 2 0 362.562 2.875 20 10 FFCDRP FC(F)(F)Oc1ccc(N2CC[NH+]([C@H]3C[C@H]4C[NH2+]C[C@H]4C3)CC2)cc1 ZINC001246993562 1039569119 /nfs/dbraw/zinc/56/91/19/1039569119.db2.gz HUFFRCGPHIPUGK-MIFYACCESA-N 2 0 355.404 2.705 20 10 FFCDRP Oc1cccc(Cl)c1C[NH+]1CCC2(C[NH+](CCn3ccnc3)C2)CC1 ZINC001278490995 1039878938 /nfs/dbraw/zinc/87/89/38/1039878938.db2.gz OCNGIHIUPZMIJI-UHFFFAOYSA-N 2 0 360.889 2.840 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3ccc4c(c3O)C=CC(C)(C)O4)CC2)CC1 ZINC001249244247 1040645927 /nfs/dbraw/zinc/64/59/27/1040645927.db2.gz CNXXYDRPNYURQU-UHFFFAOYSA-N 2 0 371.525 2.788 20 10 FFCDRP CN(C)CC[N@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557138 1041146311 /nfs/dbraw/zinc/14/63/11/1041146311.db2.gz FRNSCGQBWOBXBV-IYBDPMFKSA-N 2 0 351.922 2.751 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557601 1041146928 /nfs/dbraw/zinc/14/69/28/1041146928.db2.gz LTCMFBGCPJJXSG-IYBDPMFKSA-N 2 0 368.905 2.810 20 10 FFCDRP Oc1ccc([C@H](O)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1O ZINC001255122684 1041157015 /nfs/dbraw/zinc/15/70/15/1041157015.db2.gz IUXLKTFVRDREAA-VQQMMKBISA-N 2 0 368.477 2.916 20 10 FFCDRP COc1ccc(C[N@@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001278565447 1041190427 /nfs/dbraw/zinc/19/04/27/1041190427.db2.gz MIAFKSNYBSYWTP-NRFANRHFSA-N 2 0 361.530 2.640 20 10 FFCDRP COc1ccc(O)c(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4cn[nH]c4)(C2)CCC3)c1 ZINC001278570746 1041214856 /nfs/dbraw/zinc/21/48/56/1041214856.db2.gz LCJLFVRMTCGEKO-UXHICEINSA-N 2 0 356.470 2.849 20 10 FFCDRP Cc1ccc(C[N@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c(O)c1 ZINC001279338710 1043011379 /nfs/dbraw/zinc/01/13/79/1043011379.db2.gz PFZRLRXCDVWPON-KDURUIRLSA-N 2 0 354.498 2.741 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001279523528 1043221453 /nfs/dbraw/zinc/22/14/53/1043221453.db2.gz YYSKPSIAPSWVQQ-GASCZTMLSA-N 2 0 373.419 2.501 20 10 FFCDRP Cc1cc(F)cc(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c1O ZINC001238059800 1043506517 /nfs/dbraw/zinc/50/65/17/1043506517.db2.gz DPZCUGWJDYIXSH-UHFFFAOYSA-N 2 0 358.461 2.690 20 10 FFCDRP Cc1cc(Br)cc(C)c1NC(=O)NCCC[NH2+]CCCC[NH3+] ZINC001239252946 1044085742 /nfs/dbraw/zinc/08/57/42/1044085742.db2.gz ZMDXWRSYYOAIPC-UHFFFAOYSA-N 2 0 371.323 2.906 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3cc(F)cc(C)c3O)C[C@H]2CC1 ZINC001280027761 1044102745 /nfs/dbraw/zinc/10/27/45/1044102745.db2.gz IQWNCEMMUNBRDB-CALCHBBNSA-N 2 0 366.477 2.604 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)ccc1N1CCOCC1 ZINC000849349680 1056836206 /nfs/dbraw/zinc/83/62/06/1056836206.db2.gz DUEATMBAGDBGBD-IBGZPJMESA-N 2 0 361.505 2.874 20 10 FFCDRP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155739488 509062529 /nfs/dbraw/zinc/06/25/29/509062529.db2.gz LTYBGQVKVVOBCE-XJKSGUPXSA-N 2 0 370.335 2.831 20 10 FFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000166057596 509594430 /nfs/dbraw/zinc/59/44/30/509594430.db2.gz AMILYSQKGNWWFL-SJLPKXTDSA-N 2 0 367.509 2.670 20 10 FFCDRP C[C@H]([NH2+]Cc1cccnc1N1CCN(C)CC1)c1ccc(F)c(F)c1[O-] ZINC000187668814 510377958 /nfs/dbraw/zinc/37/79/58/510377958.db2.gz XKWQMXKNCAMCAR-ZDUSSCGKSA-N 2 0 362.424 2.668 20 10 FFCDRP CN(CC[N@H+](C)Cc1cc(Br)ccc1O)C1CC[NH+](C)CC1 ZINC000289428222 511100730 /nfs/dbraw/zinc/10/07/30/511100730.db2.gz KHCGAIFUFOEHNI-UHFFFAOYSA-N 2 0 370.335 2.613 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CC2(O)CC[NH+](C)CC2)c1O ZINC000275300026 512098907 /nfs/dbraw/zinc/09/89/07/512098907.db2.gz HVTTWJVUYCLDIF-LBPRGKRZSA-N 2 0 357.292 2.570 20 10 FFCDRP CN1CC[NH+](CC2(C)CC[NH+](Cc3c(O)cccc3Cl)CC2)CC1 ZINC000757967690 736440365 /nfs/dbraw/zinc/44/03/65/736440365.db2.gz ZMWCLPJDCOSNRA-UHFFFAOYSA-N 2 0 351.922 2.895 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000844910433 748134683 /nfs/dbraw/zinc/13/46/83/748134683.db2.gz IBKRXVCHAFMWRK-ARFHVFGLSA-N 2 0 354.878 2.915 20 10 FFCDRP Cc1nc(CC2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)no1 ZINC000896552093 971577591 /nfs/dbraw/zinc/57/75/91/971577591.db2.gz URAVRFKUPVVUDN-UHFFFAOYSA-N 2 0 369.513 2.585 20 10 FFCDRP CSc1c[nH]c2ncnc(NCc3ccc(N4CC[NH+](C)CC4)cc3)c12 ZINC001167426532 963027008 /nfs/dbraw/zinc/02/70/08/963027008.db2.gz IICPTPOHZWUTGO-UHFFFAOYSA-N 2 0 368.510 2.995 20 10 FFCDRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2c(C)cccc2O)CC1 ZINC000877522641 1014611195 /nfs/dbraw/zinc/61/11/95/1014611195.db2.gz QHZPAXACFPGVLQ-UHFFFAOYSA-N 2 0 361.530 2.761 20 10 FFCDRP COc1cc(O)c(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1OC ZINC000904472388 980282723 /nfs/dbraw/zinc/28/27/23/980282723.db2.gz FTEZBKODIKPMSO-KKSFZXQISA-N 2 0 370.449 2.755 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)Nc2ccccc2C[NH3+])[NH+](C)C)cc1 ZINC000904621946 980305493 /nfs/dbraw/zinc/30/54/93/980305493.db2.gz FVJVDTMROLOCKE-IBGZPJMESA-N 2 0 355.486 2.636 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccc(F)c(F)c3)cc2)CC1 ZINC000905426301 980438574 /nfs/dbraw/zinc/43/85/74/980438574.db2.gz HRVBAVAESSRMGS-FQEVSTJZSA-N 2 0 361.436 2.540 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)CCn3cccn3)cc2F)CC1 ZINC000157758103 984639096 /nfs/dbraw/zinc/63/90/96/984639096.db2.gz DPKSOWWOZKGXPT-KRWDZBQOSA-N 2 0 359.493 2.733 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126118 986556747 /nfs/dbraw/zinc/55/67/47/986556747.db2.gz GRVUJYMCZHRKFT-LEWJYISDSA-N 3 0 356.558 2.650 20 10 FFCDRP C[NH+](C)CC[C@@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cccnc1 ZINC000922627609 988765390 /nfs/dbraw/zinc/76/53/90/988765390.db2.gz KIEPKJRBZJMCCN-JOCHJYFZSA-N 2 0 367.541 2.616 20 10 FFCDRP Cc1cccc2c1OC[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000810178615 994723636 /nfs/dbraw/zinc/72/36/36/994723636.db2.gz SQAPVZGUSADPKF-FQEVSTJZSA-N 2 0 351.494 2.840 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)cc2)CC1 ZINC000824695650 997059195 /nfs/dbraw/zinc/05/91/95/997059195.db2.gz AGEIYAZUZNJBDX-BHDDXSALSA-N 2 0 357.542 2.954 20 10 FFCDRP COc1ccc(N2CC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000826844941 1016100655 /nfs/dbraw/zinc/10/06/55/1016100655.db2.gz CIYLZQFGIKEQGV-SFHVURJKSA-N 2 0 352.482 2.928 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@H]1CO[C@@H](C2CC2)C1 ZINC000825379282 997351558 /nfs/dbraw/zinc/35/15/58/997351558.db2.gz MMZTZQRXNNHRGR-IFMALSPDSA-N 2 0 355.526 2.876 20 10 FFCDRP CN(C)c1ccc(CN(C)C(=O)CN(CCC[NH3+])Cc2ccccc2)cc1 ZINC000844223456 997712667 /nfs/dbraw/zinc/71/26/67/997712667.db2.gz WZSCWNRDSPVANW-UHFFFAOYSA-N 2 0 368.525 2.562 20 10 FFCDRP CC(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768530143 1000285032 /nfs/dbraw/zinc/28/50/32/1000285032.db2.gz ZGIYUOASMPLVEI-FQEVSTJZSA-N 2 0 373.541 2.992 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3C[C@]3(C)Br)cc2)CC1 ZINC001183534574 1002311973 /nfs/dbraw/zinc/31/19/73/1002311973.db2.gz RANLEWXSLNSAGL-WBVHZDCISA-N 2 0 352.320 2.702 20 10 FFCDRP Oc1cc2c(cc1CN1C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C1)OCO2 ZINC000793243142 1003317330 /nfs/dbraw/zinc/31/73/30/1003317330.db2.gz VBWHIKCWSRODKF-HDICACEKSA-N 2 0 352.434 2.685 20 10 FFCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860614 /nfs/dbraw/zinc/86/06/14/1003860614.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 3 0 356.558 2.602 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3COc4cc(F)ccc4C3)cc2)CC1 ZINC000850381828 1005812171 /nfs/dbraw/zinc/81/21/71/1005812171.db2.gz JYKZVARYEVTPMV-LJQANCHMSA-N 2 0 355.457 2.671 20 10 FFCDRP Cn1cc(C[C@@H]2CCC[C@H]2[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000850384898 1005812409 /nfs/dbraw/zinc/81/24/09/1005812409.db2.gz SRQZLUYODRJSHU-RBBKRZOGSA-N 2 0 367.541 2.673 20 10 FFCDRP Fc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc1N1CCOCC1 ZINC000134210158 1007372084 /nfs/dbraw/zinc/37/20/84/1007372084.db2.gz JWFMMYKAKFKLIQ-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817902960 1007805057 /nfs/dbraw/zinc/80/50/57/1007805057.db2.gz CLSKLMQPSFCFSE-MORSLUCNSA-N 2 0 369.456 2.599 20 10 FFCDRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817917586 1007808444 /nfs/dbraw/zinc/80/84/44/1007808444.db2.gz SEJPHCXGRIWFBA-PGRDOPGGSA-N 3 0 356.558 2.696 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc(F)c1N1CCOCC1 ZINC000817937300 1007815642 /nfs/dbraw/zinc/81/56/42/1007815642.db2.gz XVZBWAISXBHCMA-ATZDWAIDSA-N 2 0 365.468 2.812 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)ccc1N1CCOCC1 ZINC000925480698 1017764487 /nfs/dbraw/zinc/76/44/87/1017764487.db2.gz MZCAQGGMCHVBLM-UYAOXDASSA-N 2 0 361.505 2.920 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)cc2F)CC1 ZINC000902796094 1020483070 /nfs/dbraw/zinc/48/30/70/1020483070.db2.gz MUYDUHRAMHPRMX-IEIALMLTSA-N 2 0 373.516 2.871 20 10 FFCDRP CC(C)(C)[NH2+]CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001116407594 1021202194 /nfs/dbraw/zinc/20/21/94/1021202194.db2.gz PKZXBWBCNJEEBQ-OAHLLOKOSA-N 2 0 353.894 2.514 20 10 FFCDRP CCOC(=O)c1c(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c2ccccc2n1C ZINC001222629426 1033081943 /nfs/dbraw/zinc/08/19/43/1033081943.db2.gz GIAGQFMKCPTROE-IYBDPMFKSA-N 2 0 355.482 2.786 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C(=O)NCC[NH+](C)C ZINC000756858418 1023760110 /nfs/dbraw/zinc/76/01/10/1023760110.db2.gz PGWHTHSCBSSOBL-IMJJTQAJSA-N 2 0 365.493 2.762 20 10 FFCDRP CCc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000840908566 1029917873 /nfs/dbraw/zinc/91/78/73/1029917873.db2.gz TXGATHWQBYDIIR-UHFFFAOYSA-N 2 0 365.525 2.861 20 10 FFCDRP Oc1cc2c(cc1C[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)OCO2 ZINC000841072801 1030016484 /nfs/dbraw/zinc/01/64/84/1030016484.db2.gz IBKZLOMZQJPIBE-DOTOQJQBSA-N 2 0 358.413 2.743 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1cccc(OC)c1O ZINC001203596859 1030778147 /nfs/dbraw/zinc/77/81/47/1030778147.db2.gz POEHBJZGDWJLFI-UHFFFAOYSA-N 2 0 351.535 2.886 20 10 FFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cc(OC)ccc1O)C2 ZINC001203673451 1030822341 /nfs/dbraw/zinc/82/23/41/1030822341.db2.gz ZCLDCUMSQQPOCR-NQIIRXRSSA-N 2 0 360.498 2.581 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)cc1 ZINC000843058451 1031165067 /nfs/dbraw/zinc/16/50/67/1031165067.db2.gz SLJCAKOKHUPWLK-TZIWHRDSSA-N 2 0 372.557 2.613 20 10 FFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)cc2F)C[C@@H](C)O1 ZINC000843342112 1031335729 /nfs/dbraw/zinc/33/57/29/1031335729.db2.gz JDMMUPWHBYECIC-SIZVQLJJSA-N 2 0 361.505 2.917 20 10 FFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)cc2F)C[C@H](C)O1 ZINC000843342113 1031336312 /nfs/dbraw/zinc/33/63/12/1031336312.db2.gz JDMMUPWHBYECIC-XWCCPHMRSA-N 2 0 361.505 2.917 20 10 FFCDRP [NH3+]C[C@]1(O)CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001205240358 1031620698 /nfs/dbraw/zinc/62/06/98/1031620698.db2.gz JGRGHBMBXWOXTN-NRFANRHFSA-N 2 0 356.466 2.647 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139256458 1035029666 /nfs/dbraw/zinc/02/96/66/1035029666.db2.gz CFIPPKQLPXTETM-LJQANCHMSA-N 2 0 371.481 2.901 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3cccc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139261109 1035033128 /nfs/dbraw/zinc/03/31/28/1035033128.db2.gz UTJWCAXESBDPTQ-GOSISDBHSA-N 2 0 371.481 2.819 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH+](CC4CCCC4)CC3)cc2)CC1 ZINC001139409637 1035093705 /nfs/dbraw/zinc/09/37/05/1035093705.db2.gz NTBMCRJMMGWFDN-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP Cc1cccc(O[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC001139411636 1035094684 /nfs/dbraw/zinc/09/46/84/1035094684.db2.gz WCRYMMYYJGEDFN-OAQYLSRUSA-N 2 0 366.509 2.795 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(CC(=O)OC)CC3)cc2)CC1 ZINC001140302044 1035424914 /nfs/dbraw/zinc/42/49/14/1035424914.db2.gz ISROTHKGGBQAJR-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP CN(C)c1ccc(/C=C/CN2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028827 1035489725 /nfs/dbraw/zinc/48/97/25/1035489725.db2.gz SRTFUQUTRSVFCS-XYXUZSOXSA-N 2 0 356.558 2.868 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC(C[NH+](C)C)CC2)cc1Br ZINC001233140173 1036389097 /nfs/dbraw/zinc/38/90/97/1036389097.db2.gz YMOYGAKVTIHAKD-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235236205 1037426680 /nfs/dbraw/zinc/42/66/80/1037426680.db2.gz CSQUGXBTDNWLCA-QFIPXVFZSA-N 3 0 374.548 2.932 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN(C[C@@H]4CCCC[NH2+]4)C3)C2)cc1 ZINC001235494946 1037586576 /nfs/dbraw/zinc/58/65/76/1037586576.db2.gz UKDSXUBVDOECMR-UGKGYDQZSA-N 2 0 373.541 2.756 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@@H]2C1 ZINC001231587071 1037706145 /nfs/dbraw/zinc/70/61/45/1037706145.db2.gz JLYDXZKGKSHWOR-XMSQKQJNSA-N 2 0 370.493 2.715 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cc2)CC1 ZINC001235883741 1037816848 /nfs/dbraw/zinc/81/68/48/1037816848.db2.gz MBVIHVSMSCRDFL-JOCHJYFZSA-N 3 0 356.558 2.793 20 10 FFCDRP COc1ccccc1C[C@H](C)[N@H+](C)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236110596 1037935165 /nfs/dbraw/zinc/93/51/65/1037935165.db2.gz BWBPHUYCHFMNOQ-HNNXBMFYSA-N 2 0 356.466 2.946 20 10 FFCDRP COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236114069 1037937597 /nfs/dbraw/zinc/93/75/97/1037937597.db2.gz ZLTZQYYMMLKOHV-QGZVFWFLSA-N 2 0 369.509 2.873 20 10 FFCDRP Cc1cc(F)ccc1N1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001236153669 1037954320 /nfs/dbraw/zinc/95/43/20/1037954320.db2.gz LKUGBUXKIOTTNW-UHFFFAOYSA-N 2 0 371.456 2.644 20 10 FFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1cc(OCc2ccccc2)ccc1O ZINC001236784460 1038265359 /nfs/dbraw/zinc/26/53/59/1038265359.db2.gz FMRKPCNAKZJONA-UHFFFAOYSA-N 2 0 371.525 2.896 20 10 FFCDRP C[N@H+](C1CC1)C1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236941891 1038370744 /nfs/dbraw/zinc/37/07/44/1038370744.db2.gz GPPACBZVBIPNGI-UHFFFAOYSA-N 2 0 360.521 2.636 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)c2ccc(F)c(F)c2)CC1 ZINC001253377788 1040142783 /nfs/dbraw/zinc/14/27/83/1040142783.db2.gz WMUTUBPZWBAHKD-FQEVSTJZSA-N 2 0 362.420 2.958 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCN(Cc4ccccc4)C3)cc2)CC1 ZINC001255099480 1041139951 /nfs/dbraw/zinc/13/99/51/1041139951.db2.gz HEZYKFVZFRBXRX-QFIPXVFZSA-N 2 0 364.537 2.803 20 10 FFCDRP Oc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]CCn4ccnc4)(C2)CCC3)c(O)c1 ZINC001279225324 1042952229 /nfs/dbraw/zinc/95/22/29/1042952229.db2.gz FOPCNDOGPOAPLI-UXHICEINSA-N 2 0 356.470 2.519 20 10 FFCDRP Cc1ccc(C[NH+]2CCC3(CC[N@H+](CCn4ccnc4)C3)CC2)c(O)c1 ZINC001279338761 1043011220 /nfs/dbraw/zinc/01/12/20/1043011220.db2.gz PVTFZMPVDPEHSH-UHFFFAOYSA-N 2 0 354.498 2.885 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC12C[NH2+]C2 ZINC001237431297 1043156600 /nfs/dbraw/zinc/15/66/00/1043156600.db2.gz QODJLVGUVNOQHJ-FQEVSTJZSA-N 2 0 371.525 2.652 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CC[C@@H](C4CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001324455114 1046039954 /nfs/dbraw/zinc/03/99/54/1046039954.db2.gz IDELTXAIZLIDIP-HXUWFJFHSA-N 3 0 374.548 2.741 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CC[C@H](C4CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001324455099 1046040147 /nfs/dbraw/zinc/04/01/47/1046040147.db2.gz IDELTXAIZLIDIP-FQEVSTJZSA-N 3 0 374.548 2.741 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202856 1046809184 /nfs/dbraw/zinc/80/91/84/1046809184.db2.gz WFSYWIFDXYJWBG-PMACEKPBSA-N 3 0 374.548 2.789 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001328087274 1048172117 /nfs/dbraw/zinc/17/21/17/1048172117.db2.gz WCEOSKYBSRBAFG-WBVHZDCISA-N 2 0 359.514 2.829 20 10 FFCDRP CCc1cccc(C[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)c1O ZINC001346540787 1053088046 /nfs/dbraw/zinc/08/80/46/1053088046.db2.gz PXPRMNXDXSVJLJ-UHFFFAOYSA-N 2 0 353.510 2.992 20 10 FFCDRP C[NH2+]CCc1ccccc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC001523575964 1062525032 /nfs/dbraw/zinc/52/50/32/1062525032.db2.gz CIOOBYWJDORRFF-NRFANRHFSA-N 2 0 368.525 2.547 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCc4ccccc4C3)cc2)CC1 ZINC001473922563 1065420290 /nfs/dbraw/zinc/42/02/90/1065420290.db2.gz ZJSLREGVJULNGW-UHFFFAOYSA-N 2 0 364.537 2.586 20 10 FFCDRP CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722858 1076063219 /nfs/dbraw/zinc/06/32/19/1076063219.db2.gz DFEIEGXJVXGLSG-QUCCMNQESA-N 2 0 360.546 2.594 20 10 FFCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 ZINC001560354830 1076267395 /nfs/dbraw/zinc/26/73/95/1076267395.db2.gz DPSANRHRMGPDFH-UHFFFAOYSA-N 2 0 362.537 2.789 20 10 FFCDRP C[N@H+](CCC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC001589178401 1080397924 /nfs/dbraw/zinc/39/79/24/1080397924.db2.gz BVFYDFXGCQUGQN-UHFFFAOYSA-N 2 0 372.557 2.709 20 10 FFCDRP Cc1ccc(O)c(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000113339855 508261680 /nfs/dbraw/zinc/26/16/80/508261680.db2.gz DSZJKXYOSCRYQO-IBGZPJMESA-N 2 0 367.493 2.688 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1 ZINC000186060436 509504761 /nfs/dbraw/zinc/50/47/61/509504761.db2.gz LBMVNIXCKGDJEI-OAHLLOKOSA-N 2 0 371.481 2.543 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1O ZINC000183503988 509830296 /nfs/dbraw/zinc/83/02/96/509830296.db2.gz OPKVOEGOMNDLBM-APWZRJJASA-N 2 0 367.493 2.940 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cn(C)nc3C)cc2F)CC1 ZINC000177971600 510352950 /nfs/dbraw/zinc/35/29/50/510352950.db2.gz QUTPHUUJQYEDMJ-OAHLLOKOSA-N 2 0 359.493 2.860 20 10 FFCDRP CCOc1ccc(O)c(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000271243854 511135114 /nfs/dbraw/zinc/13/51/14/511135114.db2.gz ZOPIFWLTBIJJCU-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP CN(Cc1cccs1)c1ccc(C[NH2+]CC2(O)CC[NH+](C)CC2)cc1 ZINC000294921522 511222580 /nfs/dbraw/zinc/22/25/80/511222580.db2.gz ARXBHKKEQQBOCX-UHFFFAOYSA-N 2 0 359.539 2.931 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000274941522 511994232 /nfs/dbraw/zinc/99/42/32/511994232.db2.gz SXAJECOVRTVYCV-HIFRSBDPSA-N 2 0 357.292 2.652 20 10 FFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)c(Cl)c1 ZINC000840946563 747238482 /nfs/dbraw/zinc/23/84/82/747238482.db2.gz RMTSIMXBVNEXPU-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C(=O)NCC[NH+](C)C ZINC000841749168 747448400 /nfs/dbraw/zinc/44/84/00/747448400.db2.gz AXWRLQHQSGPQMC-CJNGLKHVSA-N 2 0 355.910 2.789 20 10 FFCDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000848716074 748993128 /nfs/dbraw/zinc/99/31/28/748993128.db2.gz DPMZREYBOKLOCB-LSDHHAIUSA-N 2 0 357.420 2.902 20 10 FFCDRP CC[N@@H+]1CC[C@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000162800561 972135766 /nfs/dbraw/zinc/13/57/66/972135766.db2.gz SUTAWWNUVAWWAJ-KNQAVFIVSA-N 2 0 374.573 2.527 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc([C@@H]4CCC[NH2+]4)cn3)cc2)CC1 ZINC001167422800 963011219 /nfs/dbraw/zinc/01/12/19/963011219.db2.gz BURRKEKJSVFSAC-FQEVSTJZSA-N 2 0 351.498 2.870 20 10 FFCDRP COc1ccc(C[NH2+]CC[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@H]2C)cc1C ZINC001104625217 969954848 /nfs/dbraw/zinc/95/48/48/969954848.db2.gz AAJRSJJUANIKCY-IEBWSBKVSA-N 2 0 361.530 2.530 20 10 FFCDRP Cc1ccc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)c(O)c1 ZINC000876633460 1014333411 /nfs/dbraw/zinc/33/34/11/1014333411.db2.gz BQSWEXKWWDCAMN-UHFFFAOYSA-N 2 0 361.530 2.617 20 10 FFCDRP C[NH2+]Cc1ccccc1NC(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000904506926 980289178 /nfs/dbraw/zinc/28/91/78/980289178.db2.gz RUXMOQVTQHWXCZ-HXUWFJFHSA-N 2 0 369.513 2.896 20 10 FFCDRP C[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728610 983998936 /nfs/dbraw/zinc/99/89/36/983998936.db2.gz MVRNXXBHSGEHLT-MJGOQNOKSA-N 2 0 372.557 2.611 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000879648282 1015624179 /nfs/dbraw/zinc/62/41/79/1015624179.db2.gz IKETWWAAGJMAIB-AOIWGVFYSA-N 2 0 367.493 2.822 20 10 FFCDRP CCC[N@H+](C)CC(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1 ZINC001106910876 991535522 /nfs/dbraw/zinc/53/55/22/991535522.db2.gz SUWQCJNPZNZXED-IEBWSBKVSA-N 2 0 361.530 2.530 20 10 FFCDRP Cc1c(C[C@@H](C[NH3+])C[N@H+](Cc2ccccc2O)C2CCCC2)cnn1C ZINC000903892676 1016291305 /nfs/dbraw/zinc/29/13/05/1016291305.db2.gz LEBQDJSUJQLPGY-KRWDZBQOSA-N 2 0 356.514 2.996 20 10 FFCDRP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738170223 999622665 /nfs/dbraw/zinc/62/26/65/999622665.db2.gz OCWKWMUYKCTVOT-SFHVURJKSA-N 2 0 354.498 2.542 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1O ZINC000846143280 1000218380 /nfs/dbraw/zinc/21/83/80/1000218380.db2.gz DGCOUJAEUACWHA-HNNXBMFYSA-N 2 0 371.481 2.543 20 10 FFCDRP C[C@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CC[C@H]1N1CC[NH+](C)CC1 ZINC000768465732 1000263696 /nfs/dbraw/zinc/26/36/96/1000263696.db2.gz RLNXPYWOWKHKCA-LAUBAEHRSA-N 2 0 357.542 2.729 20 10 FFCDRP COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771841218 1001211501 /nfs/dbraw/zinc/21/15/01/1001211501.db2.gz FWYCZTIFGWDTHX-OAQYLSRUSA-N 2 0 353.510 2.786 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](OCC(F)(F)F)C3)cc2)CC1 ZINC000771824644 1001220571 /nfs/dbraw/zinc/22/05/71/1001220571.db2.gz OZEAUIHTBOADEO-SFHVURJKSA-N 2 0 371.447 2.982 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@@]3(C)Br)cc2)CC1 ZINC001183534555 1002312320 /nfs/dbraw/zinc/31/23/20/1002312320.db2.gz RANLEWXSLNSAGL-DOTOQJQBSA-N 2 0 352.320 2.702 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000793044481 1003265243 /nfs/dbraw/zinc/26/52/43/1003265243.db2.gz YOVBOAZADJFYHA-UHFFFAOYSA-N 2 0 372.479 2.889 20 10 FFCDRP Cn1ncc2c1CCC[C@@H]2[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732927 1003895284 /nfs/dbraw/zinc/89/52/84/1003895284.db2.gz RTXHYLMBNCSOKA-FQEVSTJZSA-N 2 0 353.514 2.681 20 10 FFCDRP COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000850235111 1005797678 /nfs/dbraw/zinc/79/76/78/1005797678.db2.gz RQHXWOHIDRDAHQ-ZLGUVYLKSA-N 2 0 371.525 2.506 20 10 FFCDRP C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850411954 1005813685 /nfs/dbraw/zinc/81/36/85/1005813685.db2.gz PETOUHDXXILRKS-PGRDOPGGSA-N 2 0 353.510 2.693 20 10 FFCDRP CCN(C)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000883283771 1006730697 /nfs/dbraw/zinc/73/06/97/1006730697.db2.gz SJIKNKHLLGYNEM-UHFFFAOYSA-N 2 0 353.514 2.579 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(-n4ccnc4)cs3)cc2)CC1 ZINC000883283640 1006731095 /nfs/dbraw/zinc/73/10/95/1006731095.db2.gz MQRMPOCAZYGNAK-UHFFFAOYSA-N 2 0 367.522 2.975 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000883283641 1006731194 /nfs/dbraw/zinc/73/11/94/1006731194.db2.gz MSPBZNVAMPUOAD-UHFFFAOYSA-N 2 0 358.417 2.776 20 10 FFCDRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000883283932 1006733013 /nfs/dbraw/zinc/73/30/13/1006733013.db2.gz ZEOBTCBWTFQWHU-QRFRQXIXSA-N 2 0 359.514 2.506 20 10 FFCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 ZINC000817889966 1007796975 /nfs/dbraw/zinc/79/69/75/1007796975.db2.gz QYYGMYGRXAQPHC-YZGWKJHDSA-N 2 0 372.557 2.789 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC001177683794 1008703212 /nfs/dbraw/zinc/70/32/12/1008703212.db2.gz VHBZEWBMRGJKNY-UHFFFAOYSA-N 2 0 370.453 2.515 20 10 FFCDRP c1cc(N2CCC(C[NH2+]Cc3ccc(N4CCOCC4)cc3)CC2)cc[nH+]1 ZINC001178304448 1008942861 /nfs/dbraw/zinc/94/28/61/1008942861.db2.gz HQOWTNCZYFYSTO-UHFFFAOYSA-N 2 0 366.509 2.924 20 10 FFCDRP CC1(C)[C@@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925505972 1017770026 /nfs/dbraw/zinc/77/00/26/1017770026.db2.gz UPRUVCGSELUVSO-HKBOAZHASA-N 2 0 357.542 2.762 20 10 FFCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC(C(N)=O)CC2)cc1 ZINC000925778720 1017846218 /nfs/dbraw/zinc/84/62/18/1017846218.db2.gz WYMYZLXURHFDOK-XLIONFOSSA-N 2 0 372.557 2.789 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC000827662187 1018602212 /nfs/dbraw/zinc/60/22/12/1018602212.db2.gz NCKMEZKQKXEHET-UHFFFAOYSA-N 2 0 366.509 2.801 20 10 FFCDRP C[NH+](C)CCOc1ccccc1N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000779017978 1022654763 /nfs/dbraw/zinc/65/47/63/1022654763.db2.gz KQNXGSPHTNNYKM-UHFFFAOYSA-N 2 0 373.472 2.794 20 10 FFCDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000159848116 1022817603 /nfs/dbraw/zinc/81/76/03/1022817603.db2.gz ROMXLXKODXBLPJ-UHFFFAOYSA-N 2 0 364.486 2.691 20 10 FFCDRP C[C@@H]([NH3+])c1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC001122413802 1023252231 /nfs/dbraw/zinc/25/22/31/1023252231.db2.gz BAKFVDZRXZIITH-QRWLVFNGSA-N 2 0 354.498 2.805 20 10 FFCDRP Cc1ccc(O)c(C[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c1 ZINC000076331160 1023281861 /nfs/dbraw/zinc/28/18/61/1023281861.db2.gz GQJIIVKJYJXOQD-UHFFFAOYSA-N 2 0 367.493 2.816 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218484562 1033176724 /nfs/dbraw/zinc/17/67/24/1033176724.db2.gz HQUJLKBKXNEUKX-AVRDEDQJSA-N 2 0 351.494 2.996 20 10 FFCDRP Cc1nn(C)cc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000092855776 1027477634 /nfs/dbraw/zinc/47/76/34/1027477634.db2.gz ZZDNMKZGOQHOLN-UHFFFAOYSA-N 2 0 353.514 2.550 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cc(N(C)C)cc[nH+]3)CC2)cc1 ZINC001156260490 1029116673 /nfs/dbraw/zinc/11/66/73/1029116673.db2.gz DUSICIVHOOBXKF-UHFFFAOYSA-N 2 0 369.513 2.780 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3[nH+]ccc4c3CCN4)CC2)cc1 ZINC001164327872 1029248458 /nfs/dbraw/zinc/24/84/58/1029248458.db2.gz PVYJWUFMRZCBHO-UHFFFAOYSA-N 2 0 367.497 2.682 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C(C)(C)[C@@H]([NH3+])c2ccccc2)cc1 ZINC000841846533 1030498874 /nfs/dbraw/zinc/49/88/74/1030498874.db2.gz PLECOQQOOIJKEV-OALUTQOASA-N 2 0 354.498 2.595 20 10 FFCDRP CCn1cncc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000841865426 1030507904 /nfs/dbraw/zinc/50/79/04/1030507904.db2.gz BQOZSAQUXKPDFJ-UHFFFAOYSA-N 2 0 353.514 2.725 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCN(c4cccnc4)CC3)cc2)CC1 ZINC001139411085 1035094810 /nfs/dbraw/zinc/09/48/10/1035094810.db2.gz UDTAINZWQABJMI-UHFFFAOYSA-N 2 0 365.525 2.546 20 10 FFCDRP CCOC(=O)[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139413543 1035096436 /nfs/dbraw/zinc/09/64/36/1035096436.db2.gz WCHLLTWWZUGVRB-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@H](F)CO4)CC3)cc2)CC1 ZINC001140306569 1035428005 /nfs/dbraw/zinc/42/80/05/1035428005.db2.gz UAYCGGCJNCUVJW-IBGZPJMESA-N 2 0 361.505 2.922 20 10 FFCDRP COc1cc(Cl)cc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c1O ZINC001233290577 1036495112 /nfs/dbraw/zinc/49/51/12/1036495112.db2.gz KWEBNMBHFHMOQP-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158841 1037389866 /nfs/dbraw/zinc/38/98/66/1037389866.db2.gz WGFGCXMJKSNBFY-JOCHJYFZSA-N 3 0 374.548 2.932 20 10 FFCDRP COc1ccccc1O[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235689515 1037684624 /nfs/dbraw/zinc/68/46/24/1037684624.db2.gz ZYFXOUKGQLOWDI-HXUWFJFHSA-N 2 0 367.493 2.758 20 10 FFCDRP c1ccc(COC[C@H]2CC[N@@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235714908 1037706676 /nfs/dbraw/zinc/70/66/76/1037706676.db2.gz MMRMWPIUQIAYKW-JOCHJYFZSA-N 2 0 351.494 2.887 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4c(N)cccc4C3)cc2)CC1 ZINC001236361964 1038057724 /nfs/dbraw/zinc/05/77/24/1038057724.db2.gz CMGBRWYGORHXJK-UHFFFAOYSA-N 2 0 350.510 2.969 20 10 FFCDRP COc1cc(C)c(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001236808003 1038282129 /nfs/dbraw/zinc/28/21/29/1038282129.db2.gz JNURIHAMGNFUNJ-XMSQKQJNSA-N 2 0 374.525 2.890 20 10 FFCDRP CCOC(=O)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001237114168 1038446917 /nfs/dbraw/zinc/44/69/17/1038446917.db2.gz CKAKZFZITGDDBQ-PKOBYXMFSA-N 2 0 359.514 2.507 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC12C[NH2+]C2 ZINC001237431301 1043156913 /nfs/dbraw/zinc/15/69/13/1043156913.db2.gz QODJLVGUVNOQHJ-HXUWFJFHSA-N 2 0 371.525 2.652 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CC[NH+](Cc1ccc(C(F)(F)F)cc1O)CC2 ZINC001279514294 1043210483 /nfs/dbraw/zinc/21/04/83/1043210483.db2.gz POEQUPOSJXHFEQ-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP COc1ccc(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c([O-])c1Cl ZINC001279665387 1043429315 /nfs/dbraw/zinc/42/93/15/1043429315.db2.gz KLUOBTDDWUITGQ-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP COc1cc(CN2CC3(CC[N@@H+]3C3CCCC3)C2)cc(C[NH+](C)C)c1O ZINC001279698511 1043490621 /nfs/dbraw/zinc/49/06/21/1043490621.db2.gz MWJDVJXBIPWTAT-UHFFFAOYSA-N 2 0 359.514 2.665 20 10 FFCDRP COC[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1ccc(C)o1 ZINC001318880540 1044920491 /nfs/dbraw/zinc/92/04/91/1044920491.db2.gz JXVGNYFKJCLQCB-GOSISDBHSA-N 2 0 361.461 2.956 20 10 FFCDRP Cn1ccnc1C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001320203248 1045368072 /nfs/dbraw/zinc/36/80/72/1045368072.db2.gz PVFKJMITBHQIDS-FQEVSTJZSA-N 2 0 367.541 2.627 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001328087270 1048172503 /nfs/dbraw/zinc/17/25/03/1048172503.db2.gz WCEOSKYBSRBAFG-NVXWUHKLSA-N 2 0 359.514 2.829 20 10 FFCDRP [NH3+]Cc1ccccc1C(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1 ZINC001340891516 1051221242 /nfs/dbraw/zinc/22/12/42/1051221242.db2.gz AACKQXRFZMIPCB-UHFFFAOYSA-N 2 0 364.493 2.930 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H](C)N2CC[NH+](CC)CC2)cc1F ZINC001308199221 1052431154 /nfs/dbraw/zinc/43/11/54/1052431154.db2.gz HTKBJMCTWLRXAZ-KRWDZBQOSA-N 2 0 350.526 2.788 20 10 FFCDRP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)N1CCc2ccccc21 ZINC001308238064 1052434687 /nfs/dbraw/zinc/43/46/87/1052434687.db2.gz SFCIALFGWGGWIE-LJQANCHMSA-N 2 0 364.537 2.979 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3ccc(F)c(F)c3)cc2)CC1 ZINC001461187385 1061244708 /nfs/dbraw/zinc/24/47/08/1061244708.db2.gz DRDYRQSNFVZZDU-UHFFFAOYSA-N 2 0 361.436 2.885 20 10 FFCDRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000123860905 508749299 /nfs/dbraw/zinc/74/92/99/508749299.db2.gz AHAUBFRCFCTIDX-UHFFFAOYSA-N 2 0 361.873 2.627 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000185322076 510805450 /nfs/dbraw/zinc/80/54/50/510805450.db2.gz PAVKZIRKPUPHDJ-MRXNPFEDSA-N 2 0 355.482 2.843 20 10 FFCDRP Cc1cc(O)c(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)cc1C ZINC000289886555 511119839 /nfs/dbraw/zinc/11/98/39/511119839.db2.gz SKWXSCPVFDAXJE-UHFFFAOYSA-N 2 0 373.541 2.823 20 10 FFCDRP C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)CN1CC[NH+](C)CC1 ZINC000280784564 511601614 /nfs/dbraw/zinc/60/16/14/511601614.db2.gz FYHCCDRBFQVQMD-HNNXBMFYSA-N 2 0 372.479 2.745 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)[NH+](C)C)C1 ZINC000443921900 514072699 /nfs/dbraw/zinc/07/26/99/514072699.db2.gz PJAADYKXCBCBIL-UHFFFAOYSA-N 2 0 370.541 2.864 20 10 FFCDRP CC[NH+]1CCN(CCCC[NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000858096934 730416456 /nfs/dbraw/zinc/41/64/56/730416456.db2.gz UAHIXGLQBYJEQH-UHFFFAOYSA-N 2 0 354.489 2.538 20 10 FFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000858126328 730417219 /nfs/dbraw/zinc/41/72/19/730417219.db2.gz XWXAGPJSVKXFIP-AWEZNQCLSA-N 2 0 370.335 2.518 20 10 FFCDRP C[C@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000873291360 731897675 /nfs/dbraw/zinc/89/76/75/731897675.db2.gz FTLSXWGZCRFTSR-JSGCOSHPSA-N 2 0 369.303 2.964 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)c1O ZINC000817973246 742225629 /nfs/dbraw/zinc/22/56/29/742225629.db2.gz RNWZUHGBUMAJGM-RISCZKNCSA-N 2 0 365.827 2.841 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1Cl ZINC000825096574 743209507 /nfs/dbraw/zinc/20/95/07/743209507.db2.gz IGMZKPZDKFOTNW-UHFFFAOYSA-N 2 0 360.889 2.791 20 10 FFCDRP CCN1CC[NH+](CCCC[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000825107570 743211214 /nfs/dbraw/zinc/21/12/14/743211214.db2.gz JCAGCBVAKZPVJK-UHFFFAOYSA-N 2 0 370.335 2.662 20 10 FFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000825275455 743239325 /nfs/dbraw/zinc/23/93/25/743239325.db2.gz NZWMPDMOSVNLEK-UHFFFAOYSA-N 2 0 355.910 2.560 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1O ZINC000843059184 747757544 /nfs/dbraw/zinc/75/75/44/747757544.db2.gz FNXMXIARYOLRTI-ZLKJLUDKSA-N 2 0 355.276 2.723 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c1O ZINC000843126917 747777766 /nfs/dbraw/zinc/77/77/66/747777766.db2.gz NIKGCMNJEKOXOC-CYBMUJFWSA-N 2 0 369.303 2.985 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(CO)(C(F)(F)F)CC3)cc2)CC1 ZINC000897037503 973183505 /nfs/dbraw/zinc/18/35/05/973183505.db2.gz OPGNVOFEBQWFOS-UHFFFAOYSA-N 2 0 371.447 2.575 20 10 FFCDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877495828 1014600345 /nfs/dbraw/zinc/60/03/45/1014600345.db2.gz HHCWKCVVMLCEGN-UHFFFAOYSA-N 2 0 357.542 2.956 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(=O)Nc3ccccc3)cc2)CC1 ZINC000905428419 980438660 /nfs/dbraw/zinc/43/86/60/980438660.db2.gz REPXNGROADJOKZ-UHFFFAOYSA-N 2 0 352.482 2.557 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1O ZINC001205996036 1032100581 /nfs/dbraw/zinc/10/05/81/1032100581.db2.gz UBZLOASGUMMLBV-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(N3CCOCC3)c(F)c1)CC2 ZINC000877684662 1014678370 /nfs/dbraw/zinc/67/83/70/1014678370.db2.gz SDVJJURHUMVMEU-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2)C1 ZINC000922240859 988234067 /nfs/dbraw/zinc/23/40/67/988234067.db2.gz SBESXTKSERYFON-NRFANRHFSA-N 2 0 352.478 2.868 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000846138955 1000217594 /nfs/dbraw/zinc/21/75/94/1000217594.db2.gz YNTFVNRHUCHOIX-GOSISDBHSA-N 2 0 369.509 2.869 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC(C[NH+]3CCCCCC3)CC1)[C@@H](O)CO2 ZINC000768439110 1000248931 /nfs/dbraw/zinc/24/89/31/1000248931.db2.gz HPTZRJQQEXLAPV-FQEVSTJZSA-N 2 0 360.498 2.906 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)Cc3ccc(F)cc3)cc2)CC1 ZINC000771823460 1001220482 /nfs/dbraw/zinc/22/04/82/1001220482.db2.gz CUCJEYLKKNKXCO-FQEVSTJZSA-N 2 0 371.500 2.518 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)c3ccc(F)cc3)cc2)CC1 ZINC000771863443 1001223175 /nfs/dbraw/zinc/22/31/75/1001223175.db2.gz GAZQXMKLMLPQSE-NRFANRHFSA-N 2 0 357.473 2.575 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H](O)C(F)(F)F)CC3)cc2)CC1 ZINC000775726461 1003839066 /nfs/dbraw/zinc/83/90/66/1003839066.db2.gz RSJUMYGGBXPHNM-SFHVURJKSA-N 2 0 371.447 2.574 20 10 FFCDRP CCOC(=O)CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775727442 1003851059 /nfs/dbraw/zinc/85/10/59/1003851059.db2.gz RNLYWQGMGOMQHA-UHFFFAOYSA-N 2 0 373.541 2.994 20 10 FFCDRP CCOC(=O)CC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775738528 1003927478 /nfs/dbraw/zinc/92/74/78/1003927478.db2.gz GUFKRTFQWWEXMI-LJQANCHMSA-N 2 0 373.541 2.994 20 10 FFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000817893797 1007800350 /nfs/dbraw/zinc/80/03/50/1007800350.db2.gz HYORPLQHUIMVNT-FDFHNCONSA-N 2 0 357.542 2.906 20 10 FFCDRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918324 1007810911 /nfs/dbraw/zinc/81/09/11/1007810911.db2.gz YRSHSKREEJTCKF-FCHUYYIVSA-N 3 0 356.558 2.968 20 10 FFCDRP C[C@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc2ccccc2c1O ZINC000925852515 1017872719 /nfs/dbraw/zinc/87/27/19/1017872719.db2.gz CENLXEUCJFSEJQ-HOCLYGCPSA-N 2 0 354.450 2.881 20 10 FFCDRP Oc1ccc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)c1 ZINC001141158709 1025540951 /nfs/dbraw/zinc/54/09/51/1025540951.db2.gz KPMFFEDDQJEKQJ-UHFFFAOYSA-N 2 0 353.466 2.981 20 10 FFCDRP c1nc(C2C[NH2+]C2)cc(N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]32)n1 ZINC001155645727 1028832100 /nfs/dbraw/zinc/83/21/00/1028832100.db2.gz LNXMMBHYWLIIPZ-VTAPXXACSA-N 2 0 365.525 2.563 20 10 FFCDRP COc1ccc(F)cc1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001203672862 1030816455 /nfs/dbraw/zinc/81/64/55/1030816455.db2.gz WNSAHQYIXPXEQF-UHFFFAOYSA-N 2 0 357.473 2.918 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CO)CCc3ccccc3)cc2)CC1 ZINC001203721515 1030845831 /nfs/dbraw/zinc/84/58/31/1030845831.db2.gz MJHSDTPOJGGABR-NRFANRHFSA-N 2 0 353.510 2.522 20 10 FFCDRP CC(C)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(CO)CC=CC1 ZINC000843433464 1031403393 /nfs/dbraw/zinc/40/33/93/1031403393.db2.gz ZPJJNNJOJGKWDB-OAQYLSRUSA-N 2 0 357.542 2.881 20 10 FFCDRP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001205725001 1031956803 /nfs/dbraw/zinc/95/68/03/1031956803.db2.gz BYCDHNHYOXWQQM-NRFANRHFSA-N 2 0 356.466 2.647 20 10 FFCDRP COc1cc(C[N@H+](C)CCc2noc(C(C)C)n2)cc(C[NH+](C)C)c1O ZINC001139256327 1035029606 /nfs/dbraw/zinc/02/96/06/1035029606.db2.gz YRSPRBXNNVIWQL-UHFFFAOYSA-N 2 0 362.474 2.643 20 10 FFCDRP CCc1noc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC001139411997 1035096771 /nfs/dbraw/zinc/09/67/71/1035096771.db2.gz ARZZTJKNQSQSAH-UHFFFAOYSA-N 2 0 369.513 2.763 20 10 FFCDRP C[NH+]1CCN(C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)c2ccccc2)CC1 ZINC000834562301 1035407992 /nfs/dbraw/zinc/40/79/92/1035407992.db2.gz IXKNOAAAQYWEEJ-WOJBJXKFSA-N 2 0 351.494 2.958 20 10 FFCDRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000834615172 1035418950 /nfs/dbraw/zinc/41/89/50/1035418950.db2.gz BHXLHFMKJSGFBL-QGZVFWFLSA-N 2 0 359.514 2.596 20 10 FFCDRP CCOC(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)[C@@H]1C ZINC001140303768 1035426175 /nfs/dbraw/zinc/42/61/75/1035426175.db2.gz AEWFGTDUVQKLJP-NQIIRXRSSA-N 2 0 373.541 2.992 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C(=O)OC)[C@@H]3C)cc2)CC1 ZINC001140304288 1035426401 /nfs/dbraw/zinc/42/64/01/1035426401.db2.gz LXQWSJNGFMMIEU-PXNSSMCTSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(n4ccnc4)CC3)cc2)CC1 ZINC001140306923 1035428360 /nfs/dbraw/zinc/42/83/60/1035428360.db2.gz ZNJIOQQDJAABSF-UHFFFAOYSA-N 2 0 353.514 2.862 20 10 FFCDRP C[NH+](C)CCN1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)CCC1=O ZINC001234997072 1037288880 /nfs/dbraw/zinc/28/88/80/1037288880.db2.gz QQEKEOWVMUKVDO-UHFFFAOYSA-N 2 0 367.493 2.655 20 10 FFCDRP COC(=O)[C@]12C[C@@H]3C[NH2+]C[C@@H]3[C@H]1C[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001235334288 1037486597 /nfs/dbraw/zinc/48/65/97/1037486597.db2.gz KRCFBTSFPGJJRA-WHEACTPUSA-N 2 0 372.509 2.520 20 10 FFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1ccc(OCc2ccccc2)cc1O ZINC001231469116 1037613333 /nfs/dbraw/zinc/61/33/33/1037613333.db2.gz OPODBLUOOFYKJY-UHFFFAOYSA-N 2 0 371.525 2.896 20 10 FFCDRP Cc1ccc(C[NH+]2CCN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235690406 1037687190 /nfs/dbraw/zinc/68/71/90/1037687190.db2.gz GEXJBZAITQUGFD-UHFFFAOYSA-N 2 0 364.537 2.722 20 10 FFCDRP C[C@@H](c1ccccc1)[NH+]1CCN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235864382 1037803701 /nfs/dbraw/zinc/80/37/01/1037803701.db2.gz QDQJQHSJMYGMIA-KRWDZBQOSA-N 2 0 367.493 2.753 20 10 FFCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@]23CCN(CC[NH+](C)C)C3=O)c(O)c1 ZINC001277975421 1037808107 /nfs/dbraw/zinc/80/81/07/1037808107.db2.gz FLUWXDXKSMYQPJ-OAQYLSRUSA-N 2 0 359.514 2.644 20 10 FFCDRP C[NH+](C)CCN1CC[NH+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001236792297 1038273883 /nfs/dbraw/zinc/27/38/83/1038273883.db2.gz LZBAAVUPMJMNCU-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP Cc1cc(Br)cc(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c1O ZINC001236931646 1038363346 /nfs/dbraw/zinc/36/33/46/1038363346.db2.gz HUOLHLHZWFORRM-MRXNPFEDSA-N 2 0 370.335 2.579 20 10 FFCDRP Cc1cc(O)c(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)cc1Br ZINC001236931496 1038363629 /nfs/dbraw/zinc/36/36/29/1038363629.db2.gz HUEJLSHBFUBGEG-OAHLLOKOSA-N 2 0 370.335 2.579 20 10 FFCDRP Cc1cc(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c(O)cc1Br ZINC001236932896 1038364770 /nfs/dbraw/zinc/36/47/70/1038364770.db2.gz OQRSFUANRKVTPS-OAHLLOKOSA-N 2 0 370.335 2.579 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH+](C4CCCC4)CC3)c(F)c2)CC1 ZINC001236941327 1038369997 /nfs/dbraw/zinc/36/99/97/1038369997.db2.gz ZAEITOBHLBKUKW-UHFFFAOYSA-N 2 0 360.521 2.638 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001249208636 1040629151 /nfs/dbraw/zinc/62/91/51/1040629151.db2.gz ZNFDMJOUIHSPRQ-OALUTQOASA-N 2 0 360.498 2.947 20 10 FFCDRP Oc1ccc(Cl)cc1C[NH+]1CCC2(C[NH+](CCn3ccnc3)C2)CC1 ZINC001278568661 1041204333 /nfs/dbraw/zinc/20/43/33/1041204333.db2.gz DQGVLWUKZNIASS-UHFFFAOYSA-N 2 0 360.889 2.840 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(OC)ccc3O)(C1)CCC2 ZINC001278571497 1041217344 /nfs/dbraw/zinc/21/73/44/1041217344.db2.gz SALSJJMNLWCMBY-UXHICEINSA-N 2 0 364.486 2.546 20 10 FFCDRP CCOC(=O)[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001255339253 1041275003 /nfs/dbraw/zinc/27/50/03/1041275003.db2.gz RSVKQXCXHZEDDW-OALUTQOASA-N 2 0 359.514 2.650 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCCN(CCN2CCOCC2)C1 ZINC001262031706 1041521056 /nfs/dbraw/zinc/52/10/56/1041521056.db2.gz ZKEIKTCSYVVJJU-QRVBRYPASA-N 2 0 373.541 2.635 20 10 FFCDRP COc1cc(C)c(C[NH2+][C@@]23CC[C@@](NCC[NH+](C)C)(C2)CCC3)c(O)c1 ZINC001279666542 1043431862 /nfs/dbraw/zinc/43/18/62/1043431862.db2.gz DFVXWKNRWCXQHV-RTWAWAEBSA-N 2 0 361.530 2.795 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001328087268 1048172599 /nfs/dbraw/zinc/17/25/99/1048172599.db2.gz WCEOSKYBSRBAFG-DOTOQJQBSA-N 2 0 359.514 2.829 20 10 FFCDRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2c(O)cccc2Br)CC1 ZINC001329723729 1048872640 /nfs/dbraw/zinc/87/26/40/1048872640.db2.gz XCDRSLSTXNAXRV-UHFFFAOYSA-N 2 0 370.335 2.660 20 10 FFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001462191194 1061531894 /nfs/dbraw/zinc/53/18/94/1061531894.db2.gz IASLJIKSPZPYQP-QGZVFWFLSA-N 2 0 368.516 2.879 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c(O)c1 ZINC001560925638 1076309984 /nfs/dbraw/zinc/30/99/84/1076309984.db2.gz PUKQTBPFMYROCF-SFHVURJKSA-N 2 0 356.466 2.566 20 10 FFCDRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001560985553 1076316652 /nfs/dbraw/zinc/31/66/52/1076316652.db2.gz FIBMVZFBBZWJQJ-SLYNCCJLSA-N 2 0 373.541 2.896 20 10 FFCDRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000093132719 508123033 /nfs/dbraw/zinc/12/30/33/508123033.db2.gz UYJIKRPLYGTOQN-QFIPXVFZSA-N 2 0 356.558 2.889 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000186520142 509750756 /nfs/dbraw/zinc/75/07/56/509750756.db2.gz JQGLKJOTEGXQKO-YJBOKZPZSA-N 2 0 356.466 2.818 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(O)c1 ZINC000185322316 510806461 /nfs/dbraw/zinc/80/64/61/510806461.db2.gz HTERIGOOQNLDTK-MRXNPFEDSA-N 2 0 355.482 2.843 20 10 FFCDRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1O ZINC000185367385 510823928 /nfs/dbraw/zinc/82/39/28/510823928.db2.gz BJIRLGIAMCSBBR-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Cc4nccs4)C3)cc2)CC1 ZINC000898071778 735309987 /nfs/dbraw/zinc/30/99/87/735309987.db2.gz SHRGUCREXMTSNK-GOSISDBHSA-N 2 0 356.539 2.960 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3c(O)cccc3Cl)cn2)CC1 ZINC000113323005 728554120 /nfs/dbraw/zinc/55/41/20/728554120.db2.gz ZWSUTEBMMGNJNH-UHFFFAOYSA-N 2 0 360.889 2.872 20 10 FFCDRP CC[C@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc(Cl)ccc1O ZINC000925857979 738538301 /nfs/dbraw/zinc/53/83/01/738538301.db2.gz RCVGMZMILWBBCD-HIFRSBDPSA-N 2 0 352.862 2.772 20 10 FFCDRP COCCC1([NH2+]Cc2cc(Br)cc(C)c2O)CC[NH2+]CC1 ZINC000873225231 731893047 /nfs/dbraw/zinc/89/30/47/731893047.db2.gz VKNDYOFVXQSQJI-UHFFFAOYSA-N 2 0 357.292 2.711 20 10 FFCDRP Cc1cc(Br)cc(C[NH+]2CCC3(CO[C@H](C[NH3+])C3)CC2)c1O ZINC000904392259 736248321 /nfs/dbraw/zinc/24/83/21/736248321.db2.gz OGXRQHDCBFKMRG-HNNXBMFYSA-N 2 0 369.303 2.793 20 10 FFCDRP COC[C@H](CCC[NH3+])[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903048 742221421 /nfs/dbraw/zinc/22/14/21/742221421.db2.gz GCHIRAASPYYLOV-HNNXBMFYSA-N 2 0 357.445 2.600 20 10 FFCDRP CC[C@@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000817972546 742225225 /nfs/dbraw/zinc/22/52/25/742225225.db2.gz MRVFJHJWENLJPF-SJORKVTESA-N 2 0 358.452 2.629 20 10 FFCDRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3cc(Br)ccc3O)CC2)C1 ZINC000841104137 747270088 /nfs/dbraw/zinc/27/00/88/747270088.db2.gz OIRDJZAWGGWMHF-NVXWUHKLSA-N 2 0 369.303 2.873 20 10 FFCDRP COC(=O)/C=C/c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000895607597 970783267 /nfs/dbraw/zinc/78/32/67/970783267.db2.gz QMNBMJQBQYBUHL-MDZDMXLPSA-N 2 0 369.465 2.507 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c(O)c1C ZINC000873244405 1013444256 /nfs/dbraw/zinc/44/42/56/1013444256.db2.gz RWLHXGZEULOVAH-HNNXBMFYSA-N 2 0 351.454 2.899 20 10 FFCDRP C[NH+]1CCC(C[NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 ZINC000892607495 969584879 /nfs/dbraw/zinc/58/48/79/969584879.db2.gz UDDKJUZXISPQRJ-UHFFFAOYSA-N 2 0 371.447 2.973 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cn(C)nc3C3CC3)cc2F)CC1 ZINC000892904876 970362111 /nfs/dbraw/zinc/36/21/11/970362111.db2.gz FUUAVCTXDBZUQZ-UHFFFAOYSA-N 2 0 371.504 2.868 20 10 FFCDRP CCn1nccc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000125500018 1014053344 /nfs/dbraw/zinc/05/33/44/1014053344.db2.gz ZTVYDHDKLYMKHY-UHFFFAOYSA-N 2 0 353.514 2.725 20 10 FFCDRP CN(C)c1ccc([C@H](CNC2CC[NH+](C[C@H]3CCCO3)CC2)[NH+](C)C)cc1 ZINC000898448144 976460445 /nfs/dbraw/zinc/46/04/45/976460445.db2.gz PYAFZLHTRZLDTB-YADHBBJMSA-N 2 0 374.573 2.588 20 10 FFCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781455 1014391363 /nfs/dbraw/zinc/39/13/63/1014391363.db2.gz LTYUPTDJRWPICM-HXUWFJFHSA-N 2 0 357.542 2.811 20 10 FFCDRP Cc1cc(C[NH3+])cc(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000904520338 980291744 /nfs/dbraw/zinc/29/17/44/980291744.db2.gz QMRGOWXIPNIINV-FQEVSTJZSA-N 2 0 369.513 2.944 20 10 FFCDRP CCOc1cccc(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1O ZINC000922394146 988555957 /nfs/dbraw/zinc/55/59/57/988555957.db2.gz VNDSXXHFBSHVFO-JYWFKMLOSA-N 2 0 362.514 2.750 20 10 FFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)CC1 ZINC000809755205 994604110 /nfs/dbraw/zinc/60/41/10/994604110.db2.gz ICKUMBBQWLNZDD-NRFANRHFSA-N 3 0 356.558 2.602 20 10 FFCDRP COc1ccc(N2CC[NH+](CCNc3cc[nH+]c4ccccc34)CC2)cc1 ZINC000731996850 998405053 /nfs/dbraw/zinc/40/50/53/998405053.db2.gz GWAUHYNRLICROI-UHFFFAOYSA-N 2 0 362.477 2.899 20 10 FFCDRP CC(C)[N@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC000903884136 1016287672 /nfs/dbraw/zinc/28/76/72/1016287672.db2.gz SMWUZPCIXPRRNY-LJQANCHMSA-N 2 0 356.518 2.679 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](O)c1cccc(F)c1 ZINC000771842021 1001211704 /nfs/dbraw/zinc/21/17/04/1001211704.db2.gz HNVAFIWTGQUEAL-IIBYNOLFSA-N 2 0 357.473 2.789 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CC(C)(C)N2CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000792906465 1003225379 /nfs/dbraw/zinc/22/53/79/1003225379.db2.gz CIQQTLARGQHSOC-UHFFFAOYSA-N 2 0 372.479 2.887 20 10 FFCDRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccccc1O ZINC000775499677 1004045591 /nfs/dbraw/zinc/04/55/91/1004045591.db2.gz TWSFPAJGHPFLFM-IBGZPJMESA-N 2 0 369.513 2.825 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](c2ccccc2)C1 ZINC000775633243 1004883838 /nfs/dbraw/zinc/88/38/38/1004883838.db2.gz GJQTZOPOJYOGMJ-HSZRJFAPSA-N 2 0 364.537 2.927 20 10 FFCDRP Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC001199344047 1004905597 /nfs/dbraw/zinc/90/55/97/1004905597.db2.gz CLBOWEIRUSUJCZ-UHFFFAOYSA-N 2 0 363.509 2.923 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCN(CC(F)(F)F)CC3)cc2)CC1 ZINC000775649291 1004936788 /nfs/dbraw/zinc/93/67/88/1004936788.db2.gz NFTCNLWUMQLNJJ-UHFFFAOYSA-N 2 0 370.463 2.508 20 10 FFCDRP Cn1cc(C[C@H]2CCC[C@@H]2[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000850384897 1005812329 /nfs/dbraw/zinc/81/23/29/1005812329.db2.gz SRQZLUYODRJSHU-IRLDBZIGSA-N 2 0 367.541 2.673 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552188 1007881253 /nfs/dbraw/zinc/88/12/53/1007881253.db2.gz IWFBJEKQFIWTDG-HXUWFJFHSA-N 2 0 371.481 2.901 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc(Cl)c(C)cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136104 1032779553 /nfs/dbraw/zinc/77/95/53/1032779553.db2.gz NJABFDMFEYPTJP-KXBFYZLASA-N 2 0 366.889 2.719 20 10 FFCDRP C[C@@H](CNC(=O)C[NH2+][C@@H](C)c1ccccc1O)[NH2+][C@@H](C)c1ccccc1O ZINC000931555586 1020513237 /nfs/dbraw/zinc/51/32/37/1020513237.db2.gz YVEMKJQVEXVAIO-JYJNAYRXSA-N 2 0 371.481 2.604 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccccc4OC3)cc2)CC1 ZINC000800889581 1020629087 /nfs/dbraw/zinc/62/90/87/1020629087.db2.gz QURJYXPBMJURTQ-HXUWFJFHSA-N 2 0 351.494 2.922 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCCC[NH2+]4)C3)cc2)CC1 ZINC001222390502 1032934751 /nfs/dbraw/zinc/93/47/51/1032934751.db2.gz PXYPZQFTJHWODG-QFIPXVFZSA-N 2 0 356.558 2.937 20 10 FFCDRP CC(C)(C)[NH2+]CC(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001116407591 1021201330 /nfs/dbraw/zinc/20/13/30/1021201330.db2.gz PKZXBWBCNJEEBQ-HNNXBMFYSA-N 2 0 353.894 2.514 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000756511666 1023721184 /nfs/dbraw/zinc/72/11/84/1023721184.db2.gz ZIOATHXUIWWVNA-GOSISDBHSA-N 2 0 354.498 2.959 20 10 FFCDRP CC[C@H]([NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000840833066 1029889492 /nfs/dbraw/zinc/88/94/92/1029889492.db2.gz KNAPZYQAQLQEDX-NRFANRHFSA-N 2 0 374.573 2.590 20 10 FFCDRP FC(F)(F)[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CC[NH2+]CC1 ZINC000841070820 1030015781 /nfs/dbraw/zinc/01/57/81/1030015781.db2.gz UHKVIIDBLPRUMD-GOSISDBHSA-N 2 0 370.463 2.603 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)cc2)CC1 ZINC001204735422 1031421436 /nfs/dbraw/zinc/42/14/36/1031421436.db2.gz UKEUSYUNLIGZCR-UHFFFAOYSA-N 3 0 356.558 2.794 20 10 FFCDRP [NH3+]C[C@]1(O)CCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001205247358 1031624626 /nfs/dbraw/zinc/62/46/26/1031624626.db2.gz FQHOGIGKXHWQJY-NRFANRHFSA-N 2 0 356.466 2.647 20 10 FFCDRP [NH3+]C[C@@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC1(F)F ZINC001205769782 1031983922 /nfs/dbraw/zinc/98/39/22/1031983922.db2.gz KOFZAPUQRVKJHF-OAHLLOKOSA-N 2 0 351.441 2.507 20 10 FFCDRP COC(=O)c1cccc(C[N@H+](C)Cc2cc(C[NH+](C)C)c(O)c(OC)c2)c1 ZINC001139259341 1035031030 /nfs/dbraw/zinc/03/10/30/1035031030.db2.gz RVIZKVNNCXYPBB-UHFFFAOYSA-N 2 0 372.465 2.881 20 10 FFCDRP COc1cc(C[N@H+](C)C[C@@H]2Cc3ccccc3O2)cc(C[NH+](C)C)c1O ZINC001139259460 1035031099 /nfs/dbraw/zinc/03/10/99/1035031099.db2.gz BUODTFOVSAVUDC-SFHVURJKSA-N 2 0 356.466 2.898 20 10 FFCDRP COc1cc(CN2CC[N@H+](C)[C@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257660 1035031939 /nfs/dbraw/zinc/03/19/39/1035031939.db2.gz ZWVBASAIUOHLQJ-FQEVSTJZSA-N 2 0 369.509 2.951 20 10 FFCDRP Cc1cccnc1O[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411377 1035095541 /nfs/dbraw/zinc/09/55/41/1035095541.db2.gz ITQJDZNIUIUTHE-NRFANRHFSA-N 2 0 366.509 2.795 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000835035008 1035490980 /nfs/dbraw/zinc/49/09/80/1035490980.db2.gz GCDQJBGQSNEOJP-SNAWJCMRSA-N 2 0 365.525 2.702 20 10 FFCDRP C[N@@H+](Cc1ccc(N2CCOCC2)c(Cl)c1)CC1CC[NH+](C)CC1 ZINC001232203070 1035498384 /nfs/dbraw/zinc/49/83/84/1035498384.db2.gz NMCXAQQWIXWEAO-UHFFFAOYSA-N 2 0 351.922 2.950 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCN[C@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789852 1037745658 /nfs/dbraw/zinc/74/56/58/1037745658.db2.gz KXHKDKLOHCTODS-SFHVURJKSA-N 2 0 373.884 2.674 20 10 FFCDRP CC[N@H+](CCc1ccc(OC)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236302664 1038032946 /nfs/dbraw/zinc/03/29/46/1038032946.db2.gz AJNJWSOZWNIWCN-UHFFFAOYSA-N 2 0 369.509 2.875 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCN(C4CCCC4)C3)cc2)CC1 ZINC001256898911 1038650197 /nfs/dbraw/zinc/65/01/97/1038650197.db2.gz AOHYUWKDWLSSBB-FQEVSTJZSA-N 2 0 356.558 2.935 20 10 FFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CN1Cc1ccccc1 ZINC001246173812 1039266152 /nfs/dbraw/zinc/26/61/52/1039266152.db2.gz MRIBFKKYYFTDTO-UGKGYDQZSA-N 2 0 364.537 2.849 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CN1Cc1ccccc1 ZINC001246173807 1039266818 /nfs/dbraw/zinc/26/68/18/1039266818.db2.gz MRIBFKKYYFTDTO-KNQAVFIVSA-N 2 0 364.537 2.849 20 10 FFCDRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700987 1039441848 /nfs/dbraw/zinc/44/18/48/1039441848.db2.gz HYRWZTYYOYSABC-GHTZIAJQSA-N 2 0 361.530 2.612 20 10 FFCDRP Cc1cccc(C[N@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c1O ZINC001279290215 1042985426 /nfs/dbraw/zinc/98/54/26/1042985426.db2.gz JBCLFSVKUNWODJ-KDURUIRLSA-N 2 0 354.498 2.741 20 10 FFCDRP COc1cc(C[NH+]2CCC3(C[NH+](Cc4ccc[nH]4)C3)CC2)c(O)cc1O ZINC001279299037 1042989308 /nfs/dbraw/zinc/98/93/08/1042989308.db2.gz HCHSGQSJIRRCFM-UHFFFAOYSA-N 2 0 357.454 2.533 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC001320425415 1045406437 /nfs/dbraw/zinc/40/64/37/1045406437.db2.gz YCZXFRUDEKYWDI-ZACQAIPSSA-N 2 0 361.530 2.931 20 10 FFCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](n2cncn2)C1 ZINC001333594636 1048995840 /nfs/dbraw/zinc/99/58/40/1048995840.db2.gz CFPQQBIDTDLPPJ-JRGCBEDISA-N 2 0 368.529 2.549 20 10 FFCDRP C[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[C@H]([NH3+])c1ccccc1 ZINC001343048098 1051664901 /nfs/dbraw/zinc/66/49/01/1051664901.db2.gz SSEITVYFIFBHHD-NDXORKPFSA-N 2 0 368.525 2.808 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001474298087 1065488318 /nfs/dbraw/zinc/48/83/18/1065488318.db2.gz NRPLVLDHBBNPCF-IYARVYRRSA-N 2 0 374.529 2.584 20 10 FFCDRP C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560330041 1076264668 /nfs/dbraw/zinc/26/46/68/1076264668.db2.gz BJQIWQHDCXTWJO-GCJKJVERSA-N 2 0 353.510 2.693 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000187182108 510107707 /nfs/dbraw/zinc/10/77/07/510107707.db2.gz AOCVTVKNZBRKED-KGLIPLIRSA-N 2 0 370.335 2.750 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000185322172 510806355 /nfs/dbraw/zinc/80/63/55/510806355.db2.gz LYMHMQUCHKORMI-OAHLLOKOSA-N 2 0 371.481 2.543 20 10 FFCDRP Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)CC2 ZINC000297524012 510978233 /nfs/dbraw/zinc/97/82/33/510978233.db2.gz DDWQTMLPKCTQHA-LJQANCHMSA-N 2 0 368.477 2.880 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000883283696 733359809 /nfs/dbraw/zinc/35/98/09/733359809.db2.gz PCSNAKKGLFQCSL-DOTOQJQBSA-N 2 0 357.420 2.638 20 10 FFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)cc1 ZINC000817973546 742225458 /nfs/dbraw/zinc/22/54/58/742225458.db2.gz VAXFSFLALWEOMW-PBHICJAKSA-N 2 0 358.452 2.629 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2Cc1ccc(Br)cc1O ZINC000824938764 743182295 /nfs/dbraw/zinc/18/22/95/743182295.db2.gz LUULCDPFYKWNSI-HLLBOEOZSA-N 2 0 369.303 2.838 20 10 FFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1ccc(Br)cc1O ZINC000825903920 743341628 /nfs/dbraw/zinc/34/16/28/743341628.db2.gz WKUWXUUIJCTMST-UHFFFAOYSA-N 2 0 372.351 2.860 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c(Cl)c1 ZINC000840873844 747208708 /nfs/dbraw/zinc/20/87/08/747208708.db2.gz DEWGYPRJGPFDGJ-UHFFFAOYSA-N 2 0 360.889 2.791 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)c1O ZINC000841103855 747270249 /nfs/dbraw/zinc/27/02/49/747270249.db2.gz KYQPVKZJJQHZBX-JKSUJKDBSA-N 2 0 354.878 2.773 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)c1O ZINC000841103852 747270304 /nfs/dbraw/zinc/27/03/04/747270304.db2.gz KYQPVKZJJQHZBX-CVEARBPZSA-N 2 0 354.878 2.773 20 10 FFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(Br)cc(OC)c2O)CC1 ZINC000843055054 747757519 /nfs/dbraw/zinc/75/75/19/747757519.db2.gz FDEPMSOFMZLYTP-UHFFFAOYSA-N 2 0 357.292 2.985 20 10 FFCDRP COc1ccc(N2CCC(Nc3cc(N4CC[NH2+]CC4)cc[nH+]3)CC2)cc1 ZINC000873246646 1013446087 /nfs/dbraw/zinc/44/60/87/1013446087.db2.gz YJFCKVBJIHPROO-UHFFFAOYSA-N 2 0 367.497 2.581 20 10 FFCDRP Cc1cc(CNC(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc(C)n1 ZINC000895410839 970593758 /nfs/dbraw/zinc/59/37/58/970593758.db2.gz JSGSKDIWEPXOJR-HXUWFJFHSA-N 2 0 369.513 2.867 20 10 FFCDRP Cc1n[nH]c(C)c1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000125500317 1014053085 /nfs/dbraw/zinc/05/30/85/1014053085.db2.gz OKQQESVHLHNGCG-UHFFFAOYSA-N 2 0 353.514 2.848 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(C[S@](C)=O)cc3)cc2)CC1 ZINC000796526414 1014178923 /nfs/dbraw/zinc/17/89/23/1014178923.db2.gz MUTYBKBEHRTGIQ-SANMLTNESA-N 2 0 371.550 2.607 20 10 FFCDRP Cc1cccc(O)c1C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000877028189 1014454371 /nfs/dbraw/zinc/45/43/71/1014454371.db2.gz VRSDFDXLNATYLN-IBGZPJMESA-N 2 0 367.493 2.688 20 10 FFCDRP Cc1noc(C[C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000897579001 982310542 /nfs/dbraw/zinc/31/05/42/982310542.db2.gz LQWVCWBTJLXYFB-LJQANCHMSA-N 2 0 369.513 2.585 20 10 FFCDRP Cc1ccc([C@H](O)[C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796480305 1015304098 /nfs/dbraw/zinc/30/40/98/1015304098.db2.gz CQECVHOHRNZBSB-PGRDOPGGSA-N 2 0 353.510 2.959 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388490 988535158 /nfs/dbraw/zinc/53/51/58/988535158.db2.gz FGMYHSSWSVYOKW-LMCOJAPRSA-N 2 0 367.484 2.600 20 10 FFCDRP CC[N@H+](C)CCC(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1 ZINC001106839670 989556510 /nfs/dbraw/zinc/55/65/10/989556510.db2.gz NHAFODJXXGBRCP-IEBWSBKVSA-N 2 0 361.530 2.530 20 10 FFCDRP CN(C)c1ccc(C[N@H+](C)CCCN2CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000809742970 994601324 /nfs/dbraw/zinc/60/13/24/994601324.db2.gz OXMKBQUKBWONDI-UHFFFAOYSA-N 2 0 372.479 2.841 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](c3ccco3)N3CCCC3)cc2)CC1 ZINC000771822721 1001220669 /nfs/dbraw/zinc/22/06/69/1001220669.db2.gz HWMSOLTYGMXEHO-NRFANRHFSA-N 2 0 368.525 2.958 20 10 FFCDRP C[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000775833495 1004546053 /nfs/dbraw/zinc/54/60/53/1004546053.db2.gz JZUXNHTUYWMBGU-UWJYYQICSA-N 2 0 368.525 2.822 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]Cc3cccc(C[NH+](C)C)c3)cc2F)CC1 ZINC001199219426 1004873210 /nfs/dbraw/zinc/87/32/10/1004873210.db2.gz NAKAZKGJPTWAHI-UHFFFAOYSA-N 2 0 370.516 2.929 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3COC4(CCCCC4)O3)cc2)CC1 ZINC001201685872 1005258512 /nfs/dbraw/zinc/25/85/12/1005258512.db2.gz WGKZCJLYQAVMJP-HXUWFJFHSA-N 2 0 359.514 2.604 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850508381 1005819320 /nfs/dbraw/zinc/81/93/20/1005819320.db2.gz MDKVNYWUFAYXMF-MAUKXSAKSA-N 2 0 356.466 2.818 20 10 FFCDRP Cc1cc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)ccc1N(C)C ZINC000815076032 1006508352 /nfs/dbraw/zinc/50/83/52/1006508352.db2.gz VCDWBOZSKAWHCS-WCRBZPEASA-N 2 0 356.558 2.804 20 10 FFCDRP CCCn1nc(C)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC000883283813 1006730420 /nfs/dbraw/zinc/73/04/20/1006730420.db2.gz UONFXDYKWXTULO-UHFFFAOYSA-N 2 0 355.530 2.952 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3cccnc3)C(C)(C)CO)cc2)CC1 ZINC000816637377 1007142480 /nfs/dbraw/zinc/14/24/80/1007142480.db2.gz AVNJOKGQIHARTC-NRFANRHFSA-N 2 0 368.525 2.683 20 10 FFCDRP CCOC(=O)C[C@@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000775376199 1007593193 /nfs/dbraw/zinc/59/31/93/1007593193.db2.gz XTMMHRMYFNDPST-OAQYLSRUSA-N 2 0 361.530 2.896 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000902519227 1020250845 /nfs/dbraw/zinc/25/08/45/1020250845.db2.gz YCOWUSIDGJQZJM-BTYIYWSLSA-N 2 0 355.530 2.868 20 10 FFCDRP C[C@@H]([NH2+]CC(=O)NC[C@H](C)[NH2+][C@H](C)c1ccccc1O)c1ccccc1O ZINC000931555584 1020512576 /nfs/dbraw/zinc/51/25/76/1020512576.db2.gz YVEMKJQVEXVAIO-ARFHVFGLSA-N 2 0 371.481 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCCC[NH2+]4)C3)cc2)CC1 ZINC001222390499 1032933466 /nfs/dbraw/zinc/93/34/66/1032933466.db2.gz PXYPZQFTJHWODG-JOCHJYFZSA-N 2 0 356.558 2.937 20 10 FFCDRP CC(C)n1cc(C(C)(C)NCc2ccc(N3CCN(C)CC3)c(F)c2)nn1 ZINC001118055155 1022044139 /nfs/dbraw/zinc/04/41/39/1022044139.db2.gz HJALJYDIMOEXMA-UHFFFAOYSA-N 2 0 374.508 2.775 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1O ZINC001119446514 1022772314 /nfs/dbraw/zinc/77/23/14/1022772314.db2.gz ZLRVKXYWHBGFLD-IBGZPJMESA-N 2 0 356.466 2.566 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)c(O)c1 ZINC000756854920 1023760084 /nfs/dbraw/zinc/76/00/84/1023760084.db2.gz BQQMSXSIFTXSTM-XLIONFOSSA-N 2 0 369.509 2.640 20 10 FFCDRP COC(=O)[C@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779431774 1023843015 /nfs/dbraw/zinc/84/30/15/1023843015.db2.gz DQYYZINGBRURDW-TZIWHRDSSA-N 2 0 359.514 2.650 20 10 FFCDRP [NH3+]Cc1cn([C@@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)nn1 ZINC000841100082 1030038215 /nfs/dbraw/zinc/03/82/15/1030038215.db2.gz SYGGHHFETCLHKE-HXUWFJFHSA-N 2 0 354.502 2.564 20 10 FFCDRP CCOc1ccc(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c(O)c1 ZINC000841103766 1030039767 /nfs/dbraw/zinc/03/97/67/1030039767.db2.gz JLBIJLSQIRWGOI-UHFFFAOYSA-N 2 0 369.509 2.874 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC(=O)O4)CC3)cc2)CC1 ZINC001140304458 1035426029 /nfs/dbraw/zinc/42/60/29/1035426029.db2.gz QMXGVGNSFIBQLE-UHFFFAOYSA-N 2 0 357.498 2.500 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1ccc(O)c(C)c1O ZINC001140748508 1036048274 /nfs/dbraw/zinc/04/82/74/1036048274.db2.gz HPNQNBWPTIFOCD-UHFFFAOYSA-N 2 0 351.535 2.892 20 10 FFCDRP [NH3+]C1CN([C@@H]2CCC[N@H+](Cc3cc(OCc4ccccc4)ccc3O)C2)C1 ZINC001236079939 1037924646 /nfs/dbraw/zinc/92/46/46/1037924646.db2.gz ULTIGUUDVBIRAJ-HXUWFJFHSA-N 2 0 367.493 2.579 20 10 FFCDRP COc1ccc(N2CC[NH+](C3CCN(c4cc[nH+]cc4)CC3)CC2)cc1 ZINC001256855618 1038635756 /nfs/dbraw/zinc/63/57/56/1038635756.db2.gz RILCWAOVDYFUHK-UHFFFAOYSA-N 2 0 352.482 2.881 20 10 FFCDRP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001246175049 1039266609 /nfs/dbraw/zinc/26/66/09/1039266609.db2.gz RVPJUULFMYMCAC-IFMALSPDSA-N 2 0 350.510 2.679 20 10 FFCDRP CN(C)CC[N@H+]1CC[C@H]2C[NH+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490681 1039865116 /nfs/dbraw/zinc/86/51/16/1039865116.db2.gz JRJRGPVXIRLBQU-IYBDPMFKSA-N 2 0 351.922 2.751 20 10 FFCDRP CN(C)CC[N@H+]1CC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568628 1041202961 /nfs/dbraw/zinc/20/29/61/1041202961.db2.gz CHMLMZINFJXERM-IYBDPMFKSA-N 2 0 351.922 2.751 20 10 FFCDRP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@H+](Cc1cc(Cl)ccc1O)C2 ZINC001278568972 1041207453 /nfs/dbraw/zinc/20/74/53/1041207453.db2.gz LVGJWCCHZLTJDE-IBGZPJMESA-N 2 0 351.922 2.895 20 10 FFCDRP CN(C)C(=O)C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(Cl)ccc3O)(C1)CCC2 ZINC001278569209 1041209417 /nfs/dbraw/zinc/20/94/17/1041209417.db2.gz RMEQDWYKLMMZQL-MOPGFXCFSA-N 2 0 365.905 2.658 20 10 FFCDRP CCOC(=O)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001255339254 1041276288 /nfs/dbraw/zinc/27/62/88/1041276288.db2.gz RSVKQXCXHZEDDW-RBUKOAKNSA-N 2 0 359.514 2.650 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[N@H+](Cc4cn[nH]c4)C3)CC2)cc1 ZINC001279149386 1042920392 /nfs/dbraw/zinc/92/03/92/1042920392.db2.gz GIMDUYFYAMCGHL-UHFFFAOYSA-N 2 0 353.514 2.964 20 10 FFCDRP COc1cc(C[NH+]2CCC3(C[NH+](Cc4ccc[nH]4)C3)CC2)cc(O)c1O ZINC001279234561 1042958630 /nfs/dbraw/zinc/95/86/30/1042958630.db2.gz URJHINRIUSZSQE-UHFFFAOYSA-N 2 0 357.454 2.533 20 10 FFCDRP Cc1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338725 1043011286 /nfs/dbraw/zinc/01/12/86/1043011286.db2.gz PKKYVSAYOJSWMS-NRFANRHFSA-N 2 0 354.498 2.885 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC[N@H+](C)C4)CC3)cc2)CC1 ZINC001279709758 1043509793 /nfs/dbraw/zinc/50/97/93/1043509793.db2.gz JFCCCDVOGVPORH-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CCC[NH+](C)C4)C3)cc2)CC1 ZINC001279709565 1043510196 /nfs/dbraw/zinc/51/01/96/1043510196.db2.gz HKAGTLVZQSYIJM-JOCHJYFZSA-N 3 0 356.558 2.746 20 10 FFCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC001324398631 1046004639 /nfs/dbraw/zinc/00/46/39/1046004639.db2.gz VPTQWTZIXUJREI-JOCHJYFZSA-N 2 0 356.558 2.887 20 10 FFCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](n2cncn2)C1 ZINC001333594638 1048996023 /nfs/dbraw/zinc/99/60/23/1048996023.db2.gz CFPQQBIDTDLPPJ-UIFIKXQLSA-N 2 0 368.529 2.549 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CO)CCc3ccccc3)cc2)CC1 ZINC001461777298 1061405347 /nfs/dbraw/zinc/40/53/47/1061405347.db2.gz MJHSDTPOJGGABR-OAQYLSRUSA-N 2 0 353.510 2.522 20 10 FFCDRP C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560330042 1076264396 /nfs/dbraw/zinc/26/43/96/1076264396.db2.gz BJQIWQHDCXTWJO-PGRDOPGGSA-N 2 0 353.510 2.693 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(N(C)C)cc1 ZINC000130465484 508820909 /nfs/dbraw/zinc/82/09/09/508820909.db2.gz SZSNPVGPZUQCGJ-KRWDZBQOSA-N 2 0 353.514 2.750 20 10 FFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000186590799 509788880 /nfs/dbraw/zinc/78/88/80/509788880.db2.gz GHHHDOIYZUUVPR-KGLIPLIRSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1C ZINC000174411643 510102241 /nfs/dbraw/zinc/10/22/41/510102241.db2.gz BVICGJYNKVGBLU-UHFFFAOYSA-N 2 0 355.482 2.590 20 10 FFCDRP COc1cc(Cl)cc(C[N@H+](C)CCN(C)C2CC[NH+](C)CC2)c1O ZINC000289404877 511100514 /nfs/dbraw/zinc/10/05/14/511100514.db2.gz HAHUDQOBCCTCQC-UHFFFAOYSA-N 2 0 355.910 2.512 20 10 FFCDRP Oc1ccc(Br)cc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530249631 517656500 /nfs/dbraw/zinc/65/65/00/517656500.db2.gz WTZSKHHAPCWBSF-MRXNPFEDSA-N 2 0 369.303 2.745 20 10 FFCDRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Br)ccc1O ZINC000756408297 736328452 /nfs/dbraw/zinc/32/84/52/736328452.db2.gz MDVYVCQUKAKZBK-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP Oc1cccc(Cl)c1C[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000776136580 738164828 /nfs/dbraw/zinc/16/48/28/738164828.db2.gz KLISJDGWWWCOSM-UHFFFAOYSA-N 2 0 360.889 2.743 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1Cl ZINC000825173834 743222828 /nfs/dbraw/zinc/22/28/28/743222828.db2.gz UDICDWWZZYVDRO-UHFFFAOYSA-N 2 0 360.889 2.791 20 10 FFCDRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3cc(Br)ccc3O)CC2)C1 ZINC000841104142 747270170 /nfs/dbraw/zinc/27/01/70/747270170.db2.gz OIRDJZAWGGWMHF-RDJZCZTQSA-N 2 0 369.303 2.873 20 10 FFCDRP CCOC(=O)c1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[nH]c1C ZINC000895607022 970783000 /nfs/dbraw/zinc/78/30/00/970783000.db2.gz JRYPWQUOMAMHPY-UHFFFAOYSA-N 2 0 370.497 2.541 20 10 FFCDRP CC(C)[NH+]1CCC(C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC000891250706 962598014 /nfs/dbraw/zinc/59/80/14/962598014.db2.gz ZCPQGHWHCRPFMO-HXUWFJFHSA-N 2 0 360.546 2.592 20 10 FFCDRP Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c(O)c1 ZINC000873242405 1013442249 /nfs/dbraw/zinc/44/22/49/1013442249.db2.gz BGUNUEMKOZJDIY-HNNXBMFYSA-N 2 0 351.454 2.899 20 10 FFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877528779 1014613796 /nfs/dbraw/zinc/61/37/96/1014613796.db2.gz KEHLWHOTNXHAIW-HXUWFJFHSA-N 2 0 357.542 2.811 20 10 FFCDRP [NH3+]CC[C@H]1CN(c2cccc3c2NC(=O)C32CC[NH2+]CC2)c2ccccc21 ZINC001168548434 985231253 /nfs/dbraw/zinc/23/12/53/985231253.db2.gz NRRRTWPFLWYTCT-HNNXBMFYSA-N 2 0 362.477 2.844 20 10 FFCDRP C[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1O ZINC000879651216 1015625242 /nfs/dbraw/zinc/62/52/42/1015625242.db2.gz NEKLJAPOLUFSCI-KRWDZBQOSA-N 2 0 367.493 2.955 20 10 FFCDRP C[NH+](C)CCN(Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809746014 994602670 /nfs/dbraw/zinc/60/26/70/994602670.db2.gz JQGSANUXUYMPKZ-UHFFFAOYSA-N 2 0 356.514 2.595 20 10 FFCDRP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738170222 999622611 /nfs/dbraw/zinc/62/26/11/999622611.db2.gz OCWKWMUYKCTVOT-GOSISDBHSA-N 2 0 354.498 2.542 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000846144564 1000218520 /nfs/dbraw/zinc/21/85/20/1000218520.db2.gz LFUIFQMOXYZWAO-KKSFZXQISA-N 2 0 356.466 2.688 20 10 FFCDRP C[NH+](C)CCCCC(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000768913740 1000384683 /nfs/dbraw/zinc/38/46/83/1000384683.db2.gz RQPXTMFZOLWDPT-UHFFFAOYSA-N 2 0 372.557 2.567 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(c4ccc5c(c4)OCO5)CC3)cc2)CC1 ZINC000771846993 1001213665 /nfs/dbraw/zinc/21/36/65/1001213665.db2.gz OQXFPNOWVXYSKU-UHFFFAOYSA-N 2 0 365.477 2.946 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnc(N4CCCC4)c3)cc2)CC1 ZINC000771821923 1001219460 /nfs/dbraw/zinc/21/94/60/1001219460.db2.gz AODSSHFQJMGGKI-UHFFFAOYSA-N 2 0 365.525 2.723 20 10 FFCDRP COc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)n1 ZINC000790982645 1002543212 /nfs/dbraw/zinc/54/32/12/1002543212.db2.gz WHDPRAXQWHLPHE-UHFFFAOYSA-N 2 0 366.509 2.912 20 10 FFCDRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850031161 1005779995 /nfs/dbraw/zinc/77/99/95/1005779995.db2.gz QYAHTAACIJFYMH-MRXNPFEDSA-N 2 0 363.546 2.814 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1OC ZINC000883284723 1006732968 /nfs/dbraw/zinc/73/29/68/1006732968.db2.gz VFNBUOFRDJKPEE-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP OC1(C[NH2+]Cc2ccc3c(c2)CCO3)CC[NH+](Cc2ccccc2)CC1 ZINC000397501217 1020290913 /nfs/dbraw/zinc/29/09/13/1020290913.db2.gz YLWTZGVBVRJYTD-UHFFFAOYSA-N 2 0 352.478 2.738 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC001120072574 1023230238 /nfs/dbraw/zinc/23/02/38/1023230238.db2.gz XHBKQSKFQLHNEF-CEXWTWQISA-N 2 0 361.505 2.824 20 10 FFCDRP C[C@H](C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000839193862 1026618015 /nfs/dbraw/zinc/61/80/15/1026618015.db2.gz XAXFKBGZSJACGH-QGZVFWFLSA-N 2 0 361.530 2.848 20 10 FFCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2[C@H](C[C@@H](Cn3cccn3)[NH+]2CC2CC2)C1 ZINC001203552681 1030763891 /nfs/dbraw/zinc/76/38/91/1030763891.db2.gz QEKBHKTXAGZKGM-HKBOAZHASA-N 2 0 366.509 2.964 20 10 FFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(OC)cc1O)C2 ZINC001203623530 1030790573 /nfs/dbraw/zinc/79/05/73/1030790573.db2.gz SZSHCKBGVUQCRG-RXVVDRJESA-N 2 0 360.498 2.581 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c1O ZINC001204337077 1031234526 /nfs/dbraw/zinc/23/45/26/1031234526.db2.gz BBZGRDKHAQCCJR-YPMHNXCESA-N 2 0 355.276 2.547 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1C[C@@H]3CNc4ccccc4[C@H]3C1)C[NH2+]CCO2 ZINC001224263684 1033810213 /nfs/dbraw/zinc/81/02/13/1033810213.db2.gz XIITUJZHOCELSU-WMZOPIPTSA-N 2 0 351.450 2.515 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139408631 1035093029 /nfs/dbraw/zinc/09/30/29/1035093029.db2.gz NYYKMSHYQHAVOL-QFIPXVFZSA-N 2 0 373.541 2.994 20 10 FFCDRP Cc1cccnc1O[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411378 1035094741 /nfs/dbraw/zinc/09/47/41/1035094741.db2.gz ITQJDZNIUIUTHE-OAQYLSRUSA-N 2 0 366.509 2.795 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC(C)([NH+]4CCCC4)CC3)cc2)CC1 ZINC001139410842 1035095575 /nfs/dbraw/zinc/09/55/75/1035095575.db2.gz IEZGKVPYYMFUMJ-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1cccc2c1OCO2 ZINC001139411386 1035095905 /nfs/dbraw/zinc/09/59/05/1035095905.db2.gz JHFHSSIFOFRWMU-UHFFFAOYSA-N 2 0 353.466 2.799 20 10 FFCDRP Cc1ccnn1C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139410766 1035096029 /nfs/dbraw/zinc/09/60/29/1035096029.db2.gz CTUPSDSTKLMKCK-UHFFFAOYSA-N 2 0 353.514 2.780 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4COC[C@H](C3)C4(F)F)cc2)CC1 ZINC001140306019 1035427572 /nfs/dbraw/zinc/42/75/72/1035427572.db2.gz KSLVDBLIQWVMMX-HDICACEKSA-N 2 0 365.468 2.542 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]4(C3)CC(F)(F)CO4)cc2)CC1 ZINC001140306196 1035427587 /nfs/dbraw/zinc/42/75/87/1035427587.db2.gz OPHIHEUHOKBTJK-IBGZPJMESA-N 2 0 365.468 2.829 20 10 FFCDRP Cc1ccccc1O[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001235675145 1037676616 /nfs/dbraw/zinc/67/66/16/1037676616.db2.gz PGDFHDWRXLFQNA-FQEVSTJZSA-N 2 0 367.493 2.764 20 10 FFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@]3(CCN(CC[NH+](C)C)C3=O)C2)c(O)c1 ZINC001277976762 1037858406 /nfs/dbraw/zinc/85/84/06/1037858406.db2.gz WBZXVVKIACOFIH-NRFANRHFSA-N 2 0 359.514 2.502 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3cccs3)c(F)c2)CC1 ZINC001236117689 1037938568 /nfs/dbraw/zinc/93/85/68/1037938568.db2.gz XRXNTRJGGQGXHR-IBGZPJMESA-N 2 0 374.529 2.786 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)c(OC)c1 ZINC001236411559 1038077065 /nfs/dbraw/zinc/07/70/65/1038077065.db2.gz NHGLCAHFYYECPY-UHFFFAOYSA-N 2 0 367.493 2.672 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN(CC[NH3+])Cc3ccccc3)c(F)c2)CC1 ZINC001236527574 1038120174 /nfs/dbraw/zinc/12/01/74/1038120174.db2.gz OZHUMCNXDIMASN-UHFFFAOYSA-N 2 0 356.489 2.538 20 10 FFCDRP Cc1cccnc1OC1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001236663353 1038179311 /nfs/dbraw/zinc/17/93/11/1038179311.db2.gz KDOWRYHMYVMKCK-UHFFFAOYSA-N 2 0 366.509 2.843 20 10 FFCDRP Cc1nnc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)o1 ZINC001236943480 1038370834 /nfs/dbraw/zinc/37/08/34/1038370834.db2.gz RWAQKBKHIZHAEJ-QGZVFWFLSA-N 2 0 373.476 2.649 20 10 FFCDRP CC[NH+]1CCC(C[NH+]2CCN(c3ccc(OCCOC)cc3)CC2)CC1 ZINC001208601667 1038440083 /nfs/dbraw/zinc/44/00/83/1038440083.db2.gz QEPLTGGNXSNSNR-UHFFFAOYSA-N 2 0 361.530 2.566 20 10 FFCDRP COc1ccc(C[NH+]2CCC3(CCC[N@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001278565651 1041191493 /nfs/dbraw/zinc/19/14/93/1041191493.db2.gz RIAKMTRSNRJVOX-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC3(Cc4ccccc4N3)CC1)C[NH2+]CCO2 ZINC001237346776 1043115655 /nfs/dbraw/zinc/11/56/55/1043115655.db2.gz WDWQVFDTORPQJP-UHFFFAOYSA-N 2 0 365.477 2.877 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2cc3ccccc3cc2O)CCC12C[NH2+]C2 ZINC001237430130 1043155110 /nfs/dbraw/zinc/15/51/10/1043155110.db2.gz IXALVDVZDKLGGV-GOSISDBHSA-N 2 0 354.450 2.520 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353544 1048681799 /nfs/dbraw/zinc/68/17/99/1048681799.db2.gz FZRKCYQTQLDXDM-FQEVSTJZSA-N 2 0 374.548 2.789 20 10 FFCDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935382 1065424499 /nfs/dbraw/zinc/42/44/99/1065424499.db2.gz CLXGXMYOORLTQB-WOJBJXKFSA-N 3 0 358.574 2.896 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1 ZINC000186060258 509504233 /nfs/dbraw/zinc/50/42/33/509504233.db2.gz HETAUWKESPSPEE-MRXNPFEDSA-N 2 0 355.482 2.843 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cc(Br)ccc2O)CC1 ZINC000185012852 510635068 /nfs/dbraw/zinc/63/50/68/510635068.db2.gz HSFMLJHUNQNSLR-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C[C@@H]3CN(CC(C)C)CCO3)CC2)cc1 ZINC000362222062 511149836 /nfs/dbraw/zinc/14/98/36/511149836.db2.gz QERJJTJRBORRIC-OAQYLSRUSA-N 2 0 361.530 2.610 20 10 FFCDRP CC[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000274970455 512001937 /nfs/dbraw/zinc/00/19/37/512001937.db2.gz YDRXMVGFCGCFQZ-CQSZACIVSA-N 2 0 357.292 2.652 20 10 FFCDRP C[NH+](C)CCOC1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000769383145 737522951 /nfs/dbraw/zinc/52/29/51/737522951.db2.gz DAICXZAHXPNODU-UHFFFAOYSA-N 2 0 357.292 2.697 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3cccc(Cl)c3)cc2)CC1 ZINC000771824920 737759819 /nfs/dbraw/zinc/75/98/19/737759819.db2.gz SJGSOKCGAFNXMJ-FQEVSTJZSA-N 2 0 359.901 2.915 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CO)c3ccc(Cl)cc3)cc2)CC1 ZINC000810162048 741394056 /nfs/dbraw/zinc/39/40/56/741394056.db2.gz VUPRKKWONIHOFW-FQEVSTJZSA-N 2 0 359.901 2.915 20 10 FFCDRP CSC1(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)CC[NH+](C)CC1 ZINC000810170550 741394561 /nfs/dbraw/zinc/39/45/61/741394561.db2.gz NBBHQZXKMMOWIN-UHFFFAOYSA-N 2 0 367.534 2.579 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1Cl ZINC000825122090 743212819 /nfs/dbraw/zinc/21/28/19/743212819.db2.gz WPSMAPZLCWBDKC-UHFFFAOYSA-N 2 0 360.889 2.791 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c2c1c(F)ccc2O ZINC000873243049 1013443001 /nfs/dbraw/zinc/44/30/01/1013443001.db2.gz IVAJWEQKDLQFEG-SJKOYZFVSA-N 2 0 367.428 2.909 20 10 FFCDRP COC(=O)c1c(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cc(F)ccc2n1C ZINC000894911893 967092198 /nfs/dbraw/zinc/09/21/98/967092198.db2.gz NNGREQCYXZOSKR-GOOCMWNKSA-N 2 0 359.445 2.819 20 10 FFCDRP COc1cc(C)cc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c1O ZINC000894998887 967154299 /nfs/dbraw/zinc/15/42/99/967154299.db2.gz IJWANTOGJBTKLP-UHFFFAOYSA-N 2 0 370.493 2.826 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1)c1ccccc1O ZINC000840889130 974109048 /nfs/dbraw/zinc/10/90/48/974109048.db2.gz OUAOPOXTCZIGCH-INIZCTEOSA-N 2 0 367.493 2.940 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1O ZINC001205996035 1032100773 /nfs/dbraw/zinc/10/07/73/1032100773.db2.gz UBZLOASGUMMLBV-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP CCOc1ccc(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391442 988549817 /nfs/dbraw/zinc/54/98/17/988549817.db2.gz CTUJFQVXHWCNKP-WLRLJWMZSA-N 2 0 362.514 2.750 20 10 FFCDRP CCc1noc([C@@H]2CC[C@H]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000922864796 988966040 /nfs/dbraw/zinc/96/60/40/988966040.db2.gz TVWQFLOKVOAPOQ-MSOLQXFVSA-N 2 0 369.513 2.810 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@@](CO)(c4ccccc4)C3)cc2)CC1 ZINC000923006103 990786277 /nfs/dbraw/zinc/78/62/77/990786277.db2.gz DSRNUAWSMRYEER-DKXQDJALSA-N 2 0 365.521 2.621 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC4(C3)Oc3ccccc3O4)cc2)CC1 ZINC000809790035 994612435 /nfs/dbraw/zinc/61/24/35/994612435.db2.gz UEGFPRACODNJFJ-UHFFFAOYSA-N 2 0 365.477 2.812 20 10 FFCDRP Oc1ccccc1C[N@H+](C[C@H]1CCCO1)C[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719177 1016149899 /nfs/dbraw/zinc/14/98/99/1016149899.db2.gz WJRCFTNDNHXMLX-RTBURBONSA-N 2 0 360.498 2.532 20 10 FFCDRP Cc1cc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nc(N)[nH+]1 ZINC000768527187 1000282800 /nfs/dbraw/zinc/28/28/00/1000282800.db2.gz FKDYFHNBSRXTOJ-UHFFFAOYSA-N 2 0 352.486 2.511 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2ccc3c(c2)[C@@H](C[NH3+])CCC3)cc1 ZINC000852790758 1006184912 /nfs/dbraw/zinc/18/49/12/1006184912.db2.gz BBEAKZYTWSYKNE-NQIIRXRSSA-N 2 0 366.509 2.561 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2ccc3c(c2)[C@H](C[NH3+])CCC3)cc1 ZINC000852790756 1006184979 /nfs/dbraw/zinc/18/49/79/1006184979.db2.gz BBEAKZYTWSYKNE-GHTZIAJQSA-N 2 0 366.509 2.561 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1[N+](=O)[O-] ZINC000883283310 1006730990 /nfs/dbraw/zinc/73/09/90/1006730990.db2.gz ACJPXCZLISUIMW-UHFFFAOYSA-N 2 0 370.453 2.645 20 10 FFCDRP COC(=O)c1coc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883290510 1006735386 /nfs/dbraw/zinc/73/53/86/1006735386.db2.gz WUEHYYNTFKOERX-OAHLLOKOSA-N 2 0 357.454 2.669 20 10 FFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000817893798 1007800008 /nfs/dbraw/zinc/80/00/08/1007800008.db2.gz HYORPLQHUIMVNT-YPAWHYETSA-N 2 0 357.542 2.906 20 10 FFCDRP CC[C@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817916272 1007808579 /nfs/dbraw/zinc/80/85/79/1007808579.db2.gz DNYBJRLQOGSYTN-VXKWHMMOSA-N 2 0 356.558 2.839 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942905 1007818378 /nfs/dbraw/zinc/81/83/78/1007818378.db2.gz RMRASBAXCXJMNN-KCZVDYSFSA-N 3 0 366.509 2.598 20 10 FFCDRP COc1c[nH+]ccc1N1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000794701711 1010520000 /nfs/dbraw/zinc/52/00/00/1010520000.db2.gz TVHVXXJZHUNZBW-UHFFFAOYSA-N 2 0 350.422 2.666 20 10 FFCDRP COc1cccc2c1C[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CO2 ZINC001173146881 1012292538 /nfs/dbraw/zinc/29/25/38/1012292538.db2.gz DCPLLUZQEQMHGA-SFHVURJKSA-N 2 0 367.493 2.540 20 10 FFCDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC(C(N)=O)CC2)cc1 ZINC000925778717 1017847778 /nfs/dbraw/zinc/84/77/78/1017847778.db2.gz WYMYZLXURHFDOK-PXNSSMCTSA-N 2 0 372.557 2.789 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321204 1032891317 /nfs/dbraw/zinc/89/13/17/1032891317.db2.gz RRVTXMSPGFHVLM-NRFANRHFSA-N 2 0 360.521 2.686 20 10 FFCDRP Fc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)ccc1N1CCOCC1 ZINC000903071474 1020663273 /nfs/dbraw/zinc/66/32/73/1020663273.db2.gz CEIYMEWMEMAPAT-JLYLLQBASA-N 2 0 359.489 2.910 20 10 FFCDRP CCN(CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)CCC(F)(F)F ZINC000755219046 1023579285 /nfs/dbraw/zinc/57/92/85/1023579285.db2.gz CNZJSLSIPKQYKD-UHFFFAOYSA-N 2 0 372.479 2.802 20 10 FFCDRP Cc1nn(C)c(C)c1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000092855959 1027478449 /nfs/dbraw/zinc/47/84/49/1027478449.db2.gz CBPYDKCKJWEYQQ-UHFFFAOYSA-N 2 0 367.541 2.859 20 10 FFCDRP Cc1ccc(O)c(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)n1 ZINC000092855982 1027478532 /nfs/dbraw/zinc/47/85/32/1027478532.db2.gz PDYOCQIOZGZZEM-UHFFFAOYSA-N 2 0 366.509 2.917 20 10 FFCDRP [NH3+]CC(=O)N1CCC[C@@H](C[N@H+](Cc2ccccc2O)C2CCCCC2)C1 ZINC000841018697 1029980953 /nfs/dbraw/zinc/98/09/53/1029980953.db2.gz OOIKWIBMGUHTJD-QGZVFWFLSA-N 2 0 359.514 2.724 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@H]3COC)C2)c1O ZINC001203608410 1030782686 /nfs/dbraw/zinc/78/26/86/1030782686.db2.gz OIHLTKXBUPVLDX-UGKGYDQZSA-N 2 0 374.525 2.971 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](c2ccccc2)C1 ZINC001204691462 1031412861 /nfs/dbraw/zinc/41/28/61/1031412861.db2.gz FYPHVGDNRCLXET-JOCHJYFZSA-N 2 0 350.510 2.585 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)cc1 ZINC000832272945 1034694362 /nfs/dbraw/zinc/69/43/62/1034694362.db2.gz KHNSLJWFNSLXCA-NHCUHLMSSA-N 2 0 366.509 2.533 20 10 FFCDRP CCOC(=O)C[C@H]1CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139254573 1035029849 /nfs/dbraw/zinc/02/98/49/1035029849.db2.gz ITPOGJBQPQAHMO-OAHLLOKOSA-N 2 0 364.486 2.628 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3C)C2)cc(C[NH+](C)C)c1O ZINC001139260016 1035031837 /nfs/dbraw/zinc/03/18/37/1035031837.db2.gz HTBLJFDGEDGUMN-GOSISDBHSA-N 2 0 371.481 2.819 20 10 FFCDRP CCCCOC(=O)[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411703 1035096062 /nfs/dbraw/zinc/09/60/62/1035096062.db2.gz ZNUJEZROZLHEOH-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@@H]([NH+]4CCCC4)[C@@H](F)C3)cc2)CC1 ZINC001140306609 1035428110 /nfs/dbraw/zinc/42/81/10/1035428110.db2.gz STESXLOFDJDWQE-FCHUYYIVSA-N 2 0 374.548 2.837 20 10 FFCDRP CCOC(=O)NC1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140309855 1035429641 /nfs/dbraw/zinc/42/96/41/1035429641.db2.gz XGAIEWRMFZFBDO-UHFFFAOYSA-N 2 0 374.529 2.539 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000835039839 1035491473 /nfs/dbraw/zinc/49/14/73/1035491473.db2.gz KIQABTTXOFDTLO-KUSOGIATSA-N 2 0 365.521 2.992 20 10 FFCDRP CC(C)C[N@H+](Cc1cnn(C)c1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000835076113 1035513793 /nfs/dbraw/zinc/51/37/93/1035513793.db2.gz CWXOXTYHVQGZFX-UHFFFAOYSA-N 2 0 355.530 2.830 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)CCC[NH+](C)C)cc1C ZINC001228261437 1036019059 /nfs/dbraw/zinc/01/90/59/1036019059.db2.gz KZGBAABTHLUEFK-RTBURBONSA-N 2 0 361.530 2.862 20 10 FFCDRP CC[NH+]1CCN(c2ccc(OC[C@H]3CCC4(CC[NH+](C)CC4)O3)cc2)CC1 ZINC001234657905 1037126722 /nfs/dbraw/zinc/12/67/22/1037126722.db2.gz LVLLZMXEURCAGK-OAQYLSRUSA-N 2 0 373.541 2.851 20 10 FFCDRP CC[NH+]1CCN(c2ccc(OC3CC[NH+](CCCOC)CC3)cc2)CC1 ZINC001234661229 1037128838 /nfs/dbraw/zinc/12/88/38/1037128838.db2.gz SEEMMAWZKCEVBY-UHFFFAOYSA-N 2 0 361.530 2.708 20 10 FFCDRP C[C@@H](c1ccccc1)[NH+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235864504 1037802975 /nfs/dbraw/zinc/80/29/75/1037802975.db2.gz RWBRPKHVWJXZIL-FQEVSTJZSA-N 2 0 364.537 2.975 20 10 FFCDRP C[C@H]1C[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)CCN1Cc1ccccc1 ZINC001236074371 1037916597 /nfs/dbraw/zinc/91/65/97/1037916597.db2.gz YCYPSTGJMQDSAK-KRWDZBQOSA-N 2 0 367.493 2.581 20 10 FFCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCN(C)CC1 ZINC001236944940 1038371986 /nfs/dbraw/zinc/37/19/86/1038371986.db2.gz HGKOTWOKQLFDDP-UHFFFAOYSA-N 2 0 362.537 2.882 20 10 FFCDRP COCCOCN1CCCC2(CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001278616732 1038835866 /nfs/dbraw/zinc/83/58/66/1038835866.db2.gz BBRRFQYVNIYYPG-UHFFFAOYSA-N 2 0 362.514 2.999 20 10 FFCDRP Clc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CO2 ZINC001246171677 1039263686 /nfs/dbraw/zinc/26/36/86/1039263686.db2.gz CNRGVRBDALLOKB-GOSISDBHSA-N 2 0 357.885 2.843 20 10 FFCDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246173961 1039266086 /nfs/dbraw/zinc/26/60/86/1039266086.db2.gz OFLYJSGBQOTEKK-INIZCTEOSA-N 2 0 354.454 2.725 20 10 FFCDRP CC[C@@H](Cc1ccc2c(c1)OCO2)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246176903 1039266641 /nfs/dbraw/zinc/26/66/41/1039266641.db2.gz YFFVDLKYRVRCGT-IBGZPJMESA-N 2 0 367.493 2.936 20 10 FFCDRP Oc1ccc([C@@H](O)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1O ZINC001255122686 1041157109 /nfs/dbraw/zinc/15/71/09/1041157109.db2.gz IUXLKTFVRDREAA-WEMPKCCASA-N 2 0 368.477 2.916 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149341 1042920377 /nfs/dbraw/zinc/92/03/77/1042920377.db2.gz FNETZMYNZIBLLQ-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001279231935 1042956743 /nfs/dbraw/zinc/95/67/43/1042956743.db2.gz ZKILTMQNXNVIRT-XDNSSPFJSA-N 2 0 356.558 2.933 20 10 FFCDRP Cn1c(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cnc1Cl ZINC000848546369 1060253974 /nfs/dbraw/zinc/25/39/74/1060253974.db2.gz ZJUOIUPGFJNJLG-UHFFFAOYSA-N 2 0 373.932 2.895 20 10 FFCDRP Nc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)s1 ZINC001580472609 1078812052 /nfs/dbraw/zinc/81/20/52/1078812052.db2.gz PTYRBSRVELWICA-UHFFFAOYSA-N 2 0 357.527 2.547 20 10 FFCDRP CN(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC001560245659 1076256724 /nfs/dbraw/zinc/25/67/24/1076256724.db2.gz LFJGXVJPSAHGRW-QFIPXVFZSA-N 2 0 352.526 2.831 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC001560426718 1076273294 /nfs/dbraw/zinc/27/32/94/1076273294.db2.gz ZIQNJAQVYNVBRB-UHFFFAOYSA-N 2 0 354.454 2.679 20 10 FFCDRP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000092615568 508087264 /nfs/dbraw/zinc/08/72/64/508087264.db2.gz OKMFHRKOUPEUOQ-UHFFFAOYSA-N 2 0 372.557 2.567 20 10 FFCDRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(N(C)C)cc1 ZINC000159144974 508799519 /nfs/dbraw/zinc/79/95/19/508799519.db2.gz UYLNNMPEAAHAOD-KRWDZBQOSA-N 2 0 353.514 2.750 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cc(F)ccc1O ZINC000186060717 509504178 /nfs/dbraw/zinc/50/41/78/509504178.db2.gz MNFQQUZNJNTTIA-AWEZNQCLSA-N 2 0 359.445 2.674 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1 ZINC000185084857 510675533 /nfs/dbraw/zinc/67/55/33/510675533.db2.gz AUFSWBKOKKYAAK-QGZVFWFLSA-N 2 0 369.509 2.999 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)c1 ZINC000289981283 511124307 /nfs/dbraw/zinc/12/43/07/511124307.db2.gz ZVQJJZXDYWGKJH-UHFFFAOYSA-N 2 0 359.514 2.515 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3c[nH]c4nccnc34)cc2F)CC1 ZINC000290771964 511150704 /nfs/dbraw/zinc/15/07/04/511150704.db2.gz BHXXFGNDLLSLGG-UHFFFAOYSA-N 2 0 368.460 2.529 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](Cc4nccs4)C3)cc2)CC1 ZINC000898071779 735310171 /nfs/dbraw/zinc/31/01/71/735310171.db2.gz SHRGUCREXMTSNK-SFHVURJKSA-N 2 0 356.539 2.960 20 10 FFCDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC000093769454 728477645 /nfs/dbraw/zinc/47/76/45/728477645.db2.gz PPOTZEJFVFIIPI-UHFFFAOYSA-N 2 0 350.503 2.971 20 10 FFCDRP Oc1ccc(Br)cc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000134051875 728728507 /nfs/dbraw/zinc/72/85/07/728728507.db2.gz UIOULQAHEFZXSQ-UHFFFAOYSA-N 2 0 369.303 2.699 20 10 FFCDRP C[NH+](C)CCOC1CC[NH+](Cc2c(O)cccc2Br)CC1 ZINC000862241940 730680495 /nfs/dbraw/zinc/68/04/95/730680495.db2.gz PDUKIISXJKXFMI-UHFFFAOYSA-N 2 0 357.292 2.697 20 10 FFCDRP CC[C@@H]([NH2+]CCN1CCC([NH3+])CC1)c1cc(Br)ccc1O ZINC000925813786 738532177 /nfs/dbraw/zinc/53/21/77/738532177.db2.gz YXFFZPUUHYJGLJ-OAHLLOKOSA-N 2 0 356.308 2.619 20 10 FFCDRP Cc1cc(O)c(C[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c(Cl)c1 ZINC000840876670 747209319 /nfs/dbraw/zinc/20/93/19/747209319.db2.gz RWHFXHSOOUHHLC-UHFFFAOYSA-N 2 0 360.889 2.791 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)CCCC[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000891255976 962618546 /nfs/dbraw/zinc/61/85/46/962618546.db2.gz UNUKECDHBIEOGG-FQEVSTJZSA-N 2 0 360.546 2.738 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(CO)cc3)cc2F)CC1 ZINC000877012107 1014448644 /nfs/dbraw/zinc/44/86/44/1014448644.db2.gz NPJJWEOGMNIWDP-UHFFFAOYSA-N 2 0 357.473 2.750 20 10 FFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877528778 1014613739 /nfs/dbraw/zinc/61/37/39/1014613739.db2.gz KEHLWHOTNXHAIW-FQEVSTJZSA-N 2 0 357.542 2.811 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cc1Br ZINC001206011583 1032108103 /nfs/dbraw/zinc/10/81/03/1032108103.db2.gz FAUTZOWZIXJFMR-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP [NH3+]CCN(c1ccc(CN2CC[NH2+]CC2)cc1)C12CC3CC(CC(C3)C1)C2 ZINC001170626247 995023235 /nfs/dbraw/zinc/02/32/35/995023235.db2.gz CSMAPNBRHYHGFS-UHFFFAOYSA-N 2 0 368.569 2.826 20 10 FFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000846221745 1000233321 /nfs/dbraw/zinc/23/33/21/1000233321.db2.gz NDCXQNMJZZZCGA-UHFFFAOYSA-N 2 0 351.494 2.801 20 10 FFCDRP CN1Cc2ccccc2[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771860352 1001231798 /nfs/dbraw/zinc/23/17/98/1001231798.db2.gz XSJDPLDSMVSRCC-JOCHJYFZSA-N 2 0 350.510 2.715 20 10 FFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CC)C(=O)OCC ZINC000792188423 1002938795 /nfs/dbraw/zinc/93/87/95/1002938795.db2.gz ONWXHGPFNLZASP-HXUWFJFHSA-N 2 0 361.530 2.992 20 10 FFCDRP COC(=O)CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775695028 1003702961 /nfs/dbraw/zinc/70/29/61/1003702961.db2.gz RMLCYLZWAMCHMB-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP Cn1ncc2c1CCC[C@H]2[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732931 1003893548 /nfs/dbraw/zinc/89/35/48/1003893548.db2.gz RTXHYLMBNCSOKA-HXUWFJFHSA-N 2 0 353.514 2.681 20 10 FFCDRP Fc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)ccc1N1CCOCC1 ZINC000853094168 1006295189 /nfs/dbraw/zinc/29/51/89/1006295189.db2.gz ZQOLNAQGIWVEMA-LJQANCHMSA-N 2 0 361.505 2.874 20 10 FFCDRP COc1cc(F)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1OC ZINC000883283321 1006730809 /nfs/dbraw/zinc/73/08/09/1006730809.db2.gz APILYGHCSOAJDX-UHFFFAOYSA-N 2 0 373.472 2.885 20 10 FFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc(C)cc(OC)c3O)CC2)CC1 ZINC000817373958 1007567092 /nfs/dbraw/zinc/56/70/92/1007567092.db2.gz UTJXTIYLASLORI-UHFFFAOYSA-N 2 0 361.530 2.701 20 10 FFCDRP C[C@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000817916676 1007808735 /nfs/dbraw/zinc/80/87/35/1007808735.db2.gz JKXQHYVGFVFPEL-AVRDEDQJSA-N 2 0 356.558 2.839 20 10 FFCDRP C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NC[C@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@@H+]2C1 ZINC001180179473 1009574068 /nfs/dbraw/zinc/57/40/68/1009574068.db2.gz PDBWXWQGUNSRQV-FRTACKCFSA-N 2 0 372.557 2.592 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173622027 1012780773 /nfs/dbraw/zinc/78/07/73/1012780773.db2.gz ITPCGODFOLUKFH-RTBURBONSA-N 2 0 359.514 2.650 20 10 FFCDRP CCOC(=O)[C@H]1CC2(C[N@@H+]1Cc1c(C)n(C)c3ccccc31)CC[NH2+]CC2 ZINC001222220828 1032831007 /nfs/dbraw/zinc/83/10/07/1032831007.db2.gz HQAVYXWOZNIYHA-HXUWFJFHSA-N 2 0 369.509 2.994 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC000756512444 1023721297 /nfs/dbraw/zinc/72/12/97/1023721297.db2.gz YNXDXUDQZJRJDJ-GOSISDBHSA-N 2 0 354.498 2.959 20 10 FFCDRP Cc1noc(C2(C)CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000781528842 1029257392 /nfs/dbraw/zinc/25/73/92/1029257392.db2.gz FTJFLPDVULUCTI-UHFFFAOYSA-N 2 0 369.513 2.684 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000840938158 1029932935 /nfs/dbraw/zinc/93/29/35/1029932935.db2.gz ZWQPAKZZDBVYFG-UHFFFAOYSA-N 2 0 368.525 2.642 20 10 FFCDRP FC(F)(F)[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)N1CC[NH2+]CC1 ZINC000841070822 1030015882 /nfs/dbraw/zinc/01/58/82/1030015882.db2.gz UHKVIIDBLPRUMD-SFHVURJKSA-N 2 0 370.463 2.603 20 10 FFCDRP COC(=O)c1c(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c2ccccc2n1C ZINC001204743050 1031423355 /nfs/dbraw/zinc/42/33/55/1031423355.db2.gz YMTQHZWUAHHIMU-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3ccccn3)C2)cc(C[NH+](C)C)c1O ZINC001139259232 1035031868 /nfs/dbraw/zinc/03/18/68/1035031868.db2.gz NRRGODSEKNPXBG-KRWDZBQOSA-N 2 0 357.454 2.511 20 10 FFCDRP Cc1nc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)no1 ZINC001139408735 1035093118 /nfs/dbraw/zinc/09/31/18/1035093118.db2.gz PVHYINXTBXCZSN-SFHVURJKSA-N 2 0 355.486 2.509 20 10 FFCDRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139409600 1035093628 /nfs/dbraw/zinc/09/36/28/1035093628.db2.gz MXZQSOJURGPXFJ-UHFFFAOYSA-N 3 0 358.574 2.991 20 10 FFCDRP CC(C)CC(=O)NC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139408849 1035093976 /nfs/dbraw/zinc/09/39/76/1035093976.db2.gz FBEJLXDAIDTQRE-UHFFFAOYSA-N 2 0 372.557 2.565 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](CCC(=O)OC)C3)cc2)CC1 ZINC001140306601 1035428307 /nfs/dbraw/zinc/42/83/07/1035428307.db2.gz VCFVSYCLEQGCNI-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP CC(C)n1nc(CN(C)C)c2c1C[N@H+](Cc1ccc(N(C)C)cc1O)CC2 ZINC001232836349 1036089984 /nfs/dbraw/zinc/08/99/84/1036089984.db2.gz OAWDGMLUDUAEJF-UHFFFAOYSA-N 2 0 371.529 2.856 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)cc1O ZINC001233484187 1036653203 /nfs/dbraw/zinc/65/32/03/1036653203.db2.gz ASRLHFXWKPDWJS-UHFFFAOYSA-N 2 0 358.438 2.885 20 10 FFCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCOC[C@@]4(CCC[NH2+]C4)C3)c2c1 ZINC001235021756 1037309067 /nfs/dbraw/zinc/30/90/67/1037309067.db2.gz JJKGDKSOBKOULP-OAQYLSRUSA-N 2 0 356.466 2.756 20 10 FFCDRP COC(=O)c1c(C[NH+]2CCC3(CC[NH2+]CC3)CC2)c2ccccc2n1C ZINC001235132998 1037379181 /nfs/dbraw/zinc/37/91/81/1037379181.db2.gz NQBSXUXICFZTOR-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP COC(=O)[C@]12C[C@@H]3C[NH2+]C[C@@H]3[C@H]1C[N@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001235334535 1037485679 /nfs/dbraw/zinc/48/56/79/1037485679.db2.gz MVYRGHYTVCVCAV-WHEACTPUSA-N 2 0 372.509 2.520 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(C(C)C)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235352185 1037497750 /nfs/dbraw/zinc/49/77/50/1037497750.db2.gz LXNPQRVBIMAZKV-RXVVDRJESA-N 2 0 360.498 2.880 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429415 1037543978 /nfs/dbraw/zinc/54/39/78/1037543978.db2.gz UENRAZQRDUTYKQ-MOPGFXCFSA-N 2 0 374.548 2.789 20 10 FFCDRP COC(=O)c1c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c2ccccc2n1C ZINC001235888400 1037820353 /nfs/dbraw/zinc/82/03/53/1037820353.db2.gz OSXBZYCCOMKCCE-GOSISDBHSA-N 2 0 355.482 2.929 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001235935349 1037845143 /nfs/dbraw/zinc/84/51/43/1037845143.db2.gz UCKJHDXUUITWRH-KRWDZBQOSA-N 2 0 355.457 2.930 20 10 FFCDRP COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236110597 1037935225 /nfs/dbraw/zinc/93/52/25/1037935225.db2.gz BWBPHUYCHFMNOQ-OAHLLOKOSA-N 2 0 356.466 2.946 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3cccs3)cc2)CC1 ZINC001236116241 1037937208 /nfs/dbraw/zinc/93/72/08/1037937208.db2.gz WWLJESGWMUFQPX-IBGZPJMESA-N 2 0 356.539 2.646 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3cccs3)cc2)CC1 ZINC001236116242 1037938488 /nfs/dbraw/zinc/93/84/88/1037938488.db2.gz WWLJESGWMUFQPX-LJQANCHMSA-N 2 0 356.539 2.646 20 10 FFCDRP CCOC(=O)C1(C(C)C)CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001236264920 1038009952 /nfs/dbraw/zinc/00/99/52/1038009952.db2.gz FVLKYMHHEBSYFO-UHFFFAOYSA-N 2 0 373.541 2.898 20 10 FFCDRP COCCOc1ccc(N2CC[NH+](CC3(C)CC[NH+](C)CC3)CC2)cc1 ZINC001208110475 1038039881 /nfs/dbraw/zinc/03/98/81/1038039881.db2.gz DHGWCJBYVUZHNX-UHFFFAOYSA-N 2 0 361.530 2.566 20 10 FFCDRP C[NH+](C)CCN(Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CCC[NH2+]C1 ZINC001236934225 1038365708 /nfs/dbraw/zinc/36/57/08/1038365708.db2.gz WIGLVCXBVLJASA-KRWDZBQOSA-N 2 0 359.514 2.692 20 10 FFCDRP C[NH+](C)CCN(Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CCC[NH2+]C1 ZINC001236934226 1038365847 /nfs/dbraw/zinc/36/58/47/1038365847.db2.gz WIGLVCXBVLJASA-QGZVFWFLSA-N 2 0 359.514 2.692 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@H](F)CO4)CC3)c(F)c2)CC1 ZINC001236943975 1038371864 /nfs/dbraw/zinc/37/18/64/1038371864.db2.gz XZBIIHQLDCCBTK-KRWDZBQOSA-N 2 0 365.468 2.671 20 10 FFCDRP c1ccc(N2C[C@@H]3C[N@H+](Cc4ccc(N5CC[NH2+]CC5)cc4)C[C@@H]3C2)cc1 ZINC001237036846 1038415362 /nfs/dbraw/zinc/41/53/62/1038415362.db2.gz DQGTUDPWVALXHY-OYRHEFFESA-N 2 0 362.521 2.664 20 10 FFCDRP COc1cc(O)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)c(Br)c1 ZINC001237071752 1038434891 /nfs/dbraw/zinc/43/48/91/1038434891.db2.gz WZJJIKFJEQTBTO-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H]3CC[NH2+][C@@H](C(C)C)C3)CC2)cc1 ZINC001246185119 1039268818 /nfs/dbraw/zinc/26/88/18/1039268818.db2.gz SFBFQWJTAWPANX-SIKLNZKXSA-N 2 0 374.573 2.574 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(OC)cc3O)(C1)CCC2 ZINC001278566053 1041192768 /nfs/dbraw/zinc/19/27/68/1041192768.db2.gz ZCUSCNGGKAPUAB-UXHICEINSA-N 2 0 364.486 2.546 20 10 FFCDRP Oc1ccc([C@H](O)C[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255382893 1041310670 /nfs/dbraw/zinc/31/06/70/1041310670.db2.gz YDJYRHVAUKMVSE-GHTZIAJQSA-N 2 0 356.466 2.776 20 10 FFCDRP COc1cc(C[N@@H+]2CCOC3(CC[NH+](C)CC3)C2)c(O)c(C(C)(C)C)c1 ZINC001330278865 1049116716 /nfs/dbraw/zinc/11/67/16/1049116716.db2.gz ITNYLUKWGAALIL-UHFFFAOYSA-N 2 0 362.514 2.995 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1O ZINC001334359711 1049388910 /nfs/dbraw/zinc/38/89/10/1049388910.db2.gz PZAHGSGRCHEKGE-HXUWFJFHSA-N 2 0 370.493 2.956 20 10 FFCDRP CC(C)C[NH+]1CCC(C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC001304768025 1051689800 /nfs/dbraw/zinc/68/98/00/1051689800.db2.gz JSUFZSGGFOGVBA-OAQYLSRUSA-N 2 0 374.573 2.840 20 10 FFCDRP C[NH+](C)CCOc1ccccc1N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001337838352 1055050499 /nfs/dbraw/zinc/05/04/99/1055050499.db2.gz OAXCIUDQYYASCF-UHFFFAOYSA-N 2 0 354.498 2.531 20 10 FFCDRP COc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000377632528 512366363 /nfs/dbraw/zinc/36/63/63/512366363.db2.gz STKREOPPFMOXOC-QGZVFWFLSA-N 2 0 367.921 2.655 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809516 509306178 /nfs/dbraw/zinc/30/61/78/509306178.db2.gz DXFFJDSHGKHVET-XQBPLPMBSA-N 2 0 374.573 2.526 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](C(F)(F)F)CC3)cc2)CC1 ZINC000877819684 732440628 /nfs/dbraw/zinc/44/06/28/732440628.db2.gz IBKHZBVYVPXPER-KRWDZBQOSA-N 2 0 357.420 2.592 20 10 FFCDRP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502164 738097723 /nfs/dbraw/zinc/09/77/23/738097723.db2.gz PDJPOMRMWGYCQI-XJKSGUPXSA-N 2 0 353.894 2.674 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3nc4c(s3)CCC4)cc2)CC1 ZINC000922714055 738190714 /nfs/dbraw/zinc/19/07/14/738190714.db2.gz CXZRAAMIVMUVDW-UHFFFAOYSA-N 2 0 356.539 2.716 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cc1F ZINC000799346403 740410940 /nfs/dbraw/zinc/41/09/40/740410940.db2.gz KUESHXAJIALCCS-UHFFFAOYSA-N 2 0 350.526 2.788 20 10 FFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817888578 742221035 /nfs/dbraw/zinc/22/10/35/742221035.db2.gz MRHPUKUSHHMEHT-SUMWQHHRSA-N 2 0 357.420 2.759 20 10 FFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)cc1 ZINC000817973547 742225622 /nfs/dbraw/zinc/22/56/22/742225622.db2.gz VAXFSFLALWEOMW-RHSMWYFYSA-N 2 0 358.452 2.629 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)c1O ZINC000842478992 747613701 /nfs/dbraw/zinc/61/37/01/747613701.db2.gz NFJIUDNITMXKNM-AEFFLSMTSA-N 2 0 366.889 2.967 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125308 747777411 /nfs/dbraw/zinc/77/74/11/747777411.db2.gz RUHHKOOHCFBBLU-QWHCGFSZSA-N 2 0 369.303 2.985 20 10 FFCDRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c2c1c(F)ccc2O ZINC000873243050 1013443159 /nfs/dbraw/zinc/44/31/59/1013443159.db2.gz IVAJWEQKDLQFEG-YVEFUNNKSA-N 2 0 367.428 2.909 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccc(F)c(F)c3)cc2)CC1 ZINC000905426302 980438392 /nfs/dbraw/zinc/43/83/92/980438392.db2.gz HRVBAVAESSRMGS-HXUWFJFHSA-N 2 0 361.436 2.540 20 10 FFCDRP CC(C)(C)c1cc(O)c(O)c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1 ZINC000054518610 981941827 /nfs/dbraw/zinc/94/18/27/981941827.db2.gz PKVZWXZLVZZMHX-UHFFFAOYSA-N 2 0 362.514 2.940 20 10 FFCDRP CCc1ccc([C@@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796451279 1014975339 /nfs/dbraw/zinc/97/53/39/1014975339.db2.gz MRBOXIBPEHOIIZ-QFIPXVFZSA-N 2 0 353.510 2.824 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126122 986556655 /nfs/dbraw/zinc/55/66/55/986556655.db2.gz GRVUJYMCZHRKFT-SFTDATJTSA-N 3 0 356.558 2.650 20 10 FFCDRP C[N@@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465835 1000262584 /nfs/dbraw/zinc/26/25/84/1000262584.db2.gz MHIJMCKXQBVYNB-UWJYYQICSA-N 2 0 368.477 2.772 20 10 FFCDRP CC(C)[NH+]1CCC(N2CC[NH+](Cc3cc4c(cc3O)CCC4)CC2)CC1 ZINC000771174387 1001036437 /nfs/dbraw/zinc/03/64/37/1001036437.db2.gz JNMBJOWGAWCSCD-UHFFFAOYSA-N 2 0 357.542 2.871 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](Cn3cccn3)C(C)C)cc2F)CC1 ZINC000788594460 1001830382 /nfs/dbraw/zinc/83/03/82/1001830382.db2.gz MTEDWQGISBDOQX-HXUWFJFHSA-N 2 0 373.520 2.979 20 10 FFCDRP Cc1cccc(C[NH+]2CCN(c3ccccc3OCC[NH+](C)C)CC2)c1O ZINC000775696389 1003703239 /nfs/dbraw/zinc/70/32/39/1003703239.db2.gz KAHKHSWPKDLSIY-UHFFFAOYSA-N 2 0 369.509 2.963 20 10 FFCDRP COC(=O)C1([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000775694459 1003703317 /nfs/dbraw/zinc/70/33/17/1003703317.db2.gz KUHVOPDUOWGCDT-UHFFFAOYSA-N 2 0 359.514 2.746 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000775726536 1003859039 /nfs/dbraw/zinc/85/90/39/1003859039.db2.gz VLHXEIWTYJRMOU-AREMUKBSSA-N 2 0 371.550 2.808 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205570623 1003950342 /nfs/dbraw/zinc/95/03/42/1003950342.db2.gz MLWLTQJOSQCUGD-OAHLLOKOSA-N 2 0 361.255 2.816 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817893872 1007800608 /nfs/dbraw/zinc/80/06/08/1007800608.db2.gz JLMUZRKULZESAN-MISYRCLQSA-N 2 0 361.505 2.797 20 10 FFCDRP O[C@H](C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)CC(F)(F)F ZINC000819200990 1008064749 /nfs/dbraw/zinc/06/47/49/1008064749.db2.gz YSFNWDKYFDPWPB-SFHVURJKSA-N 2 0 371.447 2.622 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](n3cccn3)C(F)(F)F)cc2)CC1 ZINC000858209502 1008325385 /nfs/dbraw/zinc/32/53/85/1008325385.db2.gz MNIZWRJLEDPIAW-KRWDZBQOSA-N 2 0 367.419 2.528 20 10 FFCDRP Cc1cccc2c1C[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CO2 ZINC000858216189 1008326731 /nfs/dbraw/zinc/32/67/31/1008326731.db2.gz VKNXUQIHUSLWBW-LJQANCHMSA-N 2 0 351.494 2.840 20 10 FFCDRP C[C@@H]1C[C@@H]2CC[C@H](C(=O)NC[C@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@@H+]2C1 ZINC001180179474 1009573435 /nfs/dbraw/zinc/57/34/35/1009573435.db2.gz PDBWXWQGUNSRQV-GKBFQHABSA-N 2 0 372.557 2.592 20 10 FFCDRP [NH3+]Cc1cccc(C(=O)Nc2cccc(N3CC[NH+](CC4CC4)CC3)c2)c1 ZINC000827644049 1018554811 /nfs/dbraw/zinc/55/48/11/1018554811.db2.gz OQYDBOSEHDZGEN-UHFFFAOYSA-N 2 0 364.493 2.930 20 10 FFCDRP CCOC(=O)[C@]1(C)CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000827750486 1018638694 /nfs/dbraw/zinc/63/86/94/1018638694.db2.gz HXKBXOPSQDUZIZ-TZIWHRDSSA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000827786317 1018663736 /nfs/dbraw/zinc/66/37/36/1018663736.db2.gz ISUSUIIAXZBZCT-MAUKXSAKSA-N 2 0 371.447 2.980 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc(Cl)cc(C)c3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136018 1032779237 /nfs/dbraw/zinc/77/92/37/1032779237.db2.gz KYFZXODOGGTADB-KXBFYZLASA-N 2 0 366.889 2.719 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc4ccccc4cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136026 1032780795 /nfs/dbraw/zinc/78/07/95/1032780795.db2.gz KZVRRXBPVSLDEU-UGKGYDQZSA-N 2 0 368.477 2.910 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)c1O ZINC001118246012 1022141676 /nfs/dbraw/zinc/14/16/76/1022141676.db2.gz LMUFGQLLIHVPNH-QGZVFWFLSA-N 2 0 369.509 2.999 20 10 FFCDRP C[C@H](CCn1cccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000159200993 1022632074 /nfs/dbraw/zinc/63/20/74/1022632074.db2.gz JKMXLRUWXHNESO-LJQANCHMSA-N 2 0 367.541 2.984 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548174 1023725885 /nfs/dbraw/zinc/72/58/85/1023725885.db2.gz JAXCOQHTKNZDCE-RDJZCZTQSA-N 2 0 355.482 2.783 20 10 FFCDRP CCn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000092855920 1027477332 /nfs/dbraw/zinc/47/73/32/1027477332.db2.gz ZOMXIMFQNNKVKM-UHFFFAOYSA-N 2 0 353.514 2.725 20 10 FFCDRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCCc4cc(O)c(O)cc4C3)c2)CC1 ZINC001155948577 1028987227 /nfs/dbraw/zinc/98/72/27/1028987227.db2.gz RALAJQJPUQVOSV-UHFFFAOYSA-N 2 0 369.465 2.919 20 10 FFCDRP COCC[C@@H](Cc1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000784626333 1030724770 /nfs/dbraw/zinc/72/47/70/1030724770.db2.gz ZVUJWWAJOVYZCB-IBGZPJMESA-N 2 0 357.498 2.769 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753581 1030906925 /nfs/dbraw/zinc/90/69/25/1030906925.db2.gz FKYFNVLBFUAYAN-NRSPTQNISA-N 3 0 374.548 2.930 20 10 FFCDRP C[NH+]1CCC(C[NH+]2CCN(Cc3ccc(N4CCCC4)cc3)CC2)CC1 ZINC001204329344 1031233243 /nfs/dbraw/zinc/23/32/43/1031233243.db2.gz NEZQQVUNISVKES-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c1O ZINC001204341968 1031236645 /nfs/dbraw/zinc/23/66/45/1031236645.db2.gz MLXLILRADYNMJC-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000798271621 1031353288 /nfs/dbraw/zinc/35/32/88/1031353288.db2.gz CHQOAMPIIJEOTD-SFHVURJKSA-N 2 0 374.529 2.537 20 10 FFCDRP COc1cc(CN2CC[N@H+](C)C[C@H]2c2ccccc2)cc(C[NH+](C)C)c1O ZINC001139252842 1035029788 /nfs/dbraw/zinc/02/97/88/1035029788.db2.gz BADCDMMYPCIWAM-FQEVSTJZSA-N 2 0 369.509 2.951 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](O)[C@@H]2Cc2ccccc2)cc(C[NH+](C)C)c1O ZINC001139255132 1035030476 /nfs/dbraw/zinc/03/04/76/1035030476.db2.gz MFWSOHSRSQEFBP-VQTJNVASSA-N 2 0 370.493 2.640 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C(F)(F)F)[C@H]3CO)cc2)CC1 ZINC001139409261 1035093962 /nfs/dbraw/zinc/09/39/62/1035093962.db2.gz YEDLTEVAXAUYGS-QZTJIDSGSA-N 2 0 371.447 2.574 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](Oc4ccncc4)C3)cc2)CC1 ZINC001139411405 1035094933 /nfs/dbraw/zinc/09/49/33/1035094933.db2.gz KAXCWEZTOZBVPI-QFIPXVFZSA-N 2 0 366.509 2.877 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@@H]4CCO)CC3)cc2)CC1 ZINC001140302135 1035425685 /nfs/dbraw/zinc/42/56/85/1035425685.db2.gz KXWNEFSUNCHZMU-FQEVSTJZSA-N 2 0 357.542 2.813 20 10 FFCDRP Cc1ccc(O)c(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c1 ZINC001140622065 1035749424 /nfs/dbraw/zinc/74/94/24/1035749424.db2.gz WVQWKCAXTSTFIO-WOJBJXKFSA-N 2 0 371.525 2.608 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)cc1Br ZINC001233141454 1036393166 /nfs/dbraw/zinc/39/31/66/1036393166.db2.gz JCZTYKMOAZSNGP-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN(C[C@H]4CCCC[NH2+]4)C3)C2)cc1 ZINC001235494942 1037587343 /nfs/dbraw/zinc/58/73/43/1037587343.db2.gz UKDSXUBVDOECMR-KNQAVFIVSA-N 2 0 373.541 2.756 20 10 FFCDRP COC(=O)c1cccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001236086374 1037929083 /nfs/dbraw/zinc/92/90/83/1037929083.db2.gz JHPVKIZAPMCBNF-UHFFFAOYSA-N 2 0 353.466 2.515 20 10 FFCDRP Oc1cc2c(cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376956 1038062580 /nfs/dbraw/zinc/06/25/80/1038062580.db2.gz XKMMSBXJWORDMS-MRXNPFEDSA-N 2 0 359.514 2.618 20 10 FFCDRP Cc1ccnc(O[C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236532879 1038122152 /nfs/dbraw/zinc/12/21/52/1038122152.db2.gz FVUVHYUPXOWINW-OAQYLSRUSA-N 2 0 366.509 2.843 20 10 FFCDRP Cc1cccc(O[C@H]2CCC[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)n1 ZINC001236849330 1038306746 /nfs/dbraw/zinc/30/67/46/1038306746.db2.gz VRNZSYYBEVZITF-SFHVURJKSA-N 2 0 369.465 2.621 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]4(C3)CC(F)(F)CO4)c(F)c2)CC1 ZINC001236934885 1038367836 /nfs/dbraw/zinc/36/78/36/1038367836.db2.gz AAWVMHJEMDZXPX-GOSISDBHSA-N 2 0 369.431 2.578 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@@H]4CC[C@@H](C)[NH2+]C4)C3)C2)cc1 ZINC001246707579 1039443844 /nfs/dbraw/zinc/44/38/44/1039443844.db2.gz ZAKCDAUNDLTJBL-UZKOGDIHSA-N 2 0 373.541 2.755 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[N@H+](C)C4)CC3)cc2)CC1 ZINC001278473862 1039546228 /nfs/dbraw/zinc/54/62/28/1039546228.db2.gz BURTUAJBDZZPSV-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@H+](CC)CCC[NH+](C)C)c(O)c1 ZINC001249743308 1040972295 /nfs/dbraw/zinc/97/22/95/1040972295.db2.gz JPRTWIFJVWNQCE-UHFFFAOYSA-N 2 0 366.502 2.888 20 10 FFCDRP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@H+](Cc1ccc(Cl)cc1O)C2 ZINC001278557127 1041144769 /nfs/dbraw/zinc/14/47/69/1041144769.db2.gz FRMWWFAQWSHSLJ-IBGZPJMESA-N 2 0 351.922 2.895 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cccc(-c2ccccc2)c1O ZINC001279323795 1043000736 /nfs/dbraw/zinc/00/07/36/1043000736.db2.gz ILEABOAWRUUZGA-BGYRXZFFSA-N 2 0 351.494 2.879 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC12C[NH2+]C2 ZINC001237428634 1043155363 /nfs/dbraw/zinc/15/53/63/1043155363.db2.gz BOMZFNWKSIMXQP-KRWDZBQOSA-N 2 0 360.498 2.664 20 10 FFCDRP Cc1cc(Br)cc(C)c1NC(=O)NCCC[NH2+]CCC[NH3+] ZINC001239252881 1044085518 /nfs/dbraw/zinc/08/55/18/1044085518.db2.gz JVBOQCBJXDYGFX-UHFFFAOYSA-N 2 0 357.296 2.516 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@H]2C1 ZINC001333890611 1049158856 /nfs/dbraw/zinc/15/88/56/1049158856.db2.gz FGCAMXYRLNGRDJ-SFHLNBCPSA-N 2 0 357.542 2.810 20 10 FFCDRP COc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1C ZINC001506924323 1059577563 /nfs/dbraw/zinc/57/75/63/1059577563.db2.gz VFPOUMAGVHLVSE-ZHALLVOQSA-N 2 0 361.530 2.718 20 10 FFCDRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935380 1065424188 /nfs/dbraw/zinc/42/41/88/1065424188.db2.gz CLXGXMYOORLTQB-BGYRXZFFSA-N 3 0 358.574 2.896 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@](C)(CO)Cc3ccccc3F)cc2)CC1 ZINC001560548735 1076278908 /nfs/dbraw/zinc/27/89/08/1076278908.db2.gz ZFHVFGWFSJETMG-JOCHJYFZSA-N 2 0 371.500 2.661 20 10 FFCDRP Nc1ncnc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1Cl ZINC000302864653 511718392 /nfs/dbraw/zinc/71/83/92/511718392.db2.gz XNZZPUXWPAIMPV-UHFFFAOYSA-N 2 0 372.904 2.856 20 10 FFCDRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000076894061 728268146 /nfs/dbraw/zinc/26/81/46/728268146.db2.gz RGHFZVQRFGJPTH-UHFFFAOYSA-N 2 0 361.873 2.627 20 10 FFCDRP C[C@@H]([NH2+]CCCCCN1CC[NH2+]CC1)c1ccc(Br)cc1O ZINC000925844501 738535184 /nfs/dbraw/zinc/53/51/84/738535184.db2.gz LOETZHZGQWQWAT-CQSZACIVSA-N 2 0 370.335 2.881 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000883283698 733360015 /nfs/dbraw/zinc/36/00/15/733360015.db2.gz PCSNAKKGLFQCSL-RDJZCZTQSA-N 2 0 357.420 2.638 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@H](C)C1 ZINC000894256428 734826017 /nfs/dbraw/zinc/82/60/17/734826017.db2.gz QIASBHGHTJGSMA-SJLPKXTDSA-N 2 0 350.503 2.936 20 10 FFCDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1O ZINC000756407864 736328400 /nfs/dbraw/zinc/32/84/00/736328400.db2.gz GACAPBFEDIBWRV-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CC[C@@H](C(F)(F)F)O3)cc2)CC1 ZINC000922457045 738148761 /nfs/dbraw/zinc/14/87/61/738148761.db2.gz GRFDVGMSFFDAPO-IRXDYDNUSA-N 2 0 357.420 2.638 20 10 FFCDRP C[C@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817971971 742225415 /nfs/dbraw/zinc/22/54/15/742225415.db2.gz IHQWGDWXUUQWON-IINYFYTJSA-N 2 0 351.800 2.532 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1O ZINC000824988466 743189676 /nfs/dbraw/zinc/18/96/76/743189676.db2.gz LQZYAKJJSFZDLK-AGUYFDCRSA-N 2 0 355.276 2.878 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1O ZINC000843059181 747757337 /nfs/dbraw/zinc/75/73/37/747757337.db2.gz FNXMXIARYOLRTI-BPNCWPANSA-N 2 0 355.276 2.723 20 10 FFCDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000162800661 972137018 /nfs/dbraw/zinc/13/70/18/972137018.db2.gz SUTAWWNUVAWWAJ-DENIHFKCSA-N 2 0 374.573 2.527 20 10 FFCDRP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1ccc(Cl)cc1O ZINC001275893367 1013149714 /nfs/dbraw/zinc/14/97/14/1013149714.db2.gz WZEQOYSJKIZYPJ-LJQANCHMSA-N 2 0 365.905 2.564 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C[NH+](C)C)cc2)[NH+](C)C)cc1 ZINC000891254236 962612368 /nfs/dbraw/zinc/61/23/68/962612368.db2.gz XRFSHHLXJRBMER-OAQYLSRUSA-N 2 0 368.525 2.847 20 10 FFCDRP COc1ccc(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1Cn1cccn1 ZINC000873114316 1013391326 /nfs/dbraw/zinc/39/13/26/1013391326.db2.gz AGGQVLVXICVZJP-SFHVURJKSA-N 2 0 372.513 2.531 20 10 FFCDRP COc1cc(C)cc(C[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c1O ZINC000894304241 964438574 /nfs/dbraw/zinc/43/85/74/964438574.db2.gz OUAGUDFUEFIASX-UHFFFAOYSA-N 2 0 361.530 2.749 20 10 FFCDRP COc1ccc(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(O)c1OC ZINC000892609818 969589201 /nfs/dbraw/zinc/58/92/01/969589201.db2.gz AXDFMKXGSRNXJB-UHFFFAOYSA-N 2 0 360.454 2.640 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(C[S@@](C)=O)cc3)cc2)CC1 ZINC000796526412 1014178492 /nfs/dbraw/zinc/17/84/92/1014178492.db2.gz MUTYBKBEHRTGIQ-AREMUKBSSA-N 2 0 371.550 2.607 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000877643623 1014658373 /nfs/dbraw/zinc/65/83/73/1014658373.db2.gz LKORYPVVNRFNGC-HXUWFJFHSA-N 2 0 357.542 2.859 20 10 FFCDRP FCCn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000921956356 987399273 /nfs/dbraw/zinc/39/92/73/987399273.db2.gz JTZKGFAJDHXIGW-UHFFFAOYSA-N 2 0 371.504 2.674 20 10 FFCDRP CC(C)[N@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)Cc1ccc(N(C)C)cc1 ZINC000920781270 990913015 /nfs/dbraw/zinc/91/30/15/990913015.db2.gz LTGSHBJZXYNKIQ-UHFFFAOYSA-N 2 0 372.557 2.706 20 10 FFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000809756533 994605876 /nfs/dbraw/zinc/60/58/76/994605876.db2.gz SCPAQUPJVNBOIV-LJQANCHMSA-N 2 0 361.505 2.826 20 10 FFCDRP CO[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1 ZINC000824589210 997000128 /nfs/dbraw/zinc/00/01/28/997000128.db2.gz CIFFEFSOQDLUSM-JOCHJYFZSA-N 2 0 353.510 2.786 20 10 FFCDRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)cc1 ZINC000844221187 997714504 /nfs/dbraw/zinc/71/45/04/997714504.db2.gz AESJJIVHKPOAGR-IBGZPJMESA-N 2 0 369.509 2.958 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)c(O)c1 ZINC001144515726 998627797 /nfs/dbraw/zinc/62/77/97/998627797.db2.gz WEWHUXRKZXTQTB-UHFFFAOYSA-N 2 0 354.450 2.901 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1O ZINC000846166538 1000215007 /nfs/dbraw/zinc/21/50/07/1000215007.db2.gz YZLRJICRDJIKTO-CRAIPNDOSA-N 2 0 356.466 2.818 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc[nH]c(=O)c3)cc2F)CC1 ZINC000788596651 1001830474 /nfs/dbraw/zinc/83/04/74/1001830474.db2.gz ZITGOZOUCHNNSB-HNNXBMFYSA-N 2 0 358.461 2.919 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3C[C@@]3(C)Br)cc2)CC1 ZINC001183534564 1002312614 /nfs/dbraw/zinc/31/26/14/1002312614.db2.gz RANLEWXSLNSAGL-NVXWUHKLSA-N 2 0 352.320 2.702 20 10 FFCDRP COc1ccc([C@@H](CO)[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775701483 1003706221 /nfs/dbraw/zinc/70/62/21/1003706221.db2.gz YXCZRDBQHWVWOZ-JOCHJYFZSA-N 2 0 369.509 2.612 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1n1ccnc1 ZINC000775738146 1003930009 /nfs/dbraw/zinc/93/00/09/1003930009.db2.gz UFXMLDGXRQWLFC-NQIIRXRSSA-N 2 0 353.514 2.718 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCN(c4ccccc4)CC3)cc2)CC1 ZINC000775639597 1004901589 /nfs/dbraw/zinc/90/15/89/1004901589.db2.gz ZSNVIRXPFCSYDR-UHFFFAOYSA-N 2 0 350.510 2.761 20 10 FFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@H]1COc2ccccc2O1 ZINC000775643576 1004910069 /nfs/dbraw/zinc/91/00/69/1004910069.db2.gz RFWNUVSRPXSWEY-HXUWFJFHSA-N 2 0 367.493 2.710 20 10 FFCDRP COc1ccc(N2CC[C@@H]([NH2+]Cc3cn(-c4cc[nH+]cc4)nc3C)C2)cc1 ZINC000850346746 1005809142 /nfs/dbraw/zinc/80/91/42/1005809142.db2.gz IXOYPKCQJNAQDG-GOSISDBHSA-N 2 0 363.465 2.953 20 10 FFCDRP C[C@@H](CC(=O)N1CCCCCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883289710 1006735720 /nfs/dbraw/zinc/73/57/20/1006735720.db2.gz XUAHPYZSEQLSEL-IBGZPJMESA-N 2 0 372.557 2.709 20 10 FFCDRP COC(=O)c1coc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883290509 1006736410 /nfs/dbraw/zinc/73/64/10/1006736410.db2.gz WUEHYYNTFKOERX-HNNXBMFYSA-N 2 0 357.454 2.669 20 10 FFCDRP C[NH+]1CCN(c2cc(C[NH2+]Cc3ccc4ccccc4c3O)ccn2)CC1 ZINC000816535687 1007101805 /nfs/dbraw/zinc/10/18/05/1007101805.db2.gz WUFXWGJXTVPVKC-UHFFFAOYSA-N 2 0 362.477 2.982 20 10 FFCDRP Cn1nc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000775319146 1007267690 /nfs/dbraw/zinc/26/76/90/1007267690.db2.gz PSHNCUJCBHZABC-UHFFFAOYSA-N 2 0 363.509 2.657 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817902959 1007805195 /nfs/dbraw/zinc/80/51/95/1007805195.db2.gz CLSKLMQPSFCFSE-KKXDTOCCSA-N 2 0 369.456 2.599 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)COc4ccccc4O3)cc2)CC1 ZINC000858208415 1008325150 /nfs/dbraw/zinc/32/51/50/1008325150.db2.gz BZOYTPASJKXVDN-QFIPXVFZSA-N 2 0 367.493 2.758 20 10 FFCDRP [NH3+]CC1(c2ccccc2)CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001206749830 1032407804 /nfs/dbraw/zinc/40/78/04/1032407804.db2.gz PDODTXFNVLVJGP-UHFFFAOYSA-N 3 0 364.537 2.589 20 10 FFCDRP Cn1cc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c2cccnc21 ZINC000865812210 1010867533 /nfs/dbraw/zinc/86/75/33/1010867533.db2.gz LRZKSCAQULFDMV-UHFFFAOYSA-N 2 0 363.509 2.657 20 10 FFCDRP CCOC(=O)C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173622026 1012778850 /nfs/dbraw/zinc/77/88/50/1012778850.db2.gz ITPCGODFOLUKFH-RBUKOAKNSA-N 2 0 359.514 2.650 20 10 FFCDRP CN(C)c1ccc(CN(C)C(=O)C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000047972590 1022630457 /nfs/dbraw/zinc/63/04/57/1022630457.db2.gz SGXAUHOOQKXVDS-UHFFFAOYSA-N 2 0 372.557 2.519 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c1 ZINC000756536270 1023724128 /nfs/dbraw/zinc/72/41/28/1023724128.db2.gz UJKNGVZCAGUGRQ-GOSISDBHSA-N 2 0 369.513 2.744 20 10 FFCDRP CCc1cc(NCCC[NH+]2CCN(c3ccc(OC)cc3)CC2)cc[nH+]1 ZINC001164335682 1029249295 /nfs/dbraw/zinc/24/92/95/1029249295.db2.gz GGEVFHMTQXNRJI-UHFFFAOYSA-N 2 0 354.498 2.699 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@H]3COc4ccccc4O3)cc2)CC1 ZINC000841887954 1030522956 /nfs/dbraw/zinc/52/29/56/1030522956.db2.gz AWWIFMLRWPDOSA-FQEVSTJZSA-N 2 0 367.493 2.758 20 10 FFCDRP COc1ccc(O)c(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1 ZINC001203671487 1030818854 /nfs/dbraw/zinc/81/88/54/1030818854.db2.gz PPFPNALYEBASJG-WIYYLYMNSA-N 2 0 360.498 2.581 20 10 FFCDRP CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)cc1 ZINC000843048278 1031158161 /nfs/dbraw/zinc/15/81/61/1031158161.db2.gz WVKKZUXBHYMIIC-IBGZPJMESA-N 2 0 360.546 2.600 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CC2)C[N@H+](Cc2ccccc2)CCO3)c(O)c1 ZINC001204274306 1031202144 /nfs/dbraw/zinc/20/21/44/1031202144.db2.gz MYSKVYIYWJEVAZ-UHFFFAOYSA-N 2 0 368.477 2.965 20 10 FFCDRP COC(=O)c1c(C[N@H+](C)CC2CC[NH+](C)CC2)c2cc(F)ccc2n1C ZINC001204448916 1031296168 /nfs/dbraw/zinc/29/61/68/1031296168.db2.gz GJKYQZMHMWEICO-UHFFFAOYSA-N 2 0 361.461 2.878 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)CC[C@@H]([NH3+])CC2CCCCC2)cc1 ZINC000832282023 1034699392 /nfs/dbraw/zinc/69/93/92/1034699392.db2.gz XHMAOAZMUGFFHI-UYAOXDASSA-N 2 0 360.546 2.947 20 10 FFCDRP COc1cc(C[NH+]2CCC(Oc3ccccn3)CC2)cc(C[NH+](C)C)c1O ZINC001139256697 1035029815 /nfs/dbraw/zinc/02/98/15/1035029815.db2.gz HQASADFBEBDQFW-UHFFFAOYSA-N 2 0 371.481 2.901 20 10 FFCDRP COc1cc(C[NH+]2CCC(Oc3ccncc3)CC2)cc(C[NH+](C)C)c1O ZINC001139256140 1035030016 /nfs/dbraw/zinc/03/00/16/1035030016.db2.gz UYDHIDXJSRYTQK-UHFFFAOYSA-N 2 0 371.481 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC(F)(F)CO4)CC3)cc2)CC1 ZINC001139409267 1035093677 /nfs/dbraw/zinc/09/36/77/1035093677.db2.gz YQHMGFQBDZJPSO-UHFFFAOYSA-N 2 0 365.468 2.829 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cccc(O)c43)cn2)CC1 ZINC000834514687 1035402606 /nfs/dbraw/zinc/40/26/06/1035402606.db2.gz VWCMDERAKDZPEC-SFHVURJKSA-N 2 0 352.482 2.706 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ccn(C)n4)CC3)cc2)CC1 ZINC001140305668 1035427456 /nfs/dbraw/zinc/42/74/56/1035427456.db2.gz FFZMIJPFSRRBPC-UHFFFAOYSA-N 2 0 367.541 2.942 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4nc(C)no4)C3)cc2)CC1 ZINC001140306608 1035427969 /nfs/dbraw/zinc/42/79/69/1035427969.db2.gz VIJMFCSBPQEXKO-GOSISDBHSA-N 2 0 355.486 2.509 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)[C@@H]3CCC4(C3)OCCO4)cc2)CC1 ZINC001140309731 1035429463 /nfs/dbraw/zinc/42/94/63/1035429463.db2.gz RZMVPMFNZFUDDQ-HXUWFJFHSA-N 2 0 359.514 2.556 20 10 FFCDRP CCCCOC(=O)[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140309319 1035429582 /nfs/dbraw/zinc/42/95/82/1035429582.db2.gz BDWRCEOIWJVUQJ-FQEVSTJZSA-N 2 0 373.541 2.994 20 10 FFCDRP COc1ccc2ccc(O)c(C[N@@H+]3CC[C@H]4[C@H]3CCN4CC[NH+](C)C)c2c1 ZINC001234546083 1037080666 /nfs/dbraw/zinc/08/06/66/1037080666.db2.gz YUZOCJPBJVZEJC-LEWJYISDSA-N 2 0 369.509 2.764 20 10 FFCDRP COc1ccc2ccc(O)c(C[NH+]3CCN(CC[NH+]4CCCC4)CC3)c2c1 ZINC001234562463 1037091523 /nfs/dbraw/zinc/09/15/23/1037091523.db2.gz OBCSAZIJYAWVPE-UHFFFAOYSA-N 2 0 369.509 2.767 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)CCN1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715893 1037709062 /nfs/dbraw/zinc/70/90/62/1037709062.db2.gz XDLHRZVYNXXGFY-HXUWFJFHSA-N 2 0 364.537 2.803 20 10 FFCDRP Cc1cccc(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)c1C ZINC001235865400 1037803945 /nfs/dbraw/zinc/80/39/45/1037803945.db2.gz DGNIBTKCUWBBNP-UHFFFAOYSA-N 2 0 367.493 2.813 20 10 FFCDRP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cc(OCc2ccccc2)ccc1O ZINC001236790621 1038271783 /nfs/dbraw/zinc/27/17/83/1038271783.db2.gz XSAMFLIYIORVMN-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN(C3CCC3)[C@H]3CCC[NH2+]C3)c(F)c2)CC1 ZINC001237157618 1038457712 /nfs/dbraw/zinc/45/77/12/1038457712.db2.gz TYUMDELHHOOKDQ-FQEVSTJZSA-N 2 0 360.521 2.684 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001209845936 1039260456 /nfs/dbraw/zinc/26/04/56/1039260456.db2.gz PNLLZHHCGKZLCR-NRFANRHFSA-N 2 0 359.514 2.652 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCC[N@@H+]([C@H]4CC[NH2+][C@@H](C)C4)C3)C2)cc1 ZINC001246701986 1039441461 /nfs/dbraw/zinc/44/14/61/1039441461.db2.gz JQPWEGGSBQMSNI-VCOUNFBDSA-N 2 0 373.541 2.755 20 10 FFCDRP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465264 1039474077 /nfs/dbraw/zinc/47/40/77/1039474077.db2.gz WHNDRRZDBQZLKO-QFIPXVFZSA-N 2 0 357.542 2.956 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CC[NH+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552546 /nfs/dbraw/zinc/55/25/46/1039552546.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 3 0 356.558 2.746 20 10 FFCDRP Cc1ccc(OC[C@@H](O)C[NH2+]C2CC[NH+](Cc3ccccc3O)CC2)cc1 ZINC001253846734 1040408912 /nfs/dbraw/zinc/40/89/12/1040408912.db2.gz DXVWFTSEVPKUMJ-FQEVSTJZSA-N 2 0 370.493 2.695 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)COc2cccc(F)c2)CC1 ZINC001250828783 1041387630 /nfs/dbraw/zinc/38/76/30/1041387630.db2.gz MDLKTUURQNILRG-IBGZPJMESA-N 2 0 374.456 2.525 20 10 FFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001279533063 1043232121 /nfs/dbraw/zinc/23/21/21/1043232121.db2.gz BXILWFYJCVWTSA-VXKWHMMOSA-N 2 0 356.558 2.887 20 10 FFCDRP Cc1c(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)c2ccccc2n1C ZINC001279542503 1043238074 /nfs/dbraw/zinc/23/80/74/1043238074.db2.gz XSVGAYXZJCRLSA-UHFFFAOYSA-N 2 0 354.542 2.946 20 10 FFCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@H]2CC1 ZINC001279547261 1043241562 /nfs/dbraw/zinc/24/15/62/1043241562.db2.gz BOMNHCMJXVYSAK-HDICACEKSA-N 2 0 355.526 2.865 20 10 FFCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 ZINC001200231506 1056102061 /nfs/dbraw/zinc/10/20/61/1056102061.db2.gz CVJDCOZBHPWNSS-UHFFFAOYSA-N 2 0 362.537 2.789 20 10 FFCDRP COc1c([O-])c(C[N@@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463772 1061634624 /nfs/dbraw/zinc/63/46/24/1061634624.db2.gz WHQWJVJERGETJW-UKRRQHHQSA-N 2 0 351.447 2.861 20 10 FFCDRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccccc1O ZINC000156633097 508453866 /nfs/dbraw/zinc/45/38/66/508453866.db2.gz MPZBXBZCODEMKI-IBGZPJMESA-N 2 0 355.482 2.925 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000158457710 508706639 /nfs/dbraw/zinc/70/66/39/508706639.db2.gz PXJXCCXAODODNM-QGZVFWFLSA-N 2 0 353.514 2.750 20 10 FFCDRP CCCOc1ccc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(O)c1 ZINC000179517236 509491598 /nfs/dbraw/zinc/49/15/98/509491598.db2.gz VUNSKTKDUDHJHS-MRXNPFEDSA-N 2 0 350.503 2.706 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(Br)cc2O)CC1 ZINC000185014182 510634993 /nfs/dbraw/zinc/63/49/93/510634993.db2.gz HPTVUEJSVDURRF-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP C[NH+](C)CCOC1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000738207039 735024839 /nfs/dbraw/zinc/02/48/39/735024839.db2.gz DMSNYNNSNRXEAZ-UHFFFAOYSA-N 2 0 350.503 2.938 20 10 FFCDRP CC[C@@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817972132 742225426 /nfs/dbraw/zinc/22/54/26/742225426.db2.gz KBYRPZONMAYCID-HIFRSBDPSA-N 2 0 365.827 2.922 20 10 FFCDRP COCC1(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC[NH2+]CC1 ZINC000841068453 747263102 /nfs/dbraw/zinc/26/31/02/747263102.db2.gz PGVJMKKSRZEBGQ-UHFFFAOYSA-N 2 0 359.436 2.877 20 10 FFCDRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000841099518 747268802 /nfs/dbraw/zinc/26/88/02/747268802.db2.gz KIVZMHRCLFCQHD-RDJZCZTQSA-N 2 0 369.303 2.873 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902495 748131952 /nfs/dbraw/zinc/13/19/52/748131952.db2.gz OABNKSZPCOYCAH-MAZHCROVSA-N 2 0 354.878 2.773 20 10 FFCDRP COc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1OC ZINC000893306287 971482219 /nfs/dbraw/zinc/48/22/19/971482219.db2.gz YSIHCQNZSKWYSQ-UHFFFAOYSA-N 2 0 357.454 2.811 20 10 FFCDRP CC[C@@H]([NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1)c1ccc(C)cc1O ZINC000840830374 973396907 /nfs/dbraw/zinc/39/69/07/973396907.db2.gz FBFFVTBYMBKNBI-LJQANCHMSA-N 2 0 361.530 2.538 20 10 FFCDRP C[NH2+]Cc1ccc(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC000904513398 980290860 /nfs/dbraw/zinc/29/08/60/980290860.db2.gz DJALOXFIOWVNOU-FQEVSTJZSA-N 2 0 369.513 2.896 20 10 FFCDRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921979181 987430325 /nfs/dbraw/zinc/43/03/25/987430325.db2.gz DECPIWHOVHJUAO-NRFANRHFSA-N 2 0 352.478 2.868 20 10 FFCDRP C[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1O ZINC000879649162 1015625312 /nfs/dbraw/zinc/62/53/12/1015625312.db2.gz NEKLJAPOLUFSCI-QGZVFWFLSA-N 2 0 367.493 2.955 20 10 FFCDRP CN(C)C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000808426410 994109829 /nfs/dbraw/zinc/10/98/29/994109829.db2.gz SBQXHMCULNNBAT-QFIPXVFZSA-N 2 0 370.516 2.970 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c(O)c1 ZINC001206084537 1032137105 /nfs/dbraw/zinc/13/71/05/1032137105.db2.gz LURVUYZGIYEBQA-UHFFFAOYSA-N 2 0 359.470 2.725 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@H](c4ccncc4)C3)cc2)CC1 ZINC000824955705 997156372 /nfs/dbraw/zinc/15/63/72/997156372.db2.gz YOBNHAVZSKAMEY-UNMCSNQZSA-N 2 0 366.509 2.843 20 10 FFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H](O)[C@@H]([NH3+])Cc2ccccc2)cc1 ZINC000844220522 997710785 /nfs/dbraw/zinc/71/07/85/997710785.db2.gz GNEANMRLVFBXBV-VXKWHMMOSA-N 2 0 355.526 2.896 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1O ZINC000846166540 1000215091 /nfs/dbraw/zinc/21/50/91/1000215091.db2.gz YZLRJICRDJIKTO-QAPCUYQASA-N 2 0 356.466 2.818 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(Br)c1 ZINC001205654895 1004669255 /nfs/dbraw/zinc/66/92/55/1004669255.db2.gz XZRQWSXLBAELNQ-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCN(c4ccc(F)cc4)CC3)cc2)CC1 ZINC000775639335 1004896873 /nfs/dbraw/zinc/89/68/73/1004896873.db2.gz UHOLVAACDLCGIW-UHFFFAOYSA-N 2 0 368.500 2.900 20 10 FFCDRP COc1cc(C[NH2+]CCCC[NH+]2CCN(C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850029532 1005779668 /nfs/dbraw/zinc/77/96/68/1005779668.db2.gz APOXODGZYAUEIS-UHFFFAOYSA-N 2 0 363.546 2.816 20 10 FFCDRP CCCn1nccc1C[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000850127197 1005788202 /nfs/dbraw/zinc/78/82/02/1005788202.db2.gz UWZLIJGFCPNSHC-UHFFFAOYSA-N 2 0 359.493 2.864 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000850357755 1005810942 /nfs/dbraw/zinc/81/09/42/1005810942.db2.gz ULRBINCKYKMRBP-IBGZPJMESA-N 2 0 357.473 2.748 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCC4(CCOCC4)CO3)cc2)CC1 ZINC000883255524 1006719386 /nfs/dbraw/zinc/71/93/86/1006719386.db2.gz YFQXIFXWLMSYMG-NRFANRHFSA-N 2 0 373.541 2.504 20 10 FFCDRP CCOC(=O)[C@@]1(C(C)C)CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775199887 1006734915 /nfs/dbraw/zinc/73/49/15/1006734915.db2.gz HEUBRONNNXPHRC-QFIPXVFZSA-N 2 0 373.541 2.850 20 10 FFCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 ZINC000817889964 1007796328 /nfs/dbraw/zinc/79/63/28/1007796328.db2.gz QYYGMYGRXAQPHC-MISYRCLQSA-N 2 0 372.557 2.789 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942906 1007818459 /nfs/dbraw/zinc/81/84/59/1007818459.db2.gz RMRASBAXCXJMNN-RZUBCFFCSA-N 3 0 366.509 2.598 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccccc3)cc2F)CC1 ZINC000819033127 1008027998 /nfs/dbraw/zinc/02/79/98/1008027998.db2.gz NQIIOBSAICYJQX-OAQYLSRUSA-N 2 0 357.473 2.791 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)cc2)CC1 ZINC000777439482 1011292684 /nfs/dbraw/zinc/29/26/84/1011292684.db2.gz HZSPTAAADDUHKZ-QFIPXVFZSA-N 2 0 369.484 2.671 20 10 FFCDRP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1cc(Cl)ccc1O ZINC001275248686 1012139954 /nfs/dbraw/zinc/13/99/54/1012139954.db2.gz QSGIPYHHJQYNNV-LJQANCHMSA-N 2 0 365.905 2.564 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc2c(cc1O)CCCC2 ZINC000925855602 1017877706 /nfs/dbraw/zinc/87/77/06/1017877706.db2.gz LAHPXTVNWMQQKS-PBHICJAKSA-N 2 0 358.482 2.607 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321205 1032890370 /nfs/dbraw/zinc/89/03/70/1032890370.db2.gz RRVTXMSPGFHVLM-OAQYLSRUSA-N 2 0 360.521 2.686 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)c1 ZINC001116564935 1021285910 /nfs/dbraw/zinc/28/59/10/1021285910.db2.gz BMZSWVLAAJOWPD-QGZVFWFLSA-N 2 0 369.509 2.999 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C(=O)NCC[NH+](C)C ZINC000756858419 1023760309 /nfs/dbraw/zinc/76/03/09/1023760309.db2.gz PGWHTHSCBSSOBL-KBMXLJTQSA-N 2 0 365.493 2.762 20 10 FFCDRP COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000779605189 1024255509 /nfs/dbraw/zinc/25/55/09/1024255509.db2.gz RLEQGCFPSNMJGN-LJQANCHMSA-N 2 0 373.541 2.850 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000840939721 1029934079 /nfs/dbraw/zinc/93/40/79/1029934079.db2.gz OWGVXKJKYSQQNF-UHFFFAOYSA-N 2 0 358.574 2.911 20 10 FFCDRP CO[C@@]1(C(F)(F)F)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000783718267 1030250021 /nfs/dbraw/zinc/25/00/21/1030250021.db2.gz PUPMHLUVUUBLPL-SFHVURJKSA-N 2 0 371.447 2.982 20 10 FFCDRP CCOC(=O)[C@H]1CCC[N@@H+](C2CCN(Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001203931043 1030990896 /nfs/dbraw/zinc/99/08/96/1030990896.db2.gz MJLXPJQKVZGSBP-IBGZPJMESA-N 2 0 373.541 2.992 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000843341542 1031337220 /nfs/dbraw/zinc/33/72/20/1031337220.db2.gz UOFBLEWLWWXPAO-YPAWHYETSA-N 3 0 368.569 2.696 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205635925 1031893803 /nfs/dbraw/zinc/89/38/03/1031893803.db2.gz BGNCFBUENKCFOY-NVXWUHKLSA-N 2 0 351.922 2.983 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(I)cc2O)CC[C@H]1C[NH3+] ZINC001205637831 1031894792 /nfs/dbraw/zinc/89/47/92/1031894792.db2.gz JESIJSXGXOCVFN-NEPJUHHUSA-N 2 0 374.266 2.804 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@H]1C[NH3+] ZINC001205654149 1031907833 /nfs/dbraw/zinc/90/78/33/1031907833.db2.gz WOHLPRFDPMFMDS-CVEARBPZSA-N 2 0 351.922 2.983 20 10 FFCDRP CC[N@H+](C)[C@@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281725 1034698821 /nfs/dbraw/zinc/69/88/21/1034698821.db2.gz VWJSDHRARUKKQD-WOJBJXKFSA-N 2 0 354.498 2.562 20 10 FFCDRP COc1cc(C[N@H+](CCO)Cc2cccs2)cc(C[NH+](C)C)c1O ZINC001139256448 1035029898 /nfs/dbraw/zinc/02/98/98/1035029898.db2.gz BSKLXLVPVYUNMF-UHFFFAOYSA-N 2 0 350.484 2.518 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139257152 1035030278 /nfs/dbraw/zinc/03/02/78/1035030278.db2.gz SYUNZCBSRFSOQR-HNNXBMFYSA-N 2 0 364.486 2.626 20 10 FFCDRP CCCCOC(=O)[C@@H]1CC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259677 1035031292 /nfs/dbraw/zinc/03/12/92/1035031292.db2.gz AOJQUJQEGJVFJC-MRXNPFEDSA-N 2 0 364.486 2.628 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@]1(O)C(F)(F)F ZINC001139408739 1035092156 /nfs/dbraw/zinc/09/21/56/1035092156.db2.gz PWFNIOSZSKAOSX-CRAIPNDOSA-N 2 0 371.447 2.574 20 10 FFCDRP CCOCC[NH+](CCOCC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304654 1035426266 /nfs/dbraw/zinc/42/62/66/1035426266.db2.gz XMLASXDTCFAKQC-UHFFFAOYSA-N 2 0 363.546 2.704 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@H]([NH+]4CCCC4)[C@@H](F)C3)cc2)CC1 ZINC001140306610 1035428240 /nfs/dbraw/zinc/42/82/40/1035428240.db2.gz STESXLOFDJDWQE-VXKWHMMOSA-N 2 0 374.548 2.837 20 10 FFCDRP C[C@@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000835027012 1035490145 /nfs/dbraw/zinc/49/01/45/1035490145.db2.gz AMWWEHWDWUPANB-TZJSGOIRSA-N 2 0 356.558 2.724 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCCC[NH2+]4)CC3)cc2)CC1 ZINC001235229162 1037424169 /nfs/dbraw/zinc/42/41/69/1037424169.db2.gz OOHWTQRGCDCUPK-QFIPXVFZSA-N 3 0 356.558 2.793 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCC[N@H+](CC4CC[NH2+]CC4)C3)C2)cc1 ZINC001207435382 1037438111 /nfs/dbraw/zinc/43/81/11/1037438111.db2.gz MXWMAONNDUNJCI-QFIPXVFZSA-N 2 0 373.541 2.614 20 10 FFCDRP Cc1cccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3C(C)C)C2)c1O ZINC001231592974 1037711459 /nfs/dbraw/zinc/71/14/59/1037711459.db2.gz QWZDZCAPNJZTGG-AABGKKOBSA-N 2 0 369.513 2.666 20 10 FFCDRP [NH3+]C1CN([C@@H]2CCC[N@H+](Cc3cc(-c4ccc(F)cc4)ccc3O)C2)C1 ZINC001236077490 1037921269 /nfs/dbraw/zinc/92/12/69/1037921269.db2.gz IFVOCQRETYESPV-HXUWFJFHSA-N 2 0 355.457 2.806 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN(CC[NH3+])Cc3ccccc3)cc2)CC1 ZINC001236521308 1038117713 /nfs/dbraw/zinc/11/77/13/1038117713.db2.gz KKWDQCONIDNWLN-UHFFFAOYSA-N 2 0 352.526 2.789 20 10 FFCDRP COc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)c(O)cc1Br ZINC001236752902 1038237629 /nfs/dbraw/zinc/23/76/29/1038237629.db2.gz IILAQYHKCXBOND-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN(C3CCC3)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155897 1038456324 /nfs/dbraw/zinc/45/63/24/1038456324.db2.gz USTAPJDURWXXFU-QFIPXVFZSA-N 2 0 356.558 2.935 20 10 FFCDRP CC[C@H](Cc1ccc2c(c1)OCO2)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246176907 1039266752 /nfs/dbraw/zinc/26/67/52/1039266752.db2.gz YFFVDLKYRVRCGT-LJQANCHMSA-N 2 0 367.493 2.936 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@H]4CC[C@@H](C)[NH2+]C4)C3)C2)cc1 ZINC001246707124 1039443674 /nfs/dbraw/zinc/44/36/74/1039443674.db2.gz ZAKCDAUNDLTJBL-CBQOVEMMSA-N 2 0 373.541 2.755 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)c2ccc(F)c(F)c2)CC1 ZINC001253377789 1040142313 /nfs/dbraw/zinc/14/23/13/1040142313.db2.gz WMUTUBPZWBAHKD-HXUWFJFHSA-N 2 0 362.420 2.958 20 10 FFCDRP COc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4cn[nH]c4)(C2)CCC3)c(O)c1 ZINC001278580126 1041246576 /nfs/dbraw/zinc/24/65/76/1041246576.db2.gz WUZLYYAJTMGZFK-UXHICEINSA-N 2 0 356.470 2.849 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CCC[N@H+](Cc1cc(C(F)(F)F)ccc1O)C2 ZINC001279686297 1043467060 /nfs/dbraw/zinc/46/70/60/1043467060.db2.gz TYRBLZPPWSNGDE-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)cc2F)CC1 ZINC001330781283 1049324241 /nfs/dbraw/zinc/32/42/41/1049324241.db2.gz WFMGPEBJQWMGIH-HXUWFJFHSA-N 2 0 374.548 2.789 20 10 FFCDRP Cn1cnc2cc(C[NH2+]Cc3ccc(N4CCN(C)CC4)c(F)c3)ccc21 ZINC001339895248 1050310356 /nfs/dbraw/zinc/31/03/56/1050310356.db2.gz HQBKPPYWZZXBDL-UHFFFAOYSA-N 2 0 367.472 2.754 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)CC[C@@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001343047087 1051663387 /nfs/dbraw/zinc/66/33/87/1051663387.db2.gz IVEFZUUJMRHHRZ-RTWAWAEBSA-N 2 0 368.525 2.952 20 10 FFCDRP C[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[C@H]([NH3+])c1ccccc1 ZINC001343048094 1051664942 /nfs/dbraw/zinc/66/49/42/1051664942.db2.gz SSEITVYFIFBHHD-DQLDELGASA-N 2 0 368.525 2.808 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)C2C[NH+](C3CCCCC3)C2)[NH+](C)C)cc1 ZINC001456934635 1060231457 /nfs/dbraw/zinc/23/14/57/1060231457.db2.gz PMDGOTRNJKXGIX-NRFANRHFSA-N 2 0 372.557 2.736 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCc2ccc(N3CC[NH+](C)CC3)cc2)cc1F ZINC001461834762 1061421533 /nfs/dbraw/zinc/42/15/33/1061421533.db2.gz WLEHTSXWBSWTOO-UHFFFAOYSA-N 2 0 370.516 2.976 20 10 FFCDRP CCC[NH2+][C@H](C)C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551310 1078375686 /nfs/dbraw/zinc/37/56/86/1078375686.db2.gz OSIAMALYUUOUDH-CZUORRHYSA-N 2 0 353.894 2.514 20 10 FFCDRP CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722857 1076063602 /nfs/dbraw/zinc/06/36/02/1076063602.db2.gz DFEIEGXJVXGLSG-ICSRJNTNSA-N 2 0 360.546 2.594 20 10 FFCDRP COc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1OC ZINC001560247909 1076256726 /nfs/dbraw/zinc/25/67/26/1076256726.db2.gz KJEQZUPXEZOLIG-UHFFFAOYSA-N 2 0 369.509 2.788 20 10 FFCDRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(Br)ccc1O ZINC000185366625 510824146 /nfs/dbraw/zinc/82/41/46/510824146.db2.gz ABAPROIKDFGIPS-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP CCOCc1cc(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)ccc1OC ZINC000277696789 510969106 /nfs/dbraw/zinc/96/91/06/510969106.db2.gz HTEPNUXFRYOUQE-QGZVFWFLSA-N 2 0 350.503 2.822 20 10 FFCDRP Cc1cc(Br)cc(C[N@H+](C)CCCN2CC[NH+](C)CC2)c1O ZINC000289439128 511102330 /nfs/dbraw/zinc/10/23/30/511102330.db2.gz LRLTTZTWEKCLBR-UHFFFAOYSA-N 2 0 370.335 2.532 20 10 FFCDRP CCOc1cccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000271232793 511131635 /nfs/dbraw/zinc/13/16/35/511131635.db2.gz VDNOSGYDGSJZJF-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CC2(O)CC[NH+](C)CC2)c1O ZINC000275300012 512098992 /nfs/dbraw/zinc/09/89/92/512098992.db2.gz HVTTWJVUYCLDIF-GFCCVEGCSA-N 2 0 357.292 2.570 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH+]2CCCC2)C1 ZINC000443916769 514071366 /nfs/dbraw/zinc/07/13/66/514071366.db2.gz BTLGMBHHNRKLHL-UHFFFAOYSA-N 2 0 368.525 2.620 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[NH+]2C)C1 ZINC000444236040 514164244 /nfs/dbraw/zinc/16/42/44/514164244.db2.gz KAZPNBIHPQSRLI-QGZVFWFLSA-N 2 0 368.525 2.618 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1O ZINC000841090497 747266577 /nfs/dbraw/zinc/26/65/77/747266577.db2.gz ZPQLABPGGVTLTL-CYBMUJFWSA-N 2 0 355.276 2.928 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c1O ZINC000843126920 747777682 /nfs/dbraw/zinc/77/76/82/747777682.db2.gz NIKGCMNJEKOXOC-ZDUSSCGKSA-N 2 0 369.303 2.985 20 10 FFCDRP Cc1cc(Br)cc(C[NH+]2CCC([C@@H]3OCC[C@H]3[NH3+])CC2)c1O ZINC000843124642 747777836 /nfs/dbraw/zinc/77/78/36/747777836.db2.gz DZOSJVSDMGVMHB-WBVHZDCISA-N 2 0 369.303 2.791 20 10 FFCDRP Cn1ccc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000896492332 971510457 /nfs/dbraw/zinc/51/04/57/971510457.db2.gz CBHSFMNINYNLQD-LJQANCHMSA-N 2 0 353.514 2.552 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)c2sccc2C[NH+](C)C)[NH+](C)C)cc1 ZINC000891251843 962603660 /nfs/dbraw/zinc/60/36/60/962603660.db2.gz HMBACEAIRWARKF-GOSISDBHSA-N 2 0 374.554 2.908 20 10 FFCDRP CCOC(=O)C(=Cc1cc(C)c(C)nc1NC(=[NH2+])NCCCC[NH3+])N=[N+]=[N-] ZINC001167878062 977168866 /nfs/dbraw/zinc/16/88/66/977168866.db2.gz OIGGCPVSPXHJGV-UVTDQMKNSA-N 2 0 374.449 2.588 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206027864 1032114217 /nfs/dbraw/zinc/11/42/17/1032114217.db2.gz WZRJOWQKLFFCQU-CVEARBPZSA-N 2 0 351.922 2.983 20 10 FFCDRP Cn1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C(C)(C)C)n1 ZINC000883283674 1006730642 /nfs/dbraw/zinc/73/06/42/1006730642.db2.gz NZLWUBIQWIHBEG-UHFFFAOYSA-N 2 0 355.530 2.759 20 10 FFCDRP CC[C@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1ccc(N(C)C)cc1 ZINC000854231622 1006733935 /nfs/dbraw/zinc/73/39/35/1006733935.db2.gz MWQGKNAZCPFRBQ-FQEVSTJZSA-N 2 0 360.546 2.784 20 10 FFCDRP O=c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c[nH]1 ZINC000865517511 1010804041 /nfs/dbraw/zinc/80/40/41/1010804041.db2.gz VXTVBDJTXHQJII-UHFFFAOYSA-N 2 0 352.482 2.609 20 10 FFCDRP Cc1cc(C)cc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000800896596 1020632092 /nfs/dbraw/zinc/63/20/92/1020632092.db2.gz NOLZNXBEGYQGHQ-JOCHJYFZSA-N 2 0 353.510 2.878 20 10 FFCDRP COC(=O)[C@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779431771 1023843213 /nfs/dbraw/zinc/84/32/13/1023843213.db2.gz DQYYZINGBRURDW-CTNGQTDRSA-N 2 0 359.514 2.650 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3ccc(C)c(N)[nH+]3)CC2)cc1 ZINC001164329571 1029247917 /nfs/dbraw/zinc/24/79/17/1029247917.db2.gz CICNBBKJBKVLSM-UHFFFAOYSA-N 2 0 355.486 2.605 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001157435660 1029585767 /nfs/dbraw/zinc/58/57/67/1029585767.db2.gz UUKLSYLLPZVZDY-APWZRJJASA-N 2 0 371.525 2.623 20 10 FFCDRP COc1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c(O)c1 ZINC001203622818 1030792959 /nfs/dbraw/zinc/79/29/59/1030792959.db2.gz CBBFEXPWCZHTTJ-UHFFFAOYSA-N 2 0 370.497 2.642 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753578 1030906951 /nfs/dbraw/zinc/90/69/51/1030906951.db2.gz FKYFNVLBFUAYAN-HMXCVIKNSA-N 3 0 374.548 2.930 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccc(=O)[nH]n1 ZINC000796854749 1030935896 /nfs/dbraw/zinc/93/58/96/1030935896.db2.gz CFBUVIBVYQFSIT-INIZCTEOSA-N 2 0 367.497 2.565 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128884 1031196721 /nfs/dbraw/zinc/19/67/21/1031196721.db2.gz YIXGTLZIKMJBAJ-RBUKOAKNSA-N 2 0 361.505 2.874 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000798271620 1031352912 /nfs/dbraw/zinc/35/29/12/1031352912.db2.gz CHQOAMPIIJEOTD-GOSISDBHSA-N 2 0 374.529 2.537 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@]1(O)CCc2ccccc21 ZINC000843420609 1031394089 /nfs/dbraw/zinc/39/40/89/1031394089.db2.gz IVXFMVCTGUEUOX-HSZRJFAPSA-N 2 0 365.521 2.704 20 10 FFCDRP [NH3+]C[C@@]1(O)CCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001205247359 1031624598 /nfs/dbraw/zinc/62/45/98/1031624598.db2.gz FQHOGIGKXHWQJY-OAQYLSRUSA-N 2 0 356.466 2.647 20 10 FFCDRP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001205725002 1031956345 /nfs/dbraw/zinc/95/63/45/1031956345.db2.gz BYCDHNHYOXWQQM-OAQYLSRUSA-N 2 0 356.466 2.647 20 10 FFCDRP COc1cc(CN2CCCC[C@H]2C[NH+]2CCCC2)cc(C[NH+](C)C)c1O ZINC001139256707 1035029838 /nfs/dbraw/zinc/02/98/38/1035029838.db2.gz HUFNMFIECPMSLX-IBGZPJMESA-N 2 0 361.530 2.913 20 10 FFCDRP COc1cc(CN2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257662 1035032285 /nfs/dbraw/zinc/03/22/85/1035032285.db2.gz ZWVBASAIUOHLQJ-HXUWFJFHSA-N 2 0 369.509 2.951 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC001140300792 1035424027 /nfs/dbraw/zinc/42/40/27/1035424027.db2.gz UIGIFWYKKJMAPK-UHFFFAOYSA-N 3 0 365.525 2.546 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4ccccn4)C3)cc2)CC1 ZINC001140309340 1035429451 /nfs/dbraw/zinc/42/94/51/1035429451.db2.gz BRXWUIHTKJMARA-NRFANRHFSA-N 2 0 366.509 2.877 20 10 FFCDRP c1cn2c(n1)[C@H](NCc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CC2 ZINC000834697337 1035431271 /nfs/dbraw/zinc/43/12/71/1035431271.db2.gz ITEZOYDZSWHYPB-HXUWFJFHSA-N 2 0 351.498 2.650 20 10 FFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC001232363735 1035625527 /nfs/dbraw/zinc/62/55/27/1035625527.db2.gz OIUFCDWDJOEKJW-UHFFFAOYSA-N 2 0 367.541 2.922 20 10 FFCDRP Oc1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)cc(O)c1O ZINC001233012231 1036245498 /nfs/dbraw/zinc/24/54/98/1036245498.db2.gz KAQIXSQYTUYBIQ-UHFFFAOYSA-N 2 0 358.438 2.885 20 10 FFCDRP CC[NH+]1CCN(c2ccc(OC[C@@H]3CCC4(CC[NH+](C)CC4)O3)cc2)CC1 ZINC001234657904 1037127408 /nfs/dbraw/zinc/12/74/08/1037127408.db2.gz LVLLZMXEURCAGK-NRFANRHFSA-N 2 0 373.541 2.851 20 10 FFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)cc1Cl ZINC001235717515 1037709607 /nfs/dbraw/zinc/70/96/07/1037709607.db2.gz HQIZTQUUJGJLOA-UHFFFAOYSA-N 2 0 351.922 2.998 20 10 FFCDRP COC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cc(C)cc3O)CC2)C1 ZINC001231850695 1037945603 /nfs/dbraw/zinc/94/56/03/1037945603.db2.gz UCDHNBZNWQAYAI-KRWDZBQOSA-N 2 0 360.498 2.858 20 10 FFCDRP Cc1cccc(C)c1N1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001236434305 1038089458 /nfs/dbraw/zinc/08/94/58/1038089458.db2.gz QFOHKTYHBNAKMO-UHFFFAOYSA-N 2 0 367.493 2.813 20 10 FFCDRP C[NH+](C)CCN(Cc1cc2c3c(c1)CCCN3CCC2)[C@@H]1CCC[NH2+]C1 ZINC001236932829 1038364962 /nfs/dbraw/zinc/36/49/62/1038364962.db2.gz OEIJGRBBJPFFQK-OAQYLSRUSA-N 2 0 356.558 2.501 20 10 FFCDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246173964 1039266447 /nfs/dbraw/zinc/26/64/47/1039266447.db2.gz OFLYJSGBQOTEKK-MRXNPFEDSA-N 2 0 354.454 2.725 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H]3CC[NH2+][C@H](C(C)C)C3)CC2)cc1 ZINC001246185118 1039267611 /nfs/dbraw/zinc/26/76/11/1039267611.db2.gz SFBFQWJTAWPANX-KNQAVFIVSA-N 2 0 374.573 2.574 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC12C[NH2+]C2 ZINC001237432981 1043157874 /nfs/dbraw/zinc/15/78/74/1043157874.db2.gz YOLJKTQSOMCUHW-KRWDZBQOSA-N 2 0 360.498 2.664 20 10 FFCDRP C[NH+]1CCC2(CC1)C[N@H+](Cc1cc(O)c(O)cc1O)Cc1ccccc12 ZINC001279515765 1043212293 /nfs/dbraw/zinc/21/22/93/1043212293.db2.gz XJVPGIYTNSOGTN-UHFFFAOYSA-N 2 0 354.450 2.783 20 10 FFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC001320425412 1045406370 /nfs/dbraw/zinc/40/63/70/1045406370.db2.gz YCZXFRUDEKYWDI-BBWFWOEESA-N 2 0 361.530 2.931 20 10 FFCDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CCN(C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919360 1048094484 /nfs/dbraw/zinc/09/44/84/1048094484.db2.gz ZPIXTBBLVVSNJG-KRWDZBQOSA-N 3 0 360.521 2.542 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353545 1048681696 /nfs/dbraw/zinc/68/16/96/1048681696.db2.gz FZRKCYQTQLDXDM-HXUWFJFHSA-N 2 0 374.548 2.789 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@H](O)c1ccccc1 ZINC001329836872 1048933582 /nfs/dbraw/zinc/93/35/82/1048933582.db2.gz YROIZRHEFKQYER-KKSFZXQISA-N 2 0 357.473 2.789 20 10 FFCDRP Cc1noc(C)c1C[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001200639711 1058902112 /nfs/dbraw/zinc/90/21/12/1058902112.db2.gz JSSAYHUIOPZJKL-CQSZACIVSA-N 2 0 360.477 2.903 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(NC(N)=O)cc1 ZINC001461197070 1061247894 /nfs/dbraw/zinc/24/78/94/1061247894.db2.gz RRWXJWPXFIXATD-INIZCTEOSA-N 2 0 367.497 2.780 20 10 FFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001462191186 1061532227 /nfs/dbraw/zinc/53/22/27/1061532227.db2.gz IASLJIKSPZPYQP-KRWDZBQOSA-N 2 0 368.516 2.879 20 10 FFCDRP C[C@@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001472281309 1064998162 /nfs/dbraw/zinc/99/81/62/1064998162.db2.gz VBFIUUQCQZBJNV-CLWJZODNSA-N 2 0 360.546 2.733 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC001474333613 1065495902 /nfs/dbraw/zinc/49/59/02/1065495902.db2.gz QZSWPYVAIUEZFV-ROUUACIJSA-N 2 0 361.530 2.700 20 10 FFCDRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000158457608 508706653 /nfs/dbraw/zinc/70/66/53/508706653.db2.gz PXJXCCXAODODNM-KRWDZBQOSA-N 2 0 353.514 2.750 20 10 FFCDRP CC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000192924163 509699865 /nfs/dbraw/zinc/69/98/65/509699865.db2.gz PNAJCTNISUZQDQ-INIZCTEOSA-N 2 0 370.335 2.833 20 10 FFCDRP C[NH+]1CCC(O)(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC000273154589 511519625 /nfs/dbraw/zinc/51/96/25/511519625.db2.gz ISINWSOERADTLJ-UHFFFAOYSA-N 2 0 356.466 2.518 20 10 FFCDRP CCOc1cccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000363870048 511819127 /nfs/dbraw/zinc/81/91/27/511819127.db2.gz STCXKJOJUFRJIO-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP [NH3+]CCCOCC[NH2+]Cc1ccc(N2CCCCC2)c(Br)c1 ZINC000863649746 730798865 /nfs/dbraw/zinc/79/88/65/730798865.db2.gz HNQUKMXWRJQFSY-UHFFFAOYSA-N 2 0 370.335 2.894 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCN(c4cccs4)CC3)cc2)CC1 ZINC000775722951 738117470 /nfs/dbraw/zinc/11/74/70/738117470.db2.gz AQEIODGEERSFCB-UHFFFAOYSA-N 2 0 356.539 2.822 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCCC[NH+]2CCOCC2)c(C(F)(F)F)c1 ZINC000792917815 739718520 /nfs/dbraw/zinc/71/85/20/739718520.db2.gz LOEZHRLLKQFCIL-UHFFFAOYSA-N 2 0 359.436 2.973 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H](C(N)=O)C2)c1O ZINC000808693096 741252615 /nfs/dbraw/zinc/25/26/15/741252615.db2.gz WAPVYKFEGHJBID-KBPBESRZSA-N 2 0 353.894 2.592 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC2CC[NH+](C[C@@H]3CCCO3)CC2)[NH+](C)C)cc1 ZINC000898448141 976460103 /nfs/dbraw/zinc/46/01/03/976460103.db2.gz PYAFZLHTRZLDTB-FCHUYYIVSA-N 2 0 374.573 2.588 20 10 FFCDRP CCn1nc(C)c(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC000877664613 1014666591 /nfs/dbraw/zinc/66/65/91/1014666591.db2.gz URPFKFHGYQHAFV-UHFFFAOYSA-N 2 0 355.530 2.904 20 10 FFCDRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3c(O)ccc4ccncc43)CC2)CC1 ZINC000760286034 981716839 /nfs/dbraw/zinc/71/68/39/981716839.db2.gz FUOXBYQQKWMGAA-UHFFFAOYSA-N 2 0 368.525 2.931 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206011530 1032107114 /nfs/dbraw/zinc/10/71/14/1032107114.db2.gz DGPJJNKOOHXZKZ-NVXWUHKLSA-N 2 0 351.922 2.983 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cc1Br ZINC001206011585 1032108350 /nfs/dbraw/zinc/10/83/50/1032108350.db2.gz FAUTZOWZIXJFMR-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879650588 1015625924 /nfs/dbraw/zinc/62/59/24/1015625924.db2.gz IKETWWAAGJMAIB-SCTDSRPQSA-N 2 0 367.493 2.822 20 10 FFCDRP Cc1cccc(C[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c1O ZINC000181347653 991738989 /nfs/dbraw/zinc/73/89/89/991738989.db2.gz OTWNYUVCUNDABH-UHFFFAOYSA-N 2 0 367.493 2.816 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(CO)C[C@@H]3c3ccccc3)cc2)CC1 ZINC000810165258 994713799 /nfs/dbraw/zinc/71/37/99/994713799.db2.gz NCYZHGXCACNDJR-DHIUTWEWSA-N 2 0 365.521 2.694 20 10 FFCDRP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4c(O)cc(O)cc4O)C[C@@H]3C2)cc1 ZINC001144509682 998622094 /nfs/dbraw/zinc/62/20/94/998622094.db2.gz IAHCBODPQHNKNR-IRXDYDNUSA-N 2 0 354.450 2.676 20 10 FFCDRP Oc1ccccc1C[N@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000903893114 1016291610 /nfs/dbraw/zinc/29/16/10/1016291610.db2.gz QNSZWNVPLKBWBG-GOSISDBHSA-N 2 0 355.486 2.853 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1O ZINC000846141882 1000217604 /nfs/dbraw/zinc/21/76/04/1000217604.db2.gz BGTDEOPYFQHPSK-QGZVFWFLSA-N 2 0 369.509 2.999 20 10 FFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1O ZINC000846145192 1000218611 /nfs/dbraw/zinc/21/86/11/1000218611.db2.gz NDVYZJRBOLUGOQ-XKGZKEIXSA-N 2 0 370.493 2.934 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000769329470 1000493681 /nfs/dbraw/zinc/49/36/81/1000493681.db2.gz PHOBAFDUCUZTOW-UHFFFAOYSA-N 2 0 353.510 2.950 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C/C=C\CNC(=O)OC(C)(C)C)cc2)CC1 ZINC000789869366 1002223553 /nfs/dbraw/zinc/22/35/53/1002223553.db2.gz LZZHMMOGLAASBM-WAYWQWQTSA-N 2 0 374.529 2.609 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)[NH+](C)C)cc1 ZINC001184426892 1002611594 /nfs/dbraw/zinc/61/15/94/1002611594.db2.gz POUJKGIIBXITMR-VQTJNVASSA-N 2 0 360.546 2.736 20 10 FFCDRP Cc1n[nH]cc1C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000793607528 1003439472 /nfs/dbraw/zinc/43/94/72/1003439472.db2.gz AJDOXQVLZMKZJV-UHFFFAOYSA-N 2 0 353.514 2.850 20 10 FFCDRP COc1ccccc1OCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775654200 1004959405 /nfs/dbraw/zinc/95/94/05/1004959405.db2.gz IALWUSYZHMPRJF-UHFFFAOYSA-N 2 0 369.509 2.958 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c1O ZINC000817414106 1007591613 /nfs/dbraw/zinc/59/16/13/1007591613.db2.gz RLPRGKNHOKAIDR-UHFFFAOYSA-N 2 0 361.530 2.783 20 10 FFCDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817916882 1007808721 /nfs/dbraw/zinc/80/87/21/1007808721.db2.gz MDLJQXYIKJTCMR-UNMCSNQZSA-N 3 0 356.558 2.826 20 10 FFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@@H+]1C ZINC000773145613 1009668110 /nfs/dbraw/zinc/66/81/10/1009668110.db2.gz KELGADJYXUYIDH-RXVVDRJESA-N 3 0 356.558 2.791 20 10 FFCDRP COc1ccc(C[NH2+]C[C@@H]2CN(C(=O)[C@@H]3CC[N@H+](C)[C@@H]3C)C[C@H]2C)cc1C ZINC001093780771 1010554045 /nfs/dbraw/zinc/55/40/45/1010554045.db2.gz CZDRERWVFCSBEI-HNBVOPMISA-N 2 0 373.541 2.528 20 10 FFCDRP CC[C@@H](C(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1)[NH+](C)C ZINC001094049302 1010808118 /nfs/dbraw/zinc/80/81/18/1010808118.db2.gz QLGUHDZCRXGWLI-QRQLOZEOSA-N 2 0 361.530 2.528 20 10 FFCDRP CCOC(=O)[C@@H]1CC2(C[N@@H+]1Cc1ccc(N(C)C)c(C)c1)CC[NH2+]CC2 ZINC001222221102 1032831883 /nfs/dbraw/zinc/83/18/83/1032831883.db2.gz JZTQJBNRUKIQGC-IBGZPJMESA-N 2 0 359.514 2.568 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000754739974 1023511321 /nfs/dbraw/zinc/51/13/21/1023511321.db2.gz HWIXXBSIKITAME-UHFFFAOYSA-N 2 0 361.530 2.700 20 10 FFCDRP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cc(F)ccc1O ZINC000756509368 1023721286 /nfs/dbraw/zinc/72/12/86/1023721286.db2.gz BFVNWEUYGDQZNY-INIZCTEOSA-N 2 0 358.461 2.789 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@@H]1COC2(C1)CC[NH+](Cc1ccc(O)cc1O)CC2 ZINC001204272583 1031199294 /nfs/dbraw/zinc/19/92/94/1031199294.db2.gz CYTPQWUGTDWQDW-KRWDZBQOSA-N 2 0 372.465 2.946 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(I)cc2O)CC[C@H]1C[NH3+] ZINC001205637833 1031893430 /nfs/dbraw/zinc/89/34/30/1031893430.db2.gz JESIJSXGXOCVFN-RYUDHWBXSA-N 2 0 374.266 2.804 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205635933 1031894516 /nfs/dbraw/zinc/89/45/16/1031894516.db2.gz BGNCFBUENKCFOY-WBVHZDCISA-N 2 0 351.922 2.983 20 10 FFCDRP CN(C)c1ccc(/C=C/c2ccc(NC(=O)[C@H]([NH3+])CCC[NH3+])cc2)cc1 ZINC001219203663 1033554109 /nfs/dbraw/zinc/55/41/09/1033554109.db2.gz LOXBMGYRHBVJMZ-RRFGBZISSA-N 2 0 352.482 2.928 20 10 FFCDRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccc(C[NH3+])cc3)c2)CC1 ZINC000831489754 1034099296 /nfs/dbraw/zinc/09/92/96/1034099296.db2.gz BYYDNVKYKHBXHD-UHFFFAOYSA-N 2 0 352.482 2.928 20 10 FFCDRP Oc1c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc2c3c1CCCN3CCC2 ZINC001138337875 1034167833 /nfs/dbraw/zinc/16/78/33/1034167833.db2.gz FJRDBHHEADFUTN-UHFFFAOYSA-N 2 0 364.493 2.808 20 10 FFCDRP CC[N@H+](C)[C@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281722 1034699034 /nfs/dbraw/zinc/69/90/34/1034699034.db2.gz VWJSDHRARUKKQD-PMACEKPBSA-N 2 0 354.498 2.562 20 10 FFCDRP COC(=O)CC[N@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)C1CCCC1 ZINC001139256418 1035030722 /nfs/dbraw/zinc/03/07/22/1035030722.db2.gz ANZXSANVMGXKAA-UHFFFAOYSA-N 2 0 364.486 2.770 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@](O)(C(F)(F)F)C3)cc2)CC1 ZINC001139407699 1035092722 /nfs/dbraw/zinc/09/27/22/1035092722.db2.gz AUDJPTWFFOJKSR-GOSISDBHSA-N 2 0 371.447 2.718 20 10 FFCDRP Cc1nc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)no1 ZINC001139408733 1035092900 /nfs/dbraw/zinc/09/29/00/1035092900.db2.gz PVHYINXTBXCZSN-GOSISDBHSA-N 2 0 355.486 2.509 20 10 FFCDRP Cc1cccc(O[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC001139411635 1035095092 /nfs/dbraw/zinc/09/50/92/1035095092.db2.gz WCRYMMYYJGEDFN-NRFANRHFSA-N 2 0 366.509 2.795 20 10 FFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001235716428 1037707192 /nfs/dbraw/zinc/70/71/92/1037707192.db2.gz BEZXDFFAEHQGEV-UHFFFAOYSA-N 2 0 351.922 2.998 20 10 FFCDRP CN(C)c1ccc(C[N@H+](C)Cc2cccc(CN3CC[NH2+]CC3)c2)cc1 ZINC001236190793 1037978269 /nfs/dbraw/zinc/97/82/69/1037978269.db2.gz YCKXBRBPDKMCBO-UHFFFAOYSA-N 2 0 352.526 2.790 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375565 1038059962 /nfs/dbraw/zinc/05/99/62/1038059962.db2.gz KYCNZSGLUNBFPF-SFHVURJKSA-N 2 0 372.557 2.546 20 10 FFCDRP Clc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CO2 ZINC001246171702 1039263888 /nfs/dbraw/zinc/26/38/88/1039263888.db2.gz CNRGVRBDALLOKB-SFHVURJKSA-N 2 0 357.885 2.843 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccccc3)cc2)CC1 ZINC001210216809 1039432689 /nfs/dbraw/zinc/43/26/89/1039432689.db2.gz WIPPHHMGUHPZDO-HSZRJFAPSA-N 2 0 364.537 2.975 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCC[N@@H+]([C@@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701979 1039442024 /nfs/dbraw/zinc/44/20/24/1039442024.db2.gz JQPWEGGSBQMSNI-SYYKKAFVSA-N 2 0 373.541 2.755 20 10 FFCDRP COC(=O)Cc1ccc(C[N@H+](C)Cc2ccc(-n3ccnc3)cc2)c(O)c1 ZINC001249213898 1040628788 /nfs/dbraw/zinc/62/87/88/1040628788.db2.gz BNCYVRWLIGGMMF-UHFFFAOYSA-N 2 0 365.433 2.925 20 10 FFCDRP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(Cl)cc1O)C2 ZINC001278557130 1041145154 /nfs/dbraw/zinc/14/51/54/1041145154.db2.gz FRMWWFAQWSHSLJ-LJQANCHMSA-N 2 0 351.922 2.895 20 10 FFCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)cc1 ZINC001279150186 1042920419 /nfs/dbraw/zinc/92/04/19/1042920419.db2.gz UZUATEATVJPOMY-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC12C[NH2+]C2 ZINC001237432982 1043157495 /nfs/dbraw/zinc/15/74/95/1043157495.db2.gz YOLJKTQSOMCUHW-QGZVFWFLSA-N 2 0 360.498 2.664 20 10 FFCDRP CCOc1ccc(C[NH2+][C@@]23CC[C@@](NCC[NH+](C)C)(C2)CCC3)c(O)c1 ZINC001279671933 1043440640 /nfs/dbraw/zinc/44/06/40/1043440640.db2.gz IDDFSUSPARVFEH-RTWAWAEBSA-N 2 0 361.530 2.877 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC001319717846 1045250626 /nfs/dbraw/zinc/25/06/26/1045250626.db2.gz LTHHCIHSRLCCRA-DENIHFKCSA-N 2 0 356.558 2.745 20 10 FFCDRP CCCCCC[N@H+](C)CC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001303084032 1051273616 /nfs/dbraw/zinc/27/36/16/1051273616.db2.gz DEUSMWCCFMOQFK-UHFFFAOYSA-N 2 0 360.546 2.567 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNC(=O)CCCCC3CC[NH2+]CC3)cc2)CC1 ZINC001340967553 1051300030 /nfs/dbraw/zinc/30/00/30/1051300030.db2.gz ODHPFRVMPNUNBG-UHFFFAOYSA-N 2 0 372.557 2.615 20 10 FFCDRP COc1cccc2c1OC[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001308243939 1052435647 /nfs/dbraw/zinc/43/56/47/1052435647.db2.gz IFNVDMSZLUNZLY-LJQANCHMSA-N 2 0 367.493 2.540 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2)CC1 ZINC001308301366 1052443455 /nfs/dbraw/zinc/44/34/55/1052443455.db2.gz WTSNISNTYBDIFH-UHFFFAOYSA-N 3 0 356.558 2.935 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN[C@@H]3C[NH2+]CC[C@@H]3c3ccccc3)cc2)CC1 ZINC000849350002 1056836072 /nfs/dbraw/zinc/83/60/72/1056836072.db2.gz MXQMRVHZWGSEIK-DHIUTWEWSA-N 2 0 364.537 2.674 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(C)CCC4(CC3)OCCO4)cc2)CC1 ZINC001474287154 1065484413 /nfs/dbraw/zinc/48/44/13/1065484413.db2.gz VOADJVWJCIVAQD-UHFFFAOYSA-N 2 0 373.541 2.851 20 10 FFCDRP COc1cc(C[NH2+]CCCN(C)CC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC001560546818 1076279116 /nfs/dbraw/zinc/27/91/16/1076279116.db2.gz JYHMNMLVACZNTQ-UHFFFAOYSA-N 2 0 351.535 2.671 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[C@@H](C)[NH+](C)C)C1 ZINC000617758420 520705281 /nfs/dbraw/zinc/70/52/81/520705281.db2.gz OYIFTLQQEIYLMX-QGZVFWFLSA-N 2 0 370.541 2.864 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCN2CCC([NH3+])CC2)c1O ZINC000925809881 738531648 /nfs/dbraw/zinc/53/16/48/738531648.db2.gz BMIFSQLJJPEYIK-GFCCVEGCSA-N 2 0 356.308 2.537 20 10 FFCDRP C[C@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000873293723 731897702 /nfs/dbraw/zinc/89/77/02/731897702.db2.gz OYLPUIHXJJCJHD-GXTWGEPZSA-N 2 0 369.303 2.964 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4SCCS[C@@H]34)cc2)CC1 ZINC000771863922 737762463 /nfs/dbraw/zinc/76/24/63/737762463.db2.gz GZVHDIZUBULENX-QRVBRYPASA-N 2 0 363.596 2.908 20 10 FFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809738330 741338239 /nfs/dbraw/zinc/33/82/39/741338239.db2.gz USNYDXXUNDZKSN-QGZVFWFLSA-N 2 0 369.937 2.902 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)c1O ZINC000841103854 747270210 /nfs/dbraw/zinc/27/02/10/747270210.db2.gz KYQPVKZJJQHZBX-HZPDHXFCSA-N 2 0 354.878 2.773 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)c1O ZINC000842478993 747613561 /nfs/dbraw/zinc/61/35/61/747613561.db2.gz NFJIUDNITMXKNM-FUHWJXTLSA-N 2 0 366.889 2.967 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cnc(Cl)n3C)cc2F)CC1 ZINC000848535170 748953485 /nfs/dbraw/zinc/95/34/85/748953485.db2.gz DXFZWQIUWJFGHU-UHFFFAOYSA-N 2 0 365.884 2.644 20 10 FFCDRP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1ccc(Cl)cc1O ZINC001275893366 1013149493 /nfs/dbraw/zinc/14/94/93/1013149493.db2.gz WZEQOYSJKIZYPJ-IBGZPJMESA-N 2 0 365.905 2.564 20 10 FFCDRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 ZINC000067452962 967688499 /nfs/dbraw/zinc/68/84/99/967688499.db2.gz HVXXJCQGKPVVGL-KDURUIRLSA-N 2 0 361.530 2.502 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cn4ccnc4s3)cc2F)CC1 ZINC000892905157 970363355 /nfs/dbraw/zinc/36/33/55/970363355.db2.gz IEXKPIURQZRUSW-UHFFFAOYSA-N 2 0 373.501 2.967 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3c(C)ccnc3N)cc2F)CC1 ZINC000894233889 978360269 /nfs/dbraw/zinc/36/02/69/978360269.db2.gz QKSHISVXVOWOAX-UHFFFAOYSA-N 2 0 357.477 2.543 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@H]3O)cc2)CC1 ZINC000824695654 997058678 /nfs/dbraw/zinc/05/86/78/997058678.db2.gz AGEIYAZUZNJBDX-YPAWHYETSA-N 2 0 357.542 2.954 20 10 FFCDRP CN(C)c1ccc(CN(C)C(=O)C[N@H+](CCC[NH3+])CC2CCCC2)cc1 ZINC000844225136 997712815 /nfs/dbraw/zinc/71/28/15/997712815.db2.gz ZCCFDMHVTLZKRS-UHFFFAOYSA-N 2 0 360.546 2.552 20 10 FFCDRP Cc1c(C[C@H](C[NH3+])C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cnn1C ZINC000903879880 1016284323 /nfs/dbraw/zinc/28/43/23/1016284323.db2.gz LHJYYSORARGYFK-GOSISDBHSA-N 2 0 355.530 2.577 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000846138956 1000217312 /nfs/dbraw/zinc/21/73/12/1000217312.db2.gz YNTFVNRHUCHOIX-SFHVURJKSA-N 2 0 369.509 2.869 20 10 FFCDRP Cc1c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000791000030 1002538463 /nfs/dbraw/zinc/53/84/63/1002538463.db2.gz RMUNZOIRZNKCQT-UHFFFAOYSA-N 2 0 354.454 2.945 20 10 FFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCN1CC(F)F ZINC000775726569 1003861957 /nfs/dbraw/zinc/86/19/57/1003861957.db2.gz UDPHJNJIGMGPIB-GOSISDBHSA-N 2 0 366.500 2.600 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929613 /nfs/dbraw/zinc/92/96/13/1003929613.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 3 0 368.569 2.887 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](c2ccccc2)C1 ZINC000775633246 1004883684 /nfs/dbraw/zinc/88/36/84/1004883684.db2.gz GJQTZOPOJYOGMJ-QHCPKHFHSA-N 2 0 364.537 2.927 20 10 FFCDRP COc1cc(C[NH2+]CC(C)(C)N2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850024255 1005779083 /nfs/dbraw/zinc/77/90/83/1005779083.db2.gz BTHFVQXLJVDMKM-UHFFFAOYSA-N 2 0 363.546 2.814 20 10 FFCDRP COCCOc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883283899 1006731337 /nfs/dbraw/zinc/73/13/37/1006731337.db2.gz XNEPVEHQRMPDEK-UHFFFAOYSA-N 2 0 369.509 2.753 20 10 FFCDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817916880 1007807944 /nfs/dbraw/zinc/80/79/44/1007807944.db2.gz MDLJQXYIKJTCMR-IRLDBZIGSA-N 3 0 356.558 2.826 20 10 FFCDRP COc1ccc([C@H](NC[C@H]([NH3+])c2ccc(N(C)C)cc2)[C@@H]2CCC[NH2+]2)cc1 ZINC000817942299 1007820563 /nfs/dbraw/zinc/82/05/63/1007820563.db2.gz NVJSTUJWUXBODW-FKBYEOEOSA-N 2 0 368.525 2.844 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205545675 1007849185 /nfs/dbraw/zinc/84/91/85/1007849185.db2.gz LQFZEWAFYIZYIK-HNNXBMFYSA-N 2 0 361.255 2.816 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(C)COc4ccccc4O3)cc2)CC1 ZINC000858208414 1008325036 /nfs/dbraw/zinc/32/50/36/1008325036.db2.gz BZOYTPASJKXVDN-JOCHJYFZSA-N 2 0 367.493 2.758 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c(O)c1 ZINC001180137188 1009560437 /nfs/dbraw/zinc/56/04/37/1009560437.db2.gz VUDJENKJFXEUSN-UHFFFAOYSA-N 2 0 361.530 2.700 20 10 FFCDRP CN(C)c1ccc(CN(C)C(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000123399557 1012629636 /nfs/dbraw/zinc/62/96/36/1012629636.db2.gz HWVXNSIYDQNLKW-UHFFFAOYSA-N 2 0 374.573 2.765 20 10 FFCDRP C[C@H]([NH3+])c1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC001122413801 1023251831 /nfs/dbraw/zinc/25/18/31/1023251831.db2.gz BAKFVDZRXZIITH-MGPUTAFESA-N 2 0 354.498 2.805 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN(CCC[NH3+])c3cccc(F)c3)cc2)CC1 ZINC000753589636 1023355708 /nfs/dbraw/zinc/35/57/08/1023355708.db2.gz LEZLTDSYVSVHNO-UHFFFAOYSA-N 2 0 356.489 2.933 20 10 FFCDRP [NH3+]CC(=O)N1CCC[C@H](C[N@H+](Cc2ccccc2O)C2CCCCC2)C1 ZINC000841018696 1029981084 /nfs/dbraw/zinc/98/10/84/1029981084.db2.gz OOIKWIBMGUHTJD-KRWDZBQOSA-N 2 0 359.514 2.724 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN1CC[NH+](CC2CCCCC2)CC1 ZINC001204863506 1031455317 /nfs/dbraw/zinc/45/53/17/1031455317.db2.gz JRQAABXIFXNWDW-UHFFFAOYSA-N 2 0 356.558 2.794 20 10 FFCDRP Fc1ccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001204864496 1031457531 /nfs/dbraw/zinc/45/75/31/1031457531.db2.gz VJWNPTNFGOSWJP-UHFFFAOYSA-N 2 0 354.473 2.558 20 10 FFCDRP CC(C)c1ncc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000799737097 1031870317 /nfs/dbraw/zinc/87/03/17/1031870317.db2.gz VVXNRZXDANDLTQ-UHFFFAOYSA-N 2 0 353.514 2.984 20 10 FFCDRP CCc1noc([C@H]2CCC[N@H+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)C2)n1 ZINC001139258625 1035031480 /nfs/dbraw/zinc/03/14/80/1035031480.db2.gz VFBWCCKQIDHPCB-HNNXBMFYSA-N 2 0 374.485 2.787 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](Oc4cccnc4)C3)cc2)CC1 ZINC001139408597 1035092836 /nfs/dbraw/zinc/09/28/36/1035092836.db2.gz AOAQBYMXUPNKBA-JOCHJYFZSA-N 2 0 366.509 2.877 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4nnc(C)o4)C3)cc2)CC1 ZINC001140306002 1035427615 /nfs/dbraw/zinc/42/76/15/1035427615.db2.gz KADQWQWBFLXHHT-LJQANCHMSA-N 2 0 369.513 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C(=O)OC)CC3)cc2)CC1 ZINC001140309423 1035429646 /nfs/dbraw/zinc/42/96/46/1035429646.db2.gz GCGCPWKHXMKMNS-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000835037549 1035491729 /nfs/dbraw/zinc/49/17/29/1035491729.db2.gz QMBHQUQRQIFFBZ-GQCTYLIASA-N 2 0 365.525 2.702 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3cccc(OC(F)(F)F)c3O)CC2)CC1 ZINC001233754299 1036744116 /nfs/dbraw/zinc/74/41/16/1036744116.db2.gz CTHXZDZIRUQILB-UHFFFAOYSA-N 2 0 373.419 2.503 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3cc4c5c(c3)CCCN5CCC4)CC2)CC1 ZINC001141076469 1036927181 /nfs/dbraw/zinc/92/71/81/1036927181.db2.gz SMUFCTTZXGMAFP-UHFFFAOYSA-N 2 0 368.569 2.597 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001207327072 1037353303 /nfs/dbraw/zinc/35/33/03/1037353303.db2.gz XJKDNLVJFKXROK-UHFFFAOYSA-N 2 0 359.514 2.648 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429428 1037544685 /nfs/dbraw/zinc/54/46/85/1037544685.db2.gz UENRAZQRDUTYKQ-RBUKOAKNSA-N 2 0 374.548 2.789 20 10 FFCDRP C[C@H](c1ccccc1)[NH+]1CCN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235864384 1037801609 /nfs/dbraw/zinc/80/16/09/1037801609.db2.gz QDQJQHSJMYGMIA-QGZVFWFLSA-N 2 0 367.493 2.753 20 10 FFCDRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]1C2 ZINC001236027656 1037892672 /nfs/dbraw/zinc/89/26/72/1037892672.db2.gz LNJSDDIJAXEAKZ-WHEACTPUSA-N 2 0 372.509 2.520 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]1C[NH2+]CC2 ZINC001236037996 1037899899 /nfs/dbraw/zinc/89/98/99/1037899899.db2.gz DSMNLNHFNABYNK-DENIHFKCSA-N 2 0 371.525 2.652 20 10 FFCDRP c1ccc2c(c1)CCN1CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C[C@H]21 ZINC001236058705 1037910363 /nfs/dbraw/zinc/91/03/63/1037910363.db2.gz AJKVQZKINWRIKI-HSZRJFAPSA-N 2 0 362.521 2.511 20 10 FFCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2CCC[C@H](N3CC([NH3+])C3)C2)cc1Cl ZINC001236079815 1037921678 /nfs/dbraw/zinc/92/16/78/1037921678.db2.gz YZUVUIRZUFZWSM-HNNXBMFYSA-N 2 0 351.922 2.950 20 10 FFCDRP NC(=O)C1CC[NH+](C2CC[NH+](Cc3ccc4ccccc4c3O)CC2)CC1 ZINC001231881304 1037973848 /nfs/dbraw/zinc/97/38/48/1037973848.db2.gz UWHCWSCAIWFQQM-UHFFFAOYSA-N 2 0 367.493 2.707 20 10 FFCDRP COc1cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c(O)cc1Br ZINC001236757649 1038245131 /nfs/dbraw/zinc/24/51/31/1038245131.db2.gz VYYIKPUQGKVPLU-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[NH+](C)CC4)CC3)c(F)c2)CC1 ZINC001236942949 1038371565 /nfs/dbraw/zinc/37/15/65/1038371565.db2.gz ONPRZWUFENYOTK-UHFFFAOYSA-N 3 0 374.548 2.885 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)c(Br)c1 ZINC001237069466 1038432917 /nfs/dbraw/zinc/43/29/17/1038432917.db2.gz FUUQELBCZFQFEQ-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP c1ccc(C[C@@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173837 1039266538 /nfs/dbraw/zinc/26/65/38/1039266538.db2.gz MZGDPLDZJJLQDU-FCHUYYIVSA-N 3 0 364.537 2.549 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)COc2ccc(F)cc2)CC1 ZINC001251946854 1039374708 /nfs/dbraw/zinc/37/47/08/1039374708.db2.gz FEUFRALHKHFSEL-IBGZPJMESA-N 2 0 374.456 2.525 20 10 FFCDRP Oc1ccccc1C[N@@H+]1CCC[C@]2(CCC[NH+](CCn3ccnc3)C2)C1 ZINC001278551390 1041111965 /nfs/dbraw/zinc/11/19/65/1041111965.db2.gz ICDRRXONVLBMEN-NRFANRHFSA-N 2 0 354.498 2.967 20 10 FFCDRP COc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001278577070 1041237813 /nfs/dbraw/zinc/23/78/13/1041237813.db2.gz MRRYQCYPODFSCR-UHFFFAOYSA-N 2 0 356.470 2.612 20 10 FFCDRP C[NH+]1CCC(C[NH+]2CCN(Cc3cc(F)c(Cl)cc3O)CC2)CC1 ZINC001237941364 1043446390 /nfs/dbraw/zinc/44/63/90/1043446390.db2.gz VGGBUPLKEVPKKE-UHFFFAOYSA-N 2 0 355.885 2.644 20 10 FFCDRP COC[C@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1ccc(C)o1 ZINC001318880543 1044920933 /nfs/dbraw/zinc/92/09/33/1044920933.db2.gz JXVGNYFKJCLQCB-SFHVURJKSA-N 2 0 361.461 2.956 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC001319717847 1045251214 /nfs/dbraw/zinc/25/12/14/1045251214.db2.gz LTHHCIHSRLCCRA-KNQAVFIVSA-N 2 0 356.558 2.745 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCOCC4(CCCC4)C3)cc2F)CC1 ZINC001325803220 1046644784 /nfs/dbraw/zinc/64/47/84/1046644784.db2.gz KJELDFHNEXVZFJ-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001308918671 1052518583 /nfs/dbraw/zinc/51/85/83/1052518583.db2.gz NRPLVLDHBBNPCF-UHFFFAOYSA-N 2 0 374.529 2.584 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cncnc3C)cc2F)CC1 ZINC000848529611 1060228536 /nfs/dbraw/zinc/22/85/36/1060228536.db2.gz YQZHEHHAWVQTDN-HNNXBMFYSA-N 2 0 357.477 2.917 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000186601935 509796656 /nfs/dbraw/zinc/79/66/56/509796656.db2.gz NOWRIQVTCKONRS-UONOGXRCSA-N 2 0 370.335 2.831 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1 ZINC000185084835 510675232 /nfs/dbraw/zinc/67/52/32/510675232.db2.gz AUFSWBKOKKYAAK-KRWDZBQOSA-N 2 0 369.509 2.999 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1F ZINC000288630850 511081372 /nfs/dbraw/zinc/08/13/72/511081372.db2.gz SRUURXFHXAJSOJ-UHFFFAOYSA-N 2 0 360.477 2.907 20 10 FFCDRP CCCC[N@H+](Cc1cnc(N2CCN(C)CC2)nc1)Cc1ccccc1O ZINC000282836548 511129194 /nfs/dbraw/zinc/12/91/94/511129194.db2.gz CGRVQBCIVUGCIH-UHFFFAOYSA-N 2 0 369.513 2.736 20 10 FFCDRP c1cc(N2CCC([NH2+]Cc3ccc(N4CCOCC4)cc3)CC2)cc[nH+]1 ZINC000298399499 511270821 /nfs/dbraw/zinc/27/08/21/511270821.db2.gz LSEIZTOGUHXJQR-UHFFFAOYSA-N 2 0 352.482 2.677 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1O ZINC000530249738 517656028 /nfs/dbraw/zinc/65/60/28/517656028.db2.gz YJBWADZJYDKACQ-INIZCTEOSA-N 2 0 354.878 2.645 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4SCCS[C@H]34)cc2)CC1 ZINC000771863917 737762468 /nfs/dbraw/zinc/76/24/68/737762468.db2.gz GZVHDIZUBULENX-GUDVDZBRSA-N 2 0 363.596 2.908 20 10 FFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000825246898 743234928 /nfs/dbraw/zinc/23/49/28/743234928.db2.gz KOVJLEMVKCYGAK-AWEZNQCLSA-N 2 0 370.335 2.518 20 10 FFCDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000848716071 748993159 /nfs/dbraw/zinc/99/31/59/748993159.db2.gz DPMZREYBOKLOCB-CABCVRRESA-N 2 0 357.420 2.902 20 10 FFCDRP Cc1cc(NC2CC2)nc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]1 ZINC001167423176 963012547 /nfs/dbraw/zinc/01/25/47/963012547.db2.gz PTKMLKSPOPVVTE-UHFFFAOYSA-N 2 0 352.486 2.723 20 10 FFCDRP CN(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC001177170699 1013854177 /nfs/dbraw/zinc/85/41/77/1013854177.db2.gz GHMQJCAQTUDZCZ-FQEVSTJZSA-N 2 0 358.555 2.892 20 10 FFCDRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(O)c1OC ZINC000895347782 970445205 /nfs/dbraw/zinc/44/52/05/970445205.db2.gz QLGGWMGIXZOQRI-UHFFFAOYSA-N 2 0 371.481 2.806 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1O ZINC000894139091 977955104 /nfs/dbraw/zinc/95/51/04/977955104.db2.gz SGEKWUPEXIFLKT-UHFFFAOYSA-N 2 0 370.493 2.956 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1O ZINC001206011268 1032107561 /nfs/dbraw/zinc/10/75/61/1032107561.db2.gz BDDIDKWUPGYLKO-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP CCNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809691361 994568331 /nfs/dbraw/zinc/56/83/31/994568331.db2.gz MANOHDLWAJMQEY-FQEVSTJZSA-N 2 0 374.529 2.539 20 10 FFCDRP CCNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809691362 994568836 /nfs/dbraw/zinc/56/88/36/994568836.db2.gz MANOHDLWAJMQEY-HXUWFJFHSA-N 2 0 374.529 2.539 20 10 FFCDRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000809732171 994583984 /nfs/dbraw/zinc/58/39/84/994583984.db2.gz FHOWNDHQNGAGHT-UHFFFAOYSA-N 2 0 365.493 2.591 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CCN(c3ccccc3OCC[NH+](C)C)CC2)c1 ZINC000769429332 1000514887 /nfs/dbraw/zinc/51/48/87/1000514887.db2.gz YDKAGSTUSRWMQG-UHFFFAOYSA-N 2 0 369.509 2.963 20 10 FFCDRP COc1ccc([C@H](CO)[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775701484 1003706367 /nfs/dbraw/zinc/70/63/67/1003706367.db2.gz YXCZRDBQHWVWOZ-QFIPXVFZSA-N 2 0 369.509 2.612 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929772 /nfs/dbraw/zinc/92/97/72/1003929772.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 3 0 368.569 2.887 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1O ZINC001205601768 1004166919 /nfs/dbraw/zinc/16/69/19/1004166919.db2.gz GGJUQYJJIIDQBK-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP CN(CCC[NH+](C)C)Cc1ccc(C(=O)NCc2ccccc2O)cc1 ZINC001198031464 1004464673 /nfs/dbraw/zinc/46/46/73/1004464673.db2.gz VLUNUSFGUCJORX-UHFFFAOYSA-N 2 0 355.482 2.706 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@@H]3C[NH+]3CCCCC3)cc2)CC1 ZINC000775658805 1004975571 /nfs/dbraw/zinc/97/55/71/1004975571.db2.gz CPQSTDAZVSLFLS-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@H]3C[NH+]3CCCCC3)cc2)CC1 ZINC000775658806 1004976096 /nfs/dbraw/zinc/97/60/96/1004976096.db2.gz CPQSTDAZVSLFLS-QFIPXVFZSA-N 2 0 356.558 2.889 20 10 FFCDRP CN(C)C[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199600144 1004982573 /nfs/dbraw/zinc/98/25/73/1004982573.db2.gz UFIGUXPCSOHVES-QFIPXVFZSA-N 2 0 366.553 2.701 20 10 FFCDRP COc1ccc(COCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001201734627 1005267482 /nfs/dbraw/zinc/26/74/82/1005267482.db2.gz LICVUINRNOAPCG-UHFFFAOYSA-N 2 0 369.509 2.753 20 10 FFCDRP COC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(OC)c1 ZINC000850362597 1005811189 /nfs/dbraw/zinc/81/11/89/1005811189.db2.gz QEAOUTNTMQVIFT-QFIPXVFZSA-N 2 0 369.509 2.924 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]Cc3ccnn3-c3cc[nH+]cc3)cc2)CC1 ZINC000850406721 1005813691 /nfs/dbraw/zinc/81/36/91/1005813691.db2.gz QYFHWWZNYVXAJU-UHFFFAOYSA-N 2 0 363.465 2.518 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCN3Cc3ccccc3)cc2)CC1 ZINC000850416655 1005813957 /nfs/dbraw/zinc/81/39/57/1005813957.db2.gz NMUJTSZEXFHTSJ-HSZRJFAPSA-N 2 0 364.537 2.803 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883283828 1006730474 /nfs/dbraw/zinc/73/04/74/1006730474.db2.gz UWSBFNVPZHOTAY-UHFFFAOYSA-N 2 0 355.482 2.833 20 10 FFCDRP C[C@H](CC(=O)N1CCCCCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883289711 1006735939 /nfs/dbraw/zinc/73/59/39/1006735939.db2.gz XUAHPYZSEQLSEL-LJQANCHMSA-N 2 0 372.557 2.709 20 10 FFCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(I)cc2O)CC1 ZINC001206319004 1008910706 /nfs/dbraw/zinc/91/07/06/1008910706.db2.gz XGZXGERQRPSCSL-OAHLLOKOSA-N 2 0 374.266 2.948 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC000827786319 1018663669 /nfs/dbraw/zinc/66/36/69/1018663669.db2.gz ISUSUIIAXZBZCT-YJBOKZPZSA-N 2 0 371.447 2.980 20 10 FFCDRP C[C@@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1cc(F)ccc1O ZINC000390925375 1019904928 /nfs/dbraw/zinc/90/49/28/1019904928.db2.gz YQQPZVGDTZOSNR-QGZVFWFLSA-N 2 0 357.473 3.000 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000902519231 1020250651 /nfs/dbraw/zinc/25/06/51/1020250651.db2.gz YCOWUSIDGJQZJM-YCRPNKLZSA-N 2 0 355.530 2.868 20 10 FFCDRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 ZINC000800369331 1020257809 /nfs/dbraw/zinc/25/78/09/1020257809.db2.gz OCIXZOTZLAVYKD-FQEVSTJZSA-N 2 0 374.573 2.590 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001204869541 1031457839 /nfs/dbraw/zinc/45/78/39/1031457839.db2.gz CCQIJBRCTHWWKR-HSZRJFAPSA-N 2 0 364.537 2.803 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c(O)c1 ZINC001205295941 1031655785 /nfs/dbraw/zinc/65/57/85/1031655785.db2.gz CYDMULUTCXXZHJ-FQEVSTJZSA-N 2 0 364.486 2.818 20 10 FFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001205591724 1031856059 /nfs/dbraw/zinc/85/60/59/1031856059.db2.gz OIRRZAWIFNGNPX-HNNXBMFYSA-N 2 0 350.356 2.986 20 10 FFCDRP Nc1ccc(N(C(=O)[C@@H]([NH3+])CCC[NH3+])c2ccc3ccccc3c2N)cc1 ZINC001219471364 1033660232 /nfs/dbraw/zinc/66/02/32/1033660232.db2.gz BVLRJRNSDXRTBH-SFHVURJKSA-N 2 0 363.465 2.735 20 10 FFCDRP CC[NH+](CC)[C@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832274679 1034696543 /nfs/dbraw/zinc/69/65/43/1034696543.db2.gz XEAVNVUMAPJXRC-RTWAWAEBSA-N 2 0 368.525 2.952 20 10 FFCDRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000834615171 1035419119 /nfs/dbraw/zinc/41/91/19/1035419119.db2.gz BHXLHFMKJSGFBL-KRWDZBQOSA-N 2 0 359.514 2.596 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000835037552 1035491640 /nfs/dbraw/zinc/49/16/40/1035491640.db2.gz QMBHQUQRQIFFBZ-XQRVVYSFSA-N 2 0 365.525 2.702 20 10 FFCDRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]1C2 ZINC001236029202 1037896061 /nfs/dbraw/zinc/89/60/61/1037896061.db2.gz ZBYJSCIXVONACA-WHEACTPUSA-N 2 0 372.509 2.520 20 10 FFCDRP C[NH+]1CCC2(CC[N@H+](Cc3cc(O)c(Br)cc3O)C2)CC1 ZINC001236770106 1038255580 /nfs/dbraw/zinc/25/55/80/1038255580.db2.gz DQZZSGAVUQOIIA-UHFFFAOYSA-N 2 0 355.276 2.778 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(n4ccnc4)CC3)c(F)c2)CC1 ZINC001236941460 1038370295 /nfs/dbraw/zinc/37/02/95/1038370295.db2.gz BKXUGTLJDHDKJO-UHFFFAOYSA-N 2 0 357.477 2.611 20 10 FFCDRP Fc1cccc(O[C@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236949234 1038376323 /nfs/dbraw/zinc/37/63/23/1038376323.db2.gz GUPOZVDKCAOMBL-NRFANRHFSA-N 2 0 355.457 2.889 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@@H]3COC)C2)c(O)c1 ZINC001237040337 1038418566 /nfs/dbraw/zinc/41/85/66/1038418566.db2.gz HKCFZNBYUHTKFN-KNQAVFIVSA-N 2 0 374.525 2.971 20 10 FFCDRP Cc1cc(C[NH+]2C[C@@H]3CC[N@H+](CCN(C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766748 /nfs/dbraw/zinc/76/67/48/1039766748.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 0 358.574 2.766 20 10 FFCDRP [NH3+][C@H](c1ccccc1O)[C@H](N[C@H]1CC2CC[NH+](CC2)C1)c1ccccc1O ZINC001254843454 1041001194 /nfs/dbraw/zinc/00/11/94/1041001194.db2.gz IOFQATPNUAGIFG-KNXBSLHKSA-N 2 0 367.493 2.913 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCN(Cc4ccccc4)C3)cc2)CC1 ZINC001255099479 1041140529 /nfs/dbraw/zinc/14/05/29/1041140529.db2.gz HEZYKFVZFRBXRX-JOCHJYFZSA-N 2 0 364.537 2.803 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149199 1042919939 /nfs/dbraw/zinc/91/99/39/1042919939.db2.gz AVGBJXRWPKIHTI-QFIPXVFZSA-N 2 0 358.574 2.992 20 10 FFCDRP COc1ccc(Br)c(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c1O ZINC001279282608 1042982347 /nfs/dbraw/zinc/98/23/47/1042982347.db2.gz SPYNKOKSHVIIRR-BETUJISGSA-N 2 0 369.303 2.937 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(C(F)(F)F)ccc1O ZINC001279685748 1043467469 /nfs/dbraw/zinc/46/74/69/1043467469.db2.gz FMNMLJXMQDYXPY-IYBDPMFKSA-N 2 0 357.420 2.621 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)cc2F)CC1 ZINC001329428565 1048715945 /nfs/dbraw/zinc/71/59/45/1048715945.db2.gz SQBDJABPOCDCPE-FQEVSTJZSA-N 2 0 360.521 2.542 20 10 FFCDRP C[C@@H]1Cc2ccccc2N1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308234152 1052434600 /nfs/dbraw/zinc/43/46/00/1052434600.db2.gz OGSDURIJPOVDKE-LJQANCHMSA-N 2 0 364.537 2.979 20 10 FFCDRP [NH3+]Cc1cn(-c2cccc(C[NH2+]Cc3ccc(N4CCCC4)cc3)c2)nn1 ZINC001335949311 1053663776 /nfs/dbraw/zinc/66/37/76/1053663776.db2.gz UDWRRBWABJXOMU-UHFFFAOYSA-N 2 0 362.481 2.616 20 10 FFCDRP [NH2+]=C(NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)NC1CCCC1 ZINC000849052974 1055600300 /nfs/dbraw/zinc/60/03/00/1055600300.db2.gz TVSDCEZTUBWBEW-UHFFFAOYSA-N 2 0 355.530 2.775 20 10 FFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC001474098735 1065457268 /nfs/dbraw/zinc/45/72/68/1065457268.db2.gz MRVPBUHKCSCFHJ-SFHVURJKSA-N 2 0 358.530 2.669 20 10 FFCDRP CN(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC001560245658 1076256288 /nfs/dbraw/zinc/25/62/88/1076256288.db2.gz LFJGXVJPSAHGRW-JOCHJYFZSA-N 2 0 352.526 2.831 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)c3cccc(F)c3)cc2)CC1 ZINC001560595647 1076282703 /nfs/dbraw/zinc/28/27/03/1076282703.db2.gz JBNVTLRVEMIWNR-NRFANRHFSA-N 2 0 357.473 2.575 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c(O)c1 ZINC001560925637 1076309863 /nfs/dbraw/zinc/30/98/63/1076309863.db2.gz PUKQTBPFMYROCF-GOSISDBHSA-N 2 0 356.466 2.566 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000186590811 509789996 /nfs/dbraw/zinc/78/99/96/509789996.db2.gz GHHHDOIYZUUVPR-UONOGXRCSA-N 2 0 370.335 2.831 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246113608 510300804 /nfs/dbraw/zinc/30/08/04/510300804.db2.gz JWBQLYQBLVSSJW-SIKLNZKXSA-N 2 0 355.526 2.972 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccnc1N1CCN(C)CC1)c1ccc(F)c(F)c1[O-] ZINC000187668834 510377724 /nfs/dbraw/zinc/37/77/24/510377724.db2.gz XKWQMXKNCAMCAR-CYBMUJFWSA-N 2 0 362.424 2.668 20 10 FFCDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000848716072 748993230 /nfs/dbraw/zinc/99/32/30/748993230.db2.gz DPMZREYBOKLOCB-GJZGRUSLSA-N 2 0 357.420 2.902 20 10 FFCDRP CCc1ccc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796451277 1014974848 /nfs/dbraw/zinc/97/48/48/1014974848.db2.gz MRBOXIBPEHOIIZ-JOCHJYFZSA-N 2 0 353.510 2.824 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000765795386 985853024 /nfs/dbraw/zinc/85/30/24/985853024.db2.gz CCPZFBYICSNTBH-UYAOXDASSA-N 2 0 372.557 2.915 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1 ZINC000922391238 988549176 /nfs/dbraw/zinc/54/91/76/988549176.db2.gz AEVNPGIDRYPAOH-CWJKEVGVSA-N 2 0 362.514 2.750 20 10 FFCDRP CCOCc1cc(C[NH2+]C(C)(C)CN2CC[NH+](CC)CC2)ccc1OC ZINC000825275512 997311038 /nfs/dbraw/zinc/31/10/38/997311038.db2.gz RAVCUFAZTKQXDT-UHFFFAOYSA-N 2 0 363.546 2.737 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000826941325 1016237641 /nfs/dbraw/zinc/23/76/41/1016237641.db2.gz IBSRTKHRFXKLFE-QFIPXVFZSA-N 2 0 353.510 2.917 20 10 FFCDRP COc1cc(O)c(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1OC ZINC000827012273 1016624932 /nfs/dbraw/zinc/62/49/32/1016624932.db2.gz VMXWAIUWXPCNNC-UHFFFAOYSA-N 2 0 371.481 2.806 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930069 /nfs/dbraw/zinc/93/00/69/1003930069.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 3 0 368.569 2.887 20 10 FFCDRP CN(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199600143 1004982474 /nfs/dbraw/zinc/98/24/74/1004982474.db2.gz UFIGUXPCSOHVES-JOCHJYFZSA-N 2 0 366.553 2.701 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(OC[C@H]4CCCO4)CC3)cc2)CC1 ZINC000775666322 1005007096 /nfs/dbraw/zinc/00/70/96/1005007096.db2.gz VUDLELVELWHERZ-JOCHJYFZSA-N 2 0 373.541 2.598 20 10 FFCDRP COC(=O)C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC000883283930 1006732737 /nfs/dbraw/zinc/73/27/37/1006732737.db2.gz ZEOBTCBWTFQWHU-IMFGXOCKSA-N 2 0 359.514 2.506 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883290209 1006735231 /nfs/dbraw/zinc/73/52/31/1006735231.db2.gz OBHUNQYLCFVABN-OAHLLOKOSA-N 2 0 369.469 2.780 20 10 FFCDRP O=C(C[NH2+]Cc1ccc(N2CCCCC2)cc1)NCC[NH+]1CCCCCC1 ZINC000816620993 1007140242 /nfs/dbraw/zinc/14/02/42/1007140242.db2.gz UKRQHPLWBYDDFU-UHFFFAOYSA-N 2 0 372.557 2.759 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]CC(=O)NCC[NH+]2CCCCCC2)cc1 ZINC000816620960 1007140768 /nfs/dbraw/zinc/14/07/68/1007140768.db2.gz SVHMQJRHIZLQSK-UHFFFAOYSA-N 2 0 360.546 2.615 20 10 FFCDRP Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)nc1 ZINC000858012757 1008276707 /nfs/dbraw/zinc/27/67/07/1008276707.db2.gz LMVIVWGYJUDKPH-NRFANRHFSA-N 2 0 366.509 2.795 20 10 FFCDRP OCc1cc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cc[nH+]1 ZINC000858464874 1008364941 /nfs/dbraw/zinc/36/49/41/1008364941.db2.gz RWHVPELFZLAVPI-UHFFFAOYSA-N 2 0 352.482 2.718 20 10 FFCDRP COC(=O)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001172768129 1012004222 /nfs/dbraw/zinc/00/42/22/1012004222.db2.gz OTCRSTPTCNECJL-MOPGFXCFSA-N 2 0 359.514 2.650 20 10 FFCDRP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1cc(Cl)ccc1O ZINC001275248685 1012139419 /nfs/dbraw/zinc/13/94/19/1012139419.db2.gz QSGIPYHHJQYNNV-IBGZPJMESA-N 2 0 365.905 2.564 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3c(C)n(C)c4ccccc43)C[C@@H]1C[NH2+]CCC2 ZINC001222125758 1032769099 /nfs/dbraw/zinc/76/90/99/1032769099.db2.gz UYQVHJKEIWGJPM-JTSKRJEESA-N 2 0 369.509 2.851 20 10 FFCDRP CCCC[N@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1ccccc1O ZINC000801599460 1019158690 /nfs/dbraw/zinc/15/86/90/1019158690.db2.gz OWLMNTGWGHCMEA-UHFFFAOYSA-N 2 0 361.530 2.983 20 10 FFCDRP CCOC(=O)[C@H]1CC2(C[N@@H+]1Cc1ccc(N(C)C)c(C)c1)CC[NH2+]CC2 ZINC001222221104 1032830832 /nfs/dbraw/zinc/83/08/32/1032830832.db2.gz JZTQJBNRUKIQGC-LJQANCHMSA-N 2 0 359.514 2.568 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)cc2)CC1 ZINC000903202654 1020735673 /nfs/dbraw/zinc/73/56/73/1020735673.db2.gz DSLUUFYVDHQSIK-PRJVBOEPSA-N 2 0 355.526 2.895 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCCC[NH2+]4)C3)c(F)c2)CC1 ZINC001222394793 1032938846 /nfs/dbraw/zinc/93/88/46/1032938846.db2.gz BDRDGXGFYMPTHR-NRFANRHFSA-N 2 0 360.521 2.686 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c1 ZINC000756536271 1023724045 /nfs/dbraw/zinc/72/40/45/1023724045.db2.gz UJKNGVZCAGUGRQ-SFHVURJKSA-N 2 0 369.513 2.744 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@H]1COC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001141157490 1025537903 /nfs/dbraw/zinc/53/79/03/1025537903.db2.gz JTUWSXNKDJGEJJ-QGZVFWFLSA-N 2 0 372.465 2.946 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000843058448 1031165854 /nfs/dbraw/zinc/16/58/54/1031165854.db2.gz SLJCAKOKHUPWLK-CTNGQTDRSA-N 2 0 372.557 2.613 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3cccc(F)c3)cc2)CC1 ZINC000843120046 1031191676 /nfs/dbraw/zinc/19/16/76/1031191676.db2.gz ZZSRKYQCZHRTKJ-JOCHJYFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Oc1cc2c(cc1CN1CC[NH+](CC3CCCCC3)CC1)C[NH2+]CCO2 ZINC001204863510 1031455064 /nfs/dbraw/zinc/45/50/64/1031455064.db2.gz KDLSXLCJDJJBLO-UHFFFAOYSA-N 2 0 359.514 2.572 20 10 FFCDRP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001205690983 1031938605 /nfs/dbraw/zinc/93/86/05/1031938605.db2.gz ZTSKNPYJALYQIG-NRFANRHFSA-N 2 0 356.466 2.647 20 10 FFCDRP O=C(Nc1cccc(N2CC[NH2+]CC2)c1)c1cccc([C@@H]2CCC[NH2+]2)c1 ZINC001219119533 1033523615 /nfs/dbraw/zinc/52/36/15/1033523615.db2.gz AWZDJLPRHPOQNM-FQEVSTJZSA-N 2 0 350.466 2.773 20 10 FFCDRP COc1cc(C[NH+]2CCC3(C[C@H](F)CO3)CC2)cc(C[NH+](C)C)c1O ZINC001139259099 1035031015 /nfs/dbraw/zinc/03/10/15/1035031015.db2.gz HZOTTWQKYRLFRH-INIZCTEOSA-N 2 0 352.450 2.555 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4c5ccccc5C(=O)[C@H]4C3)cc2)CC1 ZINC001139409224 1035093720 /nfs/dbraw/zinc/09/37/20/1035093720.db2.gz XBBOVQXITLPSPM-VXKWHMMOSA-N 2 0 361.489 2.850 20 10 FFCDRP C[N@H+](CCCC(=O)c1cccnc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408872 1035094070 /nfs/dbraw/zinc/09/40/70/1035094070.db2.gz GEXZCCVVMHFOOI-UHFFFAOYSA-N 2 0 366.509 2.928 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139411490 1035095965 /nfs/dbraw/zinc/09/59/65/1035095965.db2.gz ORZHUTCLVBGRTM-QUCCMNQESA-N 2 0 373.541 2.850 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(O)(C(F)(F)F)CC3)cc2)CC1 ZINC001140302051 1035425119 /nfs/dbraw/zinc/42/51/19/1035425119.db2.gz IYWZBQKNTKTJPI-UHFFFAOYSA-N 2 0 371.447 2.718 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](CCO)Cc3cccs3)cc2)CC1 ZINC001140305277 1035427541 /nfs/dbraw/zinc/42/75/41/1035427541.db2.gz SXJLKFYHLXUNPN-UHFFFAOYSA-N 2 0 359.539 2.885 20 10 FFCDRP CCN(CC)c1ccc(CN(CCC[NH+](C)C)CCC[NH+](C)C)c(O)c1 ZINC001140856294 1036292526 /nfs/dbraw/zinc/29/25/26/1036292526.db2.gz WJDXJSRRSRRQKI-UHFFFAOYSA-N 2 0 364.578 2.944 20 10 FFCDRP Oc1cc(O)c(CN2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487295 1036655405 /nfs/dbraw/zinc/65/54/05/1036655405.db2.gz XWAHNSRBHGLXHL-FUHWJXTLSA-N 2 0 354.450 2.757 20 10 FFCDRP COCCOc1ccc(N2CC[NH+](CCC3CC[NH+](C)CC3)CC2)cc1 ZINC001207487433 1037486378 /nfs/dbraw/zinc/48/63/78/1037486378.db2.gz IWQNMTSFVICGAA-UHFFFAOYSA-N 2 0 361.530 2.566 20 10 FFCDRP Cc1cc(CN2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c(O)cc1Br ZINC001235402689 1037529168 /nfs/dbraw/zinc/52/91/68/1037529168.db2.gz XTIXIFMRGUYGDJ-JKSUJKDBSA-N 2 0 357.267 2.987 20 10 FFCDRP CC[N@H+](CCn1ccnc1)Cc1c(Br)ccc(OC)c1O ZINC001231554750 1037676676 /nfs/dbraw/zinc/67/66/76/1037676676.db2.gz BVWHVDRLDFTZNX-UHFFFAOYSA-N 2 0 354.248 2.882 20 10 FFCDRP COc1ccc(Br)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)c1O ZINC001231558188 1037682576 /nfs/dbraw/zinc/68/25/76/1037682576.db2.gz YDQCRIPSTCTYNL-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccccc2)CCN1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715892 1037707947 /nfs/dbraw/zinc/70/79/47/1037707947.db2.gz XDLHRZVYNXXGFY-FQEVSTJZSA-N 2 0 364.537 2.803 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]1C[NH2+]CC2 ZINC001236041202 1037904692 /nfs/dbraw/zinc/90/46/92/1037904692.db2.gz QPZOTRTWXAQYNR-DYESRHJHSA-N 2 0 360.498 2.664 20 10 FFCDRP c1ccc(CN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001236271643 1038011053 /nfs/dbraw/zinc/01/10/53/1038011053.db2.gz UYXJQUNUSWKIRV-HSZRJFAPSA-N 2 0 364.537 2.850 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC([NH+]4CCCC4)CC3)c(F)c2)CC1 ZINC001236931875 1038363232 /nfs/dbraw/zinc/36/32/32/1038363232.db2.gz MJWXDWFDMWUTGK-UHFFFAOYSA-N 2 0 360.521 2.638 20 10 FFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c1 ZINC001278617044 1038843804 /nfs/dbraw/zinc/84/38/04/1038843804.db2.gz OGGKBIJJAKNLMJ-NRFANRHFSA-N 2 0 354.498 2.885 20 10 FFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c1 ZINC001278617045 1038844349 /nfs/dbraw/zinc/84/43/49/1038844349.db2.gz OGGKBIJJAKNLMJ-OAQYLSRUSA-N 2 0 354.498 2.885 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccccc3)cc2)CC1 ZINC001210216811 1039432787 /nfs/dbraw/zinc/43/27/87/1039432787.db2.gz WIPPHHMGUHPZDO-QHCPKHFHSA-N 2 0 364.537 2.975 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[NH+](C)CC[C@@H]4C3)cc2)CC1 ZINC001278474404 1039551538 /nfs/dbraw/zinc/55/15/38/1039551538.db2.gz HVLSAUZQLFYMSX-OYRHEFFESA-N 2 0 356.558 2.602 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2O)CC3)n(C)n1 ZINC001278552732 1041120792 /nfs/dbraw/zinc/12/07/92/1041120792.db2.gz XVJOEAVSODQTSE-UHFFFAOYSA-N 2 0 354.498 2.922 20 10 FFCDRP COc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4cn[nH]c4)C3)CC2)c1O ZINC001278562786 1041181160 /nfs/dbraw/zinc/18/11/60/1041181160.db2.gz LYEPJCRBNOHAFC-UHFFFAOYSA-N 2 0 356.470 2.612 20 10 FFCDRP Cc1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338726 1043011327 /nfs/dbraw/zinc/01/13/27/1043011327.db2.gz PKKYVSAYOJSWMS-OAQYLSRUSA-N 2 0 354.498 2.885 20 10 FFCDRP [O-]c1cccc(F)c1C[NH+]1CCC2(CC[N@H+](CCn3ccnc3)C2)CC1 ZINC001279421355 1043093772 /nfs/dbraw/zinc/09/37/72/1043093772.db2.gz FRCHZFJGKDUCBD-UHFFFAOYSA-N 2 0 358.461 2.716 20 10 FFCDRP Cc1cc(C[NH+]2CC3(CN(CC[NH+](C)C)C3)C2)c(C)n1-c1ccccc1 ZINC001279424513 1043098528 /nfs/dbraw/zinc/09/85/28/1043098528.db2.gz ATVVRFIAQFCYBD-UHFFFAOYSA-N 2 0 352.526 2.773 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC12C[NH2+]C2 ZINC001237432301 1043158130 /nfs/dbraw/zinc/15/81/30/1043158130.db2.gz XGCXLRXSEJQWIT-QGZVFWFLSA-N 2 0 360.498 2.664 20 10 FFCDRP CN1CC[NH+](CC2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)CC1 ZINC001329825324 1048926951 /nfs/dbraw/zinc/92/69/51/1048926951.db2.gz PIYFQTBUDVLGHI-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP COc1cc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc(OC)c1 ZINC001308556035 1052469693 /nfs/dbraw/zinc/46/96/93/1052469693.db2.gz RFIKHLSYEJFMFL-UHFFFAOYSA-N 2 0 369.509 2.788 20 10 FFCDRP CC(C)OC(=O)C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000848927747 1055380694 /nfs/dbraw/zinc/38/06/94/1055380694.db2.gz MNGRFGDTNIPYLR-FQEVSTJZSA-N 2 0 361.530 2.894 20 10 FFCDRP COc1ccc(C[NH2+]CCC[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1C ZINC001506924316 1059577799 /nfs/dbraw/zinc/57/77/99/1059577799.db2.gz VFPOUMAGVHLVSE-YQVWRLOYSA-N 2 0 361.530 2.718 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC001461207058 1061251693 /nfs/dbraw/zinc/25/16/93/1061251693.db2.gz XWZSRMZRNSTSDL-HNNXBMFYSA-N 2 0 365.481 2.871 20 10 FFCDRP COc1c([O-])c(C[N@@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463767 1061634122 /nfs/dbraw/zinc/63/41/22/1061634122.db2.gz WHQWJVJERGETJW-HIFRSBDPSA-N 2 0 351.447 2.861 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccccc3Cl)cc2)CC1 ZINC001560342950 1076266210 /nfs/dbraw/zinc/26/62/10/1076266210.db2.gz MRJYZPGQFPDOSL-HXUWFJFHSA-N 2 0 359.901 2.915 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809389 509306101 /nfs/dbraw/zinc/30/61/01/509306101.db2.gz DXFFJDSHGKHVET-WOIUINJBSA-N 2 0 374.573 2.526 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cc(F)ccc1O ZINC000186060730 509505150 /nfs/dbraw/zinc/50/51/50/509505150.db2.gz MNFQQUZNJNTTIA-CQSZACIVSA-N 2 0 359.445 2.674 20 10 FFCDRP Cc1cccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c1O ZINC000182202622 510812538 /nfs/dbraw/zinc/81/25/38/510812538.db2.gz NGGAJGLEHOSENP-FQEVSTJZSA-N 2 0 367.493 2.688 20 10 FFCDRP CC[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000274941518 511993766 /nfs/dbraw/zinc/99/37/66/511993766.db2.gz SXAJECOVRTVYCV-DZGCQCFKSA-N 2 0 357.292 2.652 20 10 FFCDRP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502163 738097512 /nfs/dbraw/zinc/09/75/12/738097512.db2.gz PDJPOMRMWGYCQI-CZUORRHYSA-N 2 0 353.894 2.674 20 10 FFCDRP [NH3+]CC1CC[NH+](Cc2ccc(NCCc3cc(O)c(O)cc3O)cc2)CC1 ZINC001168013818 967993425 /nfs/dbraw/zinc/99/34/25/967993425.db2.gz KPULBLGFXUEBRE-UHFFFAOYSA-N 2 0 371.481 2.629 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000877642436 1014656340 /nfs/dbraw/zinc/65/63/40/1014656340.db2.gz LFWKPHQUZGVSJT-UHFFFAOYSA-N 2 0 357.542 2.859 20 10 FFCDRP O=c1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cc[nH]1 ZINC000921955651 987393090 /nfs/dbraw/zinc/39/30/90/987393090.db2.gz FFEIVAARUXKRFX-UHFFFAOYSA-N 2 0 352.482 2.609 20 10 FFCDRP CCOc1ccc(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391441 988549389 /nfs/dbraw/zinc/54/93/89/988549389.db2.gz CTUJFQVXHWCNKP-PBASOCQRSA-N 2 0 362.514 2.750 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879650589 1015626090 /nfs/dbraw/zinc/62/60/90/1015626090.db2.gz IKETWWAAGJMAIB-YQVWRLOYSA-N 2 0 367.493 2.822 20 10 FFCDRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000809732036 994583094 /nfs/dbraw/zinc/58/30/94/994583094.db2.gz APWVOZUZFYQBTP-UHFFFAOYSA-N 2 0 361.530 2.761 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC(O)(c4ccc(Cl)cc4)C3)cc2)CC1 ZINC000811509585 995171023 /nfs/dbraw/zinc/17/10/23/995171023.db2.gz WJGBBBRWFAQBJW-UHFFFAOYSA-N 2 0 371.912 2.795 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C3CC[NH+]([C@@H]4CCC[C@@H]4O)CC3)CC2)cc1 ZINC000812839135 995549287 /nfs/dbraw/zinc/54/92/87/995549287.db2.gz HZWLUTIRACPKJL-YADHBBJMSA-N 2 0 373.541 2.631 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@@H](c4ccccn4)C3)cc2)CC1 ZINC000825087250 997211513 /nfs/dbraw/zinc/21/15/13/997211513.db2.gz YKLGAOAWKQGSNK-DENIHFKCSA-N 2 0 366.509 2.843 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000826941319 1016237449 /nfs/dbraw/zinc/23/74/49/1016237449.db2.gz IBSRTKHRFXKLFE-JOCHJYFZSA-N 2 0 353.510 2.917 20 10 FFCDRP COc1ccc([C@@H](C[NH3+])C[N@H+](C)CCN(C)c2ccc(OC)cc2)cc1 ZINC000846225778 1000234705 /nfs/dbraw/zinc/23/47/05/1000234705.db2.gz UKCVXULLJVVDKW-SFHVURJKSA-N 2 0 357.498 2.814 20 10 FFCDRP C[N@@H+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465833 1000262937 /nfs/dbraw/zinc/26/29/37/1000262937.db2.gz MHIJMCKXQBVYNB-LAUBAEHRSA-N 2 0 368.477 2.772 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccnn1C ZINC000774268565 1001827159 /nfs/dbraw/zinc/82/71/59/1001827159.db2.gz WFWYRQJFJDZPGW-QGZVFWFLSA-N 2 0 353.514 2.803 20 10 FFCDRP CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775720214 1003786287 /nfs/dbraw/zinc/78/62/87/1003786287.db2.gz IRRJOAJGLRUHGR-RTWAWAEBSA-N 2 0 372.557 2.660 20 10 FFCDRP CC[C@H]([NH2+][C@@H](Cc1ccccc1)C(=O)NCC[NH+](C)C)c1ccccc1O ZINC000775538842 1004208584 /nfs/dbraw/zinc/20/85/84/1004208584.db2.gz AFCVSPYMHBUMPW-PMACEKPBSA-N 2 0 369.509 2.722 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnc(C(F)(F)F)nc3)cc2)CC1 ZINC000850344911 1005809069 /nfs/dbraw/zinc/80/90/69/1005809069.db2.gz BIOWYCSDAHDTJB-UHFFFAOYSA-N 2 0 365.403 2.537 20 10 FFCDRP Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850391574 1005812684 /nfs/dbraw/zinc/81/26/84/1005812684.db2.gz VHBWGTZAZZFUFB-UHFFFAOYSA-N 2 0 353.514 2.729 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cccnc4CC3)cc2)CC1 ZINC000883282989 1006730858 /nfs/dbraw/zinc/73/08/58/1006730858.db2.gz NIVAJIJGLJDGBP-HXUWFJFHSA-N 2 0 350.510 2.871 20 10 FFCDRP CCOC(=O)C1([C@@H](C)[NH2+]Cc2ccc(N(CC)CC)cc2)CC[NH2+]CC1 ZINC000817887852 1007785483 /nfs/dbraw/zinc/78/54/83/1007785483.db2.gz GBYPBCSXMLPXJO-QGZVFWFLSA-N 2 0 361.530 2.944 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(N2CCNC2=O)cc1 ZINC000817941532 1007817777 /nfs/dbraw/zinc/81/77/77/1007817777.db2.gz KLSKFGUTIIDBKU-FOIQADDNSA-N 2 0 367.497 2.633 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCN3C3CCCCC3)cc2)CC1 ZINC000858222262 1008327872 /nfs/dbraw/zinc/32/78/72/1008327872.db2.gz RUZDWHWSBZGANY-QFIPXVFZSA-N 2 0 356.558 2.935 20 10 FFCDRP C[C@@H]1[C@H](C)OC[C@]12CC[C@@H](C[NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)O2 ZINC000886338483 1008642515 /nfs/dbraw/zinc/64/25/15/1008642515.db2.gz LSZTXCKCBKWZQW-JZZBYWGLSA-N 2 0 373.541 2.501 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547806 1023727135 /nfs/dbraw/zinc/72/71/35/1023727135.db2.gz HPKIXVTXZCIKCG-YJBOKZPZSA-N 2 0 359.514 2.509 20 10 FFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CN1C1CC1 ZINC000092856008 1027477352 /nfs/dbraw/zinc/47/73/52/1027477352.db2.gz XWJMLOGVISOBEP-GHTZIAJQSA-N 2 0 368.569 2.933 20 10 FFCDRP CN(C)CC(=O)N[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204240227 1031181926 /nfs/dbraw/zinc/18/19/26/1031181926.db2.gz LVRHUYWFAXARAP-GOSISDBHSA-N 2 0 368.525 2.548 20 10 FFCDRP CCCCOC(=O)[C@H]1CC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259673 1035032100 /nfs/dbraw/zinc/03/21/00/1035032100.db2.gz AOJQUJQEGJVFJC-INIZCTEOSA-N 2 0 364.486 2.628 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@]1(O)C(F)(F)F ZINC001139408741 1035092973 /nfs/dbraw/zinc/09/29/73/1035092973.db2.gz PWFNIOSZSKAOSX-QAPCUYQASA-N 2 0 371.447 2.574 20 10 FFCDRP CCOC(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC001139413541 1035096870 /nfs/dbraw/zinc/09/68/70/1035096870.db2.gz WAFOSTUWXFKQCT-XLIONFOSSA-N 2 0 359.514 2.602 20 10 FFCDRP Oc1ccc(F)cc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001140055618 1035324640 /nfs/dbraw/zinc/32/46/40/1035324640.db2.gz NGOCEAPSBAGTOS-DYESRHJHSA-N 2 0 371.456 2.649 20 10 FFCDRP COC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)C1 ZINC001140185139 1035371870 /nfs/dbraw/zinc/37/18/70/1035371870.db2.gz PRVJGGJMGJMJJC-QGZVFWFLSA-N 2 0 360.498 2.858 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(C)(C(=O)OC)CC3)cc2)CC1 ZINC001140304678 1035426143 /nfs/dbraw/zinc/42/61/43/1035426143.db2.gz YCWLWCZIKLHSDJ-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](Oc4cccnc4)C3)cc2)CC1 ZINC001140304532 1035426476 /nfs/dbraw/zinc/42/64/76/1035426476.db2.gz TXDDROLEKUJVKO-JOCHJYFZSA-N 2 0 366.509 2.877 20 10 FFCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309876 1035429832 /nfs/dbraw/zinc/42/98/32/1035429832.db2.gz XZPADNBKTOLSGF-SFTDATJTSA-N 3 0 356.558 2.602 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000835034865 1035490990 /nfs/dbraw/zinc/49/09/90/1035490990.db2.gz GCDQJBGQSNEOJP-PLNGDYQASA-N 2 0 365.525 2.702 20 10 FFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745160 1036034613 /nfs/dbraw/zinc/03/46/13/1036034613.db2.gz YKKVWESVDDAGPJ-RXVVDRJESA-N 2 0 360.498 2.587 20 10 FFCDRP CC(C)N1CCOC[C@@]2(CCC[N@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836977 1036090691 /nfs/dbraw/zinc/09/06/91/1036090691.db2.gz XZLWSNBWMSGTTB-OAQYLSRUSA-N 2 0 361.530 2.781 20 10 FFCDRP CN(C)c1ccc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c(Cl)c1 ZINC001140926333 1036465003 /nfs/dbraw/zinc/46/50/03/1036465003.db2.gz JVXOSBXXJRMJSP-UHFFFAOYSA-N 2 0 364.965 2.865 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3ccc(C(F)(F)F)cc3O)CC2)CC1 ZINC001233454489 1036633961 /nfs/dbraw/zinc/63/39/61/1036633961.db2.gz WMNRMMFDRVHIMO-UHFFFAOYSA-N 2 0 357.420 2.623 20 10 FFCDRP COCC[N@H+](Cc1cccc(OC(F)(F)F)c1O)C1CCN(C)CC1 ZINC001233754261 1036745808 /nfs/dbraw/zinc/74/58/08/1036745808.db2.gz BPMKEJHTFNZVGB-UHFFFAOYSA-N 2 0 362.392 2.833 20 10 FFCDRP Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235423697 1037541634 /nfs/dbraw/zinc/54/16/34/1037541634.db2.gz GJFKMRLIVCSYRZ-ZWKOTPCHSA-N 2 0 361.505 2.874 20 10 FFCDRP CC(C)(C)OC(=O)[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235694383 1037691047 /nfs/dbraw/zinc/69/10/47/1037691047.db2.gz DSAUNZLEAXDHDQ-GOSISDBHSA-N 2 0 359.514 2.650 20 10 FFCDRP CC1(N2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)CC[NH2+]CC1 ZINC001235814574 1037764453 /nfs/dbraw/zinc/76/44/53/1037764453.db2.gz CQFHQEHBDIBYRV-UHFFFAOYSA-N 2 0 356.558 2.937 20 10 FFCDRP CC1(N2CC[NH+](Cc3cc4c5c(c3)CCCN5CCC4)CC2)CC[NH2+]CC1 ZINC001235816722 1037765662 /nfs/dbraw/zinc/76/56/62/1037765662.db2.gz XFQLJFXSQWAXCP-UHFFFAOYSA-N 2 0 368.569 2.645 20 10 FFCDRP Cc1ccc(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)c(C)c1 ZINC001235949029 1037852522 /nfs/dbraw/zinc/85/25/22/1037852522.db2.gz ZJPRGVQFXXSDIE-UHFFFAOYSA-N 2 0 367.493 2.813 20 10 FFCDRP C[NH+](C)CCN(Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001236911345 1038350812 /nfs/dbraw/zinc/35/08/12/1038350812.db2.gz DAISVEMWYHKSRN-UHFFFAOYSA-N 2 0 356.558 2.501 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(n4cccn4)CC3)c(F)c2)CC1 ZINC001236944030 1038373241 /nfs/dbraw/zinc/37/32/41/1038373241.db2.gz YQVHZCRRIMRHOS-UHFFFAOYSA-N 2 0 357.477 2.611 20 10 FFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CCC([NH+]2CCOCC2)CC1 ZINC001256695139 1038605224 /nfs/dbraw/zinc/60/52/24/1038605224.db2.gz OKUYOPLBMYEZHQ-UHFFFAOYSA-N 2 0 373.541 2.598 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCCCC4)C3)cc2)CC1 ZINC001246184747 1039268510 /nfs/dbraw/zinc/26/85/10/1039268510.db2.gz PBUFJABHTXCAAZ-HXUWFJFHSA-N 3 0 356.558 2.983 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(-c2noc([C@]34C[NH2+]C[C@H]3C[NH2+]CC4)n2)cc1 ZINC001247855734 1039994740 /nfs/dbraw/zinc/99/47/40/1039994740.db2.gz URHVSBREXKYRFO-DYESRHJHSA-N 2 0 363.465 2.595 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC(CC[NH+](C)C)CC3)cc2F)CC1 ZINC001253996359 1040499636 /nfs/dbraw/zinc/49/96/36/1040499636.db2.gz CGSUMWYZOOAEAX-UHFFFAOYSA-N 2 0 362.537 2.741 20 10 FFCDRP Oc1ccc([C@@H](O)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1O ZINC001255122685 1041157482 /nfs/dbraw/zinc/15/74/82/1041157482.db2.gz IUXLKTFVRDREAA-VWNVYAMZSA-N 2 0 368.477 2.916 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cc2F)CC1 ZINC001261579064 1041314026 /nfs/dbraw/zinc/31/40/26/1041314026.db2.gz WWVYWIRWLJJMBC-HXUWFJFHSA-N 2 0 374.548 2.789 20 10 FFCDRP CN(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH+](Cc4cn[nH]c4)CC[C@@H]3C2)cc1 ZINC001279149383 1042920653 /nfs/dbraw/zinc/92/06/53/1042920653.db2.gz GHXZZPWJBSOPNK-BGYRXZFFSA-N 2 0 353.514 2.820 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001279533094 1043232267 /nfs/dbraw/zinc/23/22/67/1043232267.db2.gz DHJXFXKMEOOUHW-SZPZYZBQSA-N 2 0 356.558 2.887 20 10 FFCDRP CNC(=O)CN1CCCC12CC[NH+](Cc1cc(Cl)cc(C)c1O)CC2 ZINC001237679222 1043307096 /nfs/dbraw/zinc/30/70/96/1043307096.db2.gz HAMKOZHFGCIBDZ-UHFFFAOYSA-N 2 0 365.905 2.530 20 10 FFCDRP CCc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]CC(=O)N(C)C)(C2)CCC3)c(O)c1 ZINC001279664041 1043425582 /nfs/dbraw/zinc/42/55/82/1043425582.db2.gz OVWBSBVORDNKJR-LEWJYISDSA-N 2 0 359.514 2.567 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202858 1046808754 /nfs/dbraw/zinc/80/87/54/1046808754.db2.gz WFSYWIFDXYJWBG-VQTJNVASSA-N 3 0 374.548 2.789 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@](C)(CO)Cc3ccc(F)cc3)cc2)CC1 ZINC001308480303 1052459317 /nfs/dbraw/zinc/45/93/17/1052459317.db2.gz VMXMPYCUCQVWII-JOCHJYFZSA-N 2 0 371.500 2.661 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1O ZINC001308583656 1052473317 /nfs/dbraw/zinc/47/33/17/1052473317.db2.gz MPHLQXMRPFVYEX-QZTJIDSGSA-N 2 0 361.530 2.700 20 10 FFCDRP Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC001473967119 1065429854 /nfs/dbraw/zinc/42/98/54/1065429854.db2.gz POPHPGXMXSCFCP-UHFFFAOYSA-N 2 0 363.509 2.923 20 10 FFCDRP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155687236 509052850 /nfs/dbraw/zinc/05/28/50/509052850.db2.gz GGYBREJOEJLVPI-BBRMVZONSA-N 2 0 370.335 2.831 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155687008 509052860 /nfs/dbraw/zinc/05/28/60/509052860.db2.gz GGYBREJOEJLVPI-CJNGLKHVSA-N 2 0 370.335 2.831 20 10 FFCDRP COc1cc(Br)cc(CN2CC[C@]3(CC[N@H+](C)C3)C2)c1O ZINC000366536664 512077743 /nfs/dbraw/zinc/07/77/43/512077743.db2.gz SPYWKHJTDJNQRU-INIZCTEOSA-N 2 0 355.276 2.691 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)c1O ZINC000925849026 738536005 /nfs/dbraw/zinc/53/60/05/738536005.db2.gz GJLAFVKIXXEXKM-TZMCWYRMSA-N 2 0 352.862 2.690 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4SCCS[C@H]34)cc2)CC1 ZINC000771863897 737762423 /nfs/dbraw/zinc/76/24/23/737762423.db2.gz GZVHDIZUBULENX-CEXWTWQISA-N 2 0 363.596 2.908 20 10 FFCDRP CC(C)[C@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391140 738135953 /nfs/dbraw/zinc/13/59/53/738135953.db2.gz SWKFEMZFDMTBCV-MOIQIXESSA-N 2 0 356.869 2.754 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CC[C@H](C(F)(F)F)O3)cc2)CC1 ZINC000922457039 738148703 /nfs/dbraw/zinc/14/87/03/738148703.db2.gz GRFDVGMSFFDAPO-DLBZAZTESA-N 2 0 357.420 2.638 20 10 FFCDRP COC[C@@H](CCC[NH3+])[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903049 742221340 /nfs/dbraw/zinc/22/13/40/742221340.db2.gz GCHIRAASPYYLOV-OAHLLOKOSA-N 2 0 357.445 2.600 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC2CC[NH+](CCC(F)(F)F)CC2)cc1 ZINC000841045921 747260715 /nfs/dbraw/zinc/26/07/15/747260715.db2.gz SUSULDWESGNUAI-KRWDZBQOSA-N 2 0 358.452 2.759 20 10 FFCDRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000841099516 747268828 /nfs/dbraw/zinc/26/88/28/747268828.db2.gz KIVZMHRCLFCQHD-DOTOQJQBSA-N 2 0 369.303 2.873 20 10 FFCDRP CC[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(C(F)(F)F)cc1O ZINC000854231157 750265579 /nfs/dbraw/zinc/26/55/79/750265579.db2.gz BBIYDYWKTCFZGU-GFCCVEGCSA-N 2 0 356.348 2.606 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)C[NH2+]C3)[NH+](C)C)cc1 ZINC000904515941 980290968 /nfs/dbraw/zinc/29/09/68/980290968.db2.gz RMUXTFWNBTVRTP-HXUWFJFHSA-N 2 0 367.497 2.780 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](OCc4ccccn4)C3)cc2)CC1 ZINC000877645487 1014658980 /nfs/dbraw/zinc/65/89/80/1014658980.db2.gz MSZNOTSFWZZYPF-JOCHJYFZSA-N 2 0 366.509 2.625 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@@H](c4ccncc4)C3)cc2)CC1 ZINC000824955694 997157529 /nfs/dbraw/zinc/15/75/29/997157529.db2.gz YOBNHAVZSKAMEY-IFMALSPDSA-N 2 0 366.509 2.843 20 10 FFCDRP CC(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccnn1C ZINC000788077104 1001754993 /nfs/dbraw/zinc/75/49/93/1001754993.db2.gz SNDHQHDJRHRDHC-HXUWFJFHSA-N 2 0 355.530 2.701 20 10 FFCDRP CN(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(F)c1 ZINC001198959786 1004794073 /nfs/dbraw/zinc/79/40/73/1004794073.db2.gz PVJYNOYEKFDQPK-QFIPXVFZSA-N 2 0 370.516 2.970 20 10 FFCDRP Fc1cc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)ccc1N1CCOCC1 ZINC000850421527 1005814599 /nfs/dbraw/zinc/81/45/99/1005814599.db2.gz YEBASZHDNAEQKN-UHFFFAOYSA-N 2 0 361.505 2.874 20 10 FFCDRP CCOC(=O)C[C@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000775376198 1007593247 /nfs/dbraw/zinc/59/32/47/1007593247.db2.gz XTMMHRMYFNDPST-NRFANRHFSA-N 2 0 361.530 2.896 20 10 FFCDRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893841 1007800025 /nfs/dbraw/zinc/80/00/25/1007800025.db2.gz IZXCZAWIFWHQOD-MBSDFSHPSA-N 2 0 367.537 2.943 20 10 FFCDRP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817902961 1007803942 /nfs/dbraw/zinc/80/39/42/1007803942.db2.gz CLSKLMQPSFCFSE-VHSSKADRSA-N 2 0 369.456 2.599 20 10 FFCDRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918326 1007810136 /nfs/dbraw/zinc/81/01/36/1007810136.db2.gz YRSHSKREEJTCKF-FGZHOGPDSA-N 3 0 356.558 2.968 20 10 FFCDRP C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000817940704 1007819123 /nfs/dbraw/zinc/81/91/23/1007819123.db2.gz GXCOZLAVTIMJCC-QRWLVFNGSA-N 2 0 354.498 2.805 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@](C)(O)c1ccccc1 ZINC000822517345 1008665497 /nfs/dbraw/zinc/66/54/97/1008665497.db2.gz WHYSRIVUGQEYPV-JOCHJYFZSA-N 2 0 353.510 2.778 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c3CCOC4)cc2)CC1 ZINC000865724231 1010849877 /nfs/dbraw/zinc/84/98/77/1010849877.db2.gz LVGFIQUHURCWLB-UHFFFAOYSA-N 2 0 351.494 2.801 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH2+]CC3)cc2)c1 ZINC000925812932 1017857847 /nfs/dbraw/zinc/85/78/47/1017857847.db2.gz DJQPTTFCZWNHEV-MRXNPFEDSA-N 2 0 355.482 2.657 20 10 FFCDRP COC(=O)c1cc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)oc1C ZINC001116472049 1021234874 /nfs/dbraw/zinc/23/48/74/1021234874.db2.gz RUVWOIIFAVPUJN-UHFFFAOYSA-N 2 0 371.481 2.758 20 10 FFCDRP C[C@H]([NH3+])c1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC001122413803 1023252305 /nfs/dbraw/zinc/25/23/05/1023252305.db2.gz BAKFVDZRXZIITH-YWZLYKJASA-N 2 0 354.498 2.805 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](O)[C@H](C4CCCC4)C3)cc2)CC1 ZINC000839190792 1026616478 /nfs/dbraw/zinc/61/64/78/1026616478.db2.gz BVPAQCMUYUOYHQ-FCHUYYIVSA-N 2 0 357.542 2.811 20 10 FFCDRP C[C@@H](C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000839193861 1026617934 /nfs/dbraw/zinc/61/79/34/1026617934.db2.gz XAXFKBGZSJACGH-KRWDZBQOSA-N 2 0 361.530 2.848 20 10 FFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@@H]([NH3+])CCCC[NH+](C)C ZINC001157431949 1029585162 /nfs/dbraw/zinc/58/51/62/1029585162.db2.gz BYYGJOMLKRBMPI-LPHOPBHVSA-N 2 0 361.530 2.808 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000841103290 1030040190 /nfs/dbraw/zinc/04/01/90/1030040190.db2.gz GCAVJRPLDKLRFP-UHFFFAOYSA-N 2 0 369.509 2.874 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(I)cc2O)CC[C@@H]1C[NH3+] ZINC001205637834 1031894369 /nfs/dbraw/zinc/89/43/69/1031894369.db2.gz JESIJSXGXOCVFN-VXGBXAGGSA-N 2 0 374.266 2.804 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cc1Br ZINC001205638273 1031896812 /nfs/dbraw/zinc/89/68/12/1031896812.db2.gz LVAZEYYOJNZBHH-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(Oc4ccncc4)CC3)cc2)CC1 ZINC001139408786 1035093524 /nfs/dbraw/zinc/09/35/24/1035093524.db2.gz QVOKPDGHESIEPY-UHFFFAOYSA-N 2 0 366.509 2.877 20 10 FFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCN(C(C)=O)CC1 ZINC001139412863 1035096469 /nfs/dbraw/zinc/09/64/69/1035096469.db2.gz QJSMELVMJSCCSF-UHFFFAOYSA-N 2 0 372.557 2.661 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4noc(C)n4)C3)cc2)CC1 ZINC001140301929 1035424940 /nfs/dbraw/zinc/42/49/40/1035424940.db2.gz DOCRQZXSZRTEAG-IBGZPJMESA-N 2 0 369.513 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(c4nc(C)no4)CC3)cc2)CC1 ZINC001140305573 1035427444 /nfs/dbraw/zinc/42/74/44/1035427444.db2.gz CPURRIQSBNOFOA-UHFFFAOYSA-N 2 0 369.513 2.900 20 10 FFCDRP CCOC(=O)[C@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140306587 1035428370 /nfs/dbraw/zinc/42/83/70/1035428370.db2.gz UVPZNZRAJSDWBZ-JOCHJYFZSA-N 2 0 373.541 2.994 20 10 FFCDRP Cc1ccc(O)c(CN2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749628 /nfs/dbraw/zinc/74/96/28/1035749628.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 0 370.497 2.503 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@]34CCC[NH2+]C4)c(F)c2)CC1 ZINC001235180292 1037396735 /nfs/dbraw/zinc/39/67/35/1037396735.db2.gz VCFROCSLSDPIHT-OAQYLSRUSA-N 2 0 360.521 2.686 20 10 FFCDRP c1ccc(C[N@H+]2CCCN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235658815 1037668212 /nfs/dbraw/zinc/66/82/12/1037668212.db2.gz HFLIWBMQZZRFDF-UHFFFAOYSA-N 2 0 364.537 2.804 20 10 FFCDRP COc1ccc(Br)c(C[NH+]2CCC(C[NH+](C)C)CC2)c1O ZINC001231553005 1037675439 /nfs/dbraw/zinc/67/54/39/1037675439.db2.gz OTSQJDBAHMUQOD-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP COc1ccccc1O[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235689514 1037684107 /nfs/dbraw/zinc/68/41/07/1037684107.db2.gz ZYFXOUKGQLOWDI-FQEVSTJZSA-N 2 0 367.493 2.758 20 10 FFCDRP COCCC[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001235936683 1037844712 /nfs/dbraw/zinc/84/47/12/1037844712.db2.gz FPIYYXFMWPFSIY-UHFFFAOYSA-N 2 0 357.542 2.976 20 10 FFCDRP CCOC(=O)c1c(C[NH+]2CC3(C2)CCC[NH2+]CC3)c2ccccc2n1C ZINC001236009645 1037886725 /nfs/dbraw/zinc/88/67/25/1037886725.db2.gz NVULZSFUJSOPHI-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc(Cl)c(C)cc3O)CC[C@@H]2C1 ZINC001231867470 1037966283 /nfs/dbraw/zinc/96/62/83/1037966283.db2.gz NEADUPPLPZWPMT-DNVCBOLYSA-N 2 0 368.905 2.523 20 10 FFCDRP Cc1cc(O)c(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)cc1Cl ZINC001231871199 1037967688 /nfs/dbraw/zinc/96/76/88/1037967688.db2.gz FBSHGWPAJHFGFV-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP CN(C)c1ccc(C[NH2+][C@]23CC[C@](NCC[NH+](C)C)(C2)CCC3)c(O)c1 ZINC001278924119 1038457162 /nfs/dbraw/zinc/45/71/62/1038457162.db2.gz UTSUUWGTUAPPJU-LEWJYISDSA-N 2 0 360.546 2.544 20 10 FFCDRP Oc1cc(Cl)ccc1C[NH+]1CCC2(C[NH+](CCn3ccnc3)C2)CC1 ZINC001278557596 1041148192 /nfs/dbraw/zinc/14/81/92/1041148192.db2.gz LSSVMIDUIMNBEH-UHFFFAOYSA-N 2 0 360.889 2.840 20 10 FFCDRP COc1ccc(C[N@@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001278565448 1041190400 /nfs/dbraw/zinc/19/04/00/1041190400.db2.gz MIAFKSNYBSYWTP-OAQYLSRUSA-N 2 0 361.530 2.640 20 10 FFCDRP Oc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]CCn4ccnc4)(C2)CCC3)cc1O ZINC001279141814 1042915988 /nfs/dbraw/zinc/91/59/88/1042915988.db2.gz IQQFVYIDVNQUEL-UXHICEINSA-N 2 0 356.470 2.519 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC12C[NH2+]C2 ZINC001237431091 1043155955 /nfs/dbraw/zinc/15/59/55/1043155955.db2.gz MXKZYFDYJCMHOZ-SFHVURJKSA-N 2 0 354.450 2.520 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC12C[NH2+]C2 ZINC001237432896 1043158583 /nfs/dbraw/zinc/15/85/83/1043158583.db2.gz XMSGLQOYFHTRDK-GOSISDBHSA-N 2 0 354.450 2.520 20 10 FFCDRP Cc1cccc(O)c1C[NH+]1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001237485768 1043198476 /nfs/dbraw/zinc/19/84/76/1043198476.db2.gz LUYKXXWUKCABPS-UHFFFAOYSA-N 2 0 370.497 2.503 20 10 FFCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001237489536 1043203688 /nfs/dbraw/zinc/20/36/88/1043203688.db2.gz YVXADIDKUJUIEV-DENIHFKCSA-N 2 0 367.493 2.819 20 10 FFCDRP COc1cc(CN2CCC[C@@]3(CCC[N@H+](C)C3)C2)cc(C[NH+](C)C)c1O ZINC001279698519 1043490389 /nfs/dbraw/zinc/49/03/89/1043490389.db2.gz NEXXJLUUBGRSDR-OAQYLSRUSA-N 2 0 361.530 2.770 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC4(CC[N@@H+]4C4CCCC4)C3)cc2)CC1 ZINC001279709837 1043509911 /nfs/dbraw/zinc/50/99/11/1043509911.db2.gz LGXYMFWANZVCTG-UHFFFAOYSA-N 2 0 354.542 2.641 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@H](O)c1ccccc1 ZINC001329836868 1048932647 /nfs/dbraw/zinc/93/26/47/1048932647.db2.gz YROIZRHEFKQYER-IERDGZPVSA-N 2 0 357.473 2.789 20 10 FFCDRP CCc1cccc(C[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1O ZINC000848896134 1055323608 /nfs/dbraw/zinc/32/36/08/1055323608.db2.gz SOEIDNFNABRBJX-UHFFFAOYSA-N 2 0 355.482 2.536 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c(O)c1 ZINC001461994310 1061473200 /nfs/dbraw/zinc/47/32/00/1061473200.db2.gz GTJSNIILNDRYHB-LJQANCHMSA-N 2 0 370.493 2.956 20 10 FFCDRP COc1c([O-])c(C[N@@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463762 1061633932 /nfs/dbraw/zinc/63/39/32/1061633932.db2.gz WHQWJVJERGETJW-DZGCQCFKSA-N 2 0 351.447 2.861 20 10 FFCDRP CC(C)[C@H](C(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1)[NH+]1CCCCC1 ZINC001558123409 1075947084 /nfs/dbraw/zinc/94/70/84/1075947084.db2.gz DXAYTPKUTPDXDB-OAQYLSRUSA-N 2 0 372.557 2.565 20 10 FFCDRP Cc1ccc(O)c(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000113339857 508261633 /nfs/dbraw/zinc/26/16/33/508261633.db2.gz DSZJKXYOSCRYQO-LJQANCHMSA-N 2 0 367.493 2.688 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C[C@@H](C(C)C)N3CC[NH+](C)CC3)CC2)cc1 ZINC000132472076 509037353 /nfs/dbraw/zinc/03/73/53/509037353.db2.gz YEEVCCDROJJLTM-QFIPXVFZSA-N 2 0 374.573 2.526 20 10 FFCDRP CCOc1ccc(O)c(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000271172716 511107294 /nfs/dbraw/zinc/10/72/94/511107294.db2.gz AKJYODAGHTYQKD-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000273596478 511546233 /nfs/dbraw/zinc/54/62/33/511546233.db2.gz QWQPBLKUHYCMAJ-QGZVFWFLSA-N 2 0 370.497 2.659 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000370697441 513058926 /nfs/dbraw/zinc/05/89/26/513058926.db2.gz GGUJYQSFRLCXQZ-SIKLNZKXSA-N 2 0 358.574 2.991 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1O ZINC000530249739 517656154 /nfs/dbraw/zinc/65/61/54/517656154.db2.gz YJBWADZJYDKACQ-MRXNPFEDSA-N 2 0 354.878 2.645 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1O ZINC000725846021 734395869 /nfs/dbraw/zinc/39/58/69/734395869.db2.gz UMFJXVVGZYUDFZ-ZIAGYGMSSA-N 2 0 355.276 2.880 20 10 FFCDRP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502161 738097825 /nfs/dbraw/zinc/09/78/25/738097825.db2.gz PDJPOMRMWGYCQI-BBRMVZONSA-N 2 0 353.894 2.674 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3OCCc4sccc43)cc2)CC1 ZINC000922438108 738145131 /nfs/dbraw/zinc/14/51/31/738145131.db2.gz QABUWVAPQSRYGZ-IBGZPJMESA-N 2 0 357.523 2.904 20 10 FFCDRP CN(C)c1ccc(CN(CC[NH+](C)C)CC[NH+](C)C)c(C(F)(F)F)c1 ZINC000809741139 741339042 /nfs/dbraw/zinc/33/90/42/741339042.db2.gz KLJXPLCMJGYYCD-UHFFFAOYSA-N 2 0 360.468 2.697 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000844910436 748134385 /nfs/dbraw/zinc/13/43/85/748134385.db2.gz IBKRXVCHAFMWRK-XHSDSOJGSA-N 2 0 354.878 2.915 20 10 FFCDRP CCC1([NH+]2CCC2)CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000895828043 970975446 /nfs/dbraw/zinc/97/54/46/970975446.db2.gz SIMWGQPQWNPKCJ-UHFFFAOYSA-N 3 0 356.558 2.889 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(O)c1OC ZINC000892610038 969589007 /nfs/dbraw/zinc/58/90/07/969589007.db2.gz FVKZPFFHWHMNMF-UHFFFAOYSA-N 2 0 360.454 2.640 20 10 FFCDRP C[NH2+]Cc1ccccc1NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000904506925 980289298 /nfs/dbraw/zinc/28/92/98/980289298.db2.gz RUXMOQVTQHWXCZ-FQEVSTJZSA-N 2 0 369.513 2.896 20 10 FFCDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000921666879 986139382 /nfs/dbraw/zinc/13/93/82/986139382.db2.gz XARBPGOGJCPLHH-UHFFFAOYSA-N 2 0 367.493 2.593 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000184887440 993066347 /nfs/dbraw/zinc/06/63/47/993066347.db2.gz CVXCWAYMPJDTHK-GOSISDBHSA-N 2 0 369.509 2.869 20 10 FFCDRP Oc1ccccc1C[N@H+](C[C@@H]1CCCO1)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719175 1016149739 /nfs/dbraw/zinc/14/97/39/1016149739.db2.gz WJRCFTNDNHXMLX-OALUTQOASA-N 2 0 360.498 2.532 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1O ZINC000846153759 1000210865 /nfs/dbraw/zinc/21/08/65/1000210865.db2.gz IAUXQCFVIVVAGW-OAHLLOKOSA-N 2 0 371.481 2.543 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1O ZINC000846140931 1000217839 /nfs/dbraw/zinc/21/78/39/1000217839.db2.gz AGFCZBPAOSQIGW-QGZVFWFLSA-N 2 0 370.497 2.659 20 10 FFCDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768450104 1000250769 /nfs/dbraw/zinc/25/07/69/1000250769.db2.gz HVLKDBIHFQOTTF-FQEVSTJZSA-N 2 0 356.466 2.902 20 10 FFCDRP COc1cc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c(O)cc1C ZINC000768461831 1000261579 /nfs/dbraw/zinc/26/15/79/1000261579.db2.gz FWRBSQCDUNENSL-UHFFFAOYSA-N 2 0 361.530 2.700 20 10 FFCDRP Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737498 1003900924 /nfs/dbraw/zinc/90/09/24/1003900924.db2.gz NKKVCWNCFAOSSW-NRFANRHFSA-N 2 0 353.514 2.817 20 10 FFCDRP CCOC(=O)CC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775650755 1004947926 /nfs/dbraw/zinc/94/79/26/1004947926.db2.gz VRNLZLDGTJXTSM-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4cc[nH]n4)o3)cc2)CC1 ZINC000883283682 1006731281 /nfs/dbraw/zinc/73/12/81/1006731281.db2.gz OPJFDFJZGFRSNT-UHFFFAOYSA-N 2 0 351.454 2.711 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c(O)c1 ZINC000817413710 1007591701 /nfs/dbraw/zinc/59/17/01/1007591701.db2.gz ALZFZNBLJPPCCX-UHFFFAOYSA-N 2 0 361.530 2.783 20 10 FFCDRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773143531 1009704239 /nfs/dbraw/zinc/70/42/39/1009704239.db2.gz AUAMWQOXZXXOKW-JPYJTQIMSA-N 2 0 368.569 2.791 20 10 FFCDRP CN(C)c1ccc(C[N@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000190316291 1023614567 /nfs/dbraw/zinc/61/45/67/1023614567.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 0 353.510 2.821 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)C(=O)NCC[NH+](C)C ZINC000756858417 1023760130 /nfs/dbraw/zinc/76/01/30/1023760130.db2.gz PGWHTHSCBSSOBL-BPUTZDHNSA-N 2 0 365.493 2.762 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@@H]3COc4ccccc4O3)cc2)CC1 ZINC000841887955 1030522109 /nfs/dbraw/zinc/52/21/09/1030522109.db2.gz AWWIFMLRWPDOSA-HXUWFJFHSA-N 2 0 367.493 2.758 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC2(CC1)COCC[N@H+](Cc1cccnc1)C2 ZINC001203556445 1030767157 /nfs/dbraw/zinc/76/71/57/1030767157.db2.gz QAYAPZMSGPILMC-UHFFFAOYSA-N 2 0 367.493 2.902 20 10 FFCDRP COc1cccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001203591999 1030776453 /nfs/dbraw/zinc/77/64/53/1030776453.db2.gz AAOJTBVZEPBNOB-UHFFFAOYSA-N 2 0 370.497 2.642 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001203608498 1030784100 /nfs/dbraw/zinc/78/41/00/1030784100.db2.gz RLBOELVTAHCDGH-DENIHFKCSA-N 2 0 374.525 2.971 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000843341539 1031336929 /nfs/dbraw/zinc/33/69/29/1031336929.db2.gz UOFBLEWLWWXPAO-BHDDXSALSA-N 3 0 368.569 2.696 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205654157 1031908070 /nfs/dbraw/zinc/90/80/70/1031908070.db2.gz WOHLPRFDPMFMDS-JKSUJKDBSA-N 2 0 351.922 2.983 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3c4ccccc4n(C)c3C)CC[C@@H]2C1 ZINC001138255670 1034024631 /nfs/dbraw/zinc/02/46/31/1034024631.db2.gz OVSWRPDDYUJTLQ-XMSQKQJNSA-N 2 0 371.525 2.656 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3ccc(C)cn3)C2)cc(C[NH+](C)C)c1O ZINC001139260413 1035032003 /nfs/dbraw/zinc/03/20/03/1035032003.db2.gz LOKKGMXJBRLJLD-SFHVURJKSA-N 2 0 371.481 2.819 20 10 FFCDRP CCc1nc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)no1 ZINC001139413553 1035097154 /nfs/dbraw/zinc/09/71/54/1035097154.db2.gz WGEXVEFFHHORPM-UHFFFAOYSA-N 2 0 369.513 2.763 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4noc(C)n4)C3)cc2)CC1 ZINC001140301930 1035424969 /nfs/dbraw/zinc/42/49/69/1035424969.db2.gz DOCRQZXSZRTEAG-LJQANCHMSA-N 2 0 369.513 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001140304395 1035426219 /nfs/dbraw/zinc/42/62/19/1035426219.db2.gz NHDVDXBRVDPBBZ-LJQANCHMSA-N 2 0 373.541 2.992 20 10 FFCDRP CCCNC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304701 1035426385 /nfs/dbraw/zinc/42/63/85/1035426385.db2.gz YSJMIHPGFXQIKO-NRFANRHFSA-N 2 0 372.557 2.709 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@@H]3C[NH+]3CCCC3)cc2)CC1 ZINC001140304103 1035426463 /nfs/dbraw/zinc/42/64/63/1035426463.db2.gz IHVRLBYCXXSNML-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP C[C@@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000835027007 1035490076 /nfs/dbraw/zinc/49/00/76/1035490076.db2.gz AMWWEHWDWUPANB-LNGTVFGOSA-N 2 0 356.558 2.724 20 10 FFCDRP Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1C ZINC000835075579 1035512241 /nfs/dbraw/zinc/51/22/41/1035512241.db2.gz YSDCIVDRZDUVQO-JOCHJYFZSA-N 2 0 367.537 2.748 20 10 FFCDRP Cc1c(O)ccc(CN2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047800 /nfs/dbraw/zinc/04/78/00/1036047800.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 0 360.498 2.729 20 10 FFCDRP Oc1cc(O)c(CN2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487297 1036656401 /nfs/dbraw/zinc/65/64/01/1036656401.db2.gz XWAHNSRBHGLXHL-WMZOPIPTSA-N 2 0 354.450 2.757 20 10 FFCDRP Cc1cc(C[NH+]2CCN(C3CC[NH2+]CC3)CC2)c(C)n1-c1ccccc1 ZINC001235699090 1037696758 /nfs/dbraw/zinc/69/67/58/1037696758.db2.gz LKOPNNXKPDALCR-UHFFFAOYSA-N 2 0 352.526 2.964 20 10 FFCDRP CC1(N2CC[NH+](Cc3ccc(C(F)(F)F)cc3O)CC2)CC[NH2+]CC1 ZINC001235821884 1037766723 /nfs/dbraw/zinc/76/67/23/1037766723.db2.gz NENIAWAKMVODDN-UHFFFAOYSA-N 2 0 357.420 2.671 20 10 FFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@@]3(CCN(CC[NH+](C)C)C3=O)C2)c(O)c1 ZINC001277976763 1037857618 /nfs/dbraw/zinc/85/76/18/1037857618.db2.gz WBZXVVKIACOFIH-OAQYLSRUSA-N 2 0 359.514 2.502 20 10 FFCDRP CCOCC[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001236461691 1038097420 /nfs/dbraw/zinc/09/74/20/1038097420.db2.gz OTSGCQAIWMQVSI-UHFFFAOYSA-N 2 0 357.542 2.976 20 10 FFCDRP Cc1cc(O)c(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)cc1Br ZINC001236931493 1038364179 /nfs/dbraw/zinc/36/41/79/1038364179.db2.gz HUEJLSHBFUBGEG-HNNXBMFYSA-N 2 0 370.335 2.579 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)ccc1N(C)C ZINC001278686338 1039774400 /nfs/dbraw/zinc/77/44/00/1039774400.db2.gz LZDBBLKVXOKZBD-QFIPXVFZSA-N 2 0 358.574 2.911 20 10 FFCDRP Oc1ccc(O)c(C[N@@H+]2CCC[C@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278751421 1040474705 /nfs/dbraw/zinc/47/47/05/1040474705.db2.gz ZTRDTBSCOHSGGC-FQEVSTJZSA-N 2 0 356.470 2.699 20 10 FFCDRP Cc1c(O)ccc(C[NH+]2CCC3(CC[N@H+](Cc4cn[nH]c4)C3)CC2)c1O ZINC001279311420 1042995035 /nfs/dbraw/zinc/99/50/35/1042995035.db2.gz APMWYDDEYMUNEY-UHFFFAOYSA-N 2 0 356.470 2.617 20 10 FFCDRP CN(C)c1ccc(CN2[C@@H]3CC[C@H]2CN(CC[NH+](C)C)C3)c(Cl)c1 ZINC001279334038 1043008834 /nfs/dbraw/zinc/00/88/34/1043008834.db2.gz YYJOCXITVZIDAE-HDICACEKSA-N 2 0 350.938 2.616 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3c(C)cc(C)cc3O)C[C@H]2CC1 ZINC001279433492 1043107536 /nfs/dbraw/zinc/10/75/36/1043107536.db2.gz XTGOPEGWIKGFFI-KDURUIRLSA-N 2 0 362.514 2.773 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC12C[NH2+]C2 ZINC001237432897 1043158694 /nfs/dbraw/zinc/15/86/94/1043158694.db2.gz XMSGLQOYFHTRDK-SFHVURJKSA-N 2 0 354.450 2.520 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c1O ZINC001279476528 1043159882 /nfs/dbraw/zinc/15/98/82/1043159882.db2.gz QMIYAKMRKRHIGV-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)cc1Cl ZINC001279572201 1043276229 /nfs/dbraw/zinc/27/62/29/1043276229.db2.gz XWMSASQAOGVWGD-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC001319717848 1045250728 /nfs/dbraw/zinc/25/07/28/1045250728.db2.gz LTHHCIHSRLCCRA-SIKLNZKXSA-N 2 0 356.558 2.745 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC001320425413 1045406428 /nfs/dbraw/zinc/40/64/28/1045406428.db2.gz YCZXFRUDEKYWDI-IKGGRYGDSA-N 2 0 361.530 2.931 20 10 FFCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC001324398633 1046006353 /nfs/dbraw/zinc/00/63/53/1046006353.db2.gz VPTQWTZIXUJREI-QFIPXVFZSA-N 2 0 356.558 2.887 20 10 FFCDRP C[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[C@@H]([NH3+])c1ccccc1 ZINC001343048101 1051664638 /nfs/dbraw/zinc/66/46/38/1051664638.db2.gz SSEITVYFIFBHHD-ORYQWCPZSA-N 2 0 368.525 2.808 20 10 FFCDRP CC[NH+](CC)C[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001337042713 1054434503 /nfs/dbraw/zinc/43/45/03/1054434503.db2.gz SJYGYBABGSFIIQ-IBGZPJMESA-N 3 0 362.537 2.741 20 10 FFCDRP Fc1cc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)ccc1N1CCOCC1 ZINC000849350710 1056835321 /nfs/dbraw/zinc/83/53/21/1056835321.db2.gz SHYQEPRXDMQPGY-LJQANCHMSA-N 2 0 361.505 2.874 20 10 FFCDRP C[NH+]1CCN(Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCO4)c2)CC1 ZINC001461142733 1061223193 /nfs/dbraw/zinc/22/31/93/1061223193.db2.gz SNRFULGWDYUKJF-UHFFFAOYSA-N 2 0 351.494 2.659 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@](C)(CO)Cc3ccccc3F)cc2)CC1 ZINC001560548736 1076279126 /nfs/dbraw/zinc/27/91/26/1076279126.db2.gz ZFHVFGWFSJETMG-QFIPXVFZSA-N 2 0 371.500 2.661 20 10 FFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000279814127 511225061 /nfs/dbraw/zinc/22/50/61/511225061.db2.gz FPMXTFWJZXEDSR-HNNXBMFYSA-N 2 0 372.479 2.887 20 10 FFCDRP CC(C)[C@@H](C[NH2+]Cc1c(O)cccc1Br)N1CC[NH+](C)CC1 ZINC000858094975 730416340 /nfs/dbraw/zinc/41/63/40/730416340.db2.gz RGHCYGBBVKJSPY-MRXNPFEDSA-N 2 0 370.335 2.516 20 10 FFCDRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1O ZINC000756407863 736328512 /nfs/dbraw/zinc/32/85/12/736328512.db2.gz GACAPBFEDIBWRV-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898620 742221268 /nfs/dbraw/zinc/22/12/68/742221268.db2.gz IEMRKNKZDLOIRA-HUUCEWRRSA-N 2 0 357.445 2.600 20 10 FFCDRP C[C@@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817971973 742225448 /nfs/dbraw/zinc/22/54/48/742225448.db2.gz IHQWGDWXUUQWON-YGRLFVJLSA-N 2 0 351.800 2.532 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)c1O ZINC000841099871 747268995 /nfs/dbraw/zinc/26/89/95/747268995.db2.gz PTGNWCIPQXVQRW-CRAIPNDOSA-N 2 0 354.878 2.773 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@@H]3OCC[C@H]3[NH3+])CC2)c1O ZINC000843389095 747822020 /nfs/dbraw/zinc/82/20/20/747822020.db2.gz GTTBLYVSSIOYLZ-AEFFLSMTSA-N 2 0 352.862 2.576 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(Nc4ccccn4)CC3)cc2)CC1 ZINC000896195705 971330988 /nfs/dbraw/zinc/33/09/88/971330988.db2.gz OJEJTLLBPSNYOW-UHFFFAOYSA-N 2 0 365.525 2.910 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)CCCC[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000891255977 962619449 /nfs/dbraw/zinc/61/94/49/962619449.db2.gz UNUKECDHBIEOGG-HXUWFJFHSA-N 2 0 360.546 2.738 20 10 FFCDRP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444977 1000250614 /nfs/dbraw/zinc/25/06/14/1000250614.db2.gz DHVVIRPBRDVUSS-OAQYLSRUSA-N 2 0 357.542 2.873 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cn3cccn3)C(C)C)cc2F)CC1 ZINC000788594451 1001828602 /nfs/dbraw/zinc/82/86/02/1001828602.db2.gz MTEDWQGISBDOQX-FQEVSTJZSA-N 2 0 373.520 2.979 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CCO)c1ccccc1 ZINC000775698624 1003704566 /nfs/dbraw/zinc/70/45/66/1003704566.db2.gz PMHBCLAMJQATAW-QFIPXVFZSA-N 2 0 353.510 2.994 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c3OCCCO4)cc2)CC1 ZINC000883283309 1006729979 /nfs/dbraw/zinc/72/99/79/1006729979.db2.gz ABLYCJMCSQVUCD-UHFFFAOYSA-N 2 0 367.493 2.890 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4ccccc4c3O)cn2)CC1 ZINC000816533722 1007099312 /nfs/dbraw/zinc/09/93/12/1007099312.db2.gz HXDQUHNMZNDWIJ-UHFFFAOYSA-N 2 0 362.477 2.982 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc(F)c1N1CCOCC1 ZINC000817937303 1007816881 /nfs/dbraw/zinc/81/68/81/1007816881.db2.gz XVZBWAISXBHCMA-AYOQOUSVSA-N 2 0 365.468 2.812 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942908 1007818159 /nfs/dbraw/zinc/81/81/59/1007818159.db2.gz RMRASBAXCXJMNN-URVUXULASA-N 3 0 366.509 2.598 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554323 1007884611 /nfs/dbraw/zinc/88/46/11/1007884611.db2.gz QZUPNCKPIYQMCR-SFHVURJKSA-N 2 0 371.481 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3COC4(CCCCCC4)O3)cc2)CC1 ZINC000776958277 1008201564 /nfs/dbraw/zinc/20/15/64/1008201564.db2.gz CAMVCXKYOBYWTM-NRFANRHFSA-N 2 0 373.541 2.994 20 10 FFCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249905 1008914563 /nfs/dbraw/zinc/91/45/63/1008914563.db2.gz WJJXAMLBSFWWLD-OAQYLSRUSA-N 3 0 358.574 2.896 20 10 FFCDRP C[NH+](C)CCOCC[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC000796356029 1012307992 /nfs/dbraw/zinc/30/79/92/1012307992.db2.gz JYKDWKXWIIQVQP-UHFFFAOYSA-N 2 0 353.510 2.917 20 10 FFCDRP C[C@H](Cn1cccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000123234824 1012495649 /nfs/dbraw/zinc/49/56/49/1012495649.db2.gz MZGBABDKPZDAAQ-GOSISDBHSA-N 2 0 353.514 2.593 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000809750457 1013019169 /nfs/dbraw/zinc/01/91/69/1013019169.db2.gz XCKGYUJEONFFLH-LJQANCHMSA-N 2 0 373.541 2.992 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000902519230 1020250401 /nfs/dbraw/zinc/25/04/01/1020250401.db2.gz YCOWUSIDGJQZJM-VFNWGFHPSA-N 2 0 355.530 2.868 20 10 FFCDRP Cc1cc(N2CCCC2)nc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]1 ZINC001156651552 1029286084 /nfs/dbraw/zinc/28/60/84/1029286084.db2.gz OIIRURLUHYZQCL-UHFFFAOYSA-N 2 0 366.513 2.749 20 10 FFCDRP CCN(Cc1ccccc1)c1ccc(C[NH2+]CCN2CC[NH2+]CC2)cc1 ZINC000841045019 1030000095 /nfs/dbraw/zinc/00/00/95/1030000095.db2.gz KMPSMYACDDDCAH-UHFFFAOYSA-N 2 0 352.526 2.708 20 10 FFCDRP CO[C@]1(C(F)(F)F)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000783718265 1030249548 /nfs/dbraw/zinc/24/95/48/1030249548.db2.gz PUPMHLUVUUBLPL-GOSISDBHSA-N 2 0 371.447 2.982 20 10 FFCDRP CN(C)c1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)cc1 ZINC001203931999 1030991455 /nfs/dbraw/zinc/99/14/55/1030991455.db2.gz NQGRIDGLWQOGNK-UHFFFAOYSA-N 2 0 353.514 2.603 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCC[NH3+])Cc3ccccc3)cc2)CC1 ZINC000843107832 1031187670 /nfs/dbraw/zinc/18/76/70/1031187670.db2.gz JNXPPHYXCJINIC-UHFFFAOYSA-N 3 0 352.526 2.789 20 10 FFCDRP COc1cc(CN2CC[NH+](C3CCCCC3)CC2)cc(C[NH+](C)C)c1O ZINC001139253408 1035030699 /nfs/dbraw/zinc/03/06/99/1035030699.db2.gz UQZLECADZCSURT-UHFFFAOYSA-N 2 0 361.530 2.913 20 10 FFCDRP CCOC(=O)[C@H]1CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)[C@@H]1C ZINC001139258893 1035031230 /nfs/dbraw/zinc/03/12/30/1035031230.db2.gz ZUUASZBMNZVVBK-PBHICJAKSA-N 2 0 364.486 2.626 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](O)[C@@H]3Cc3ccccc3)cc2)CC1 ZINC001139407525 1035093050 /nfs/dbraw/zinc/09/30/50/1035093050.db2.gz FVRIYUNDGRFAIX-XZOQPEGZSA-N 2 0 365.521 2.616 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@H]4CCO)CC3)cc2)CC1 ZINC001140302136 1035425650 /nfs/dbraw/zinc/42/56/50/1035425650.db2.gz KXWNEFSUNCHZMU-HXUWFJFHSA-N 2 0 357.542 2.813 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(c4noc(C)n4)CC3)cc2)CC1 ZINC001140303918 1035426232 /nfs/dbraw/zinc/42/62/32/1035426232.db2.gz DWAKWWWKLNKYBN-UHFFFAOYSA-N 2 0 369.513 2.900 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCN(C)CC34CCCC4)cc2)CC1 ZINC001140309292 1035429734 /nfs/dbraw/zinc/42/97/34/1035429734.db2.gz AHIIEEKAQZUZFF-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP CN(C)c1ccc(/C=C\CN2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028821 1035489866 /nfs/dbraw/zinc/48/98/66/1035489866.db2.gz SRTFUQUTRSVFCS-DYRFGFBLSA-N 2 0 356.558 2.868 20 10 FFCDRP CCOC(=O)c1c(C[NH+]2CCC3(CC[NH2+]C3)CC2)c2ccccc2n1C ZINC001235103752 1037364289 /nfs/dbraw/zinc/36/42/89/1037364289.db2.gz KKTCFNHJUJHAHV-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001235693084 1037688152 /nfs/dbraw/zinc/68/81/52/1037688152.db2.gz RCLOVJLMUISFOI-NRFANRHFSA-N 2 0 367.493 2.845 20 10 FFCDRP Cc1cccnc1O[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001236535599 1038122838 /nfs/dbraw/zinc/12/28/38/1038122838.db2.gz IMUZUSQDPQUGFF-GOSISDBHSA-N 2 0 369.465 2.621 20 10 FFCDRP CCC[NH+](CCC)CCN1CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001236812114 1038284965 /nfs/dbraw/zinc/28/49/65/1038284965.db2.gz ZOAXVWQXQKUCTH-UHFFFAOYSA-N 2 0 363.546 2.949 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4ccncc4)C3)c(F)c2)CC1 ZINC001236942637 1038371128 /nfs/dbraw/zinc/37/11/28/1038371128.db2.gz LEMVPLMHCJHDGF-FQEVSTJZSA-N 2 0 370.472 2.626 20 10 FFCDRP Cc1ccnn1C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236945443 1038372765 /nfs/dbraw/zinc/37/27/65/1038372765.db2.gz IQYRGYXANVHOQK-UHFFFAOYSA-N 2 0 371.504 2.920 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCCCC4)C3)cc2)CC1 ZINC001246184745 1039268954 /nfs/dbraw/zinc/26/89/54/1039268954.db2.gz PBUFJABHTXCAAZ-FQEVSTJZSA-N 3 0 356.558 2.983 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@@H]4CCCC[NH2+]C4)C3)C2)cc1 ZINC001246704093 1039443785 /nfs/dbraw/zinc/44/37/85/1039443785.db2.gz OQUZRRMRMGREFG-IRLDBZIGSA-N 2 0 373.541 2.756 20 10 FFCDRP Oc1ccc(F)cc1C[N@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279197419 1042941725 /nfs/dbraw/zinc/94/17/25/1042941725.db2.gz VHGQOZWWRHIQTD-CALCHBBNSA-N 2 0 358.461 2.572 20 10 FFCDRP Cc1cc(C)c(C[NH+]2CCC3(C[NH+](CCn4ccnc4)C3)CC2)c(O)c1 ZINC001279432858 1043107339 /nfs/dbraw/zinc/10/73/39/1043107339.db2.gz OMABWZVVQPVPTR-UHFFFAOYSA-N 2 0 354.498 2.804 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(N(CC)CC)cc2)CCC12C[NH2+]C2 ZINC001237413379 1043149161 /nfs/dbraw/zinc/14/91/61/1043149161.db2.gz WVSKBRZHZYZTDT-IBGZPJMESA-N 2 0 359.514 2.507 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC001326037775 1046737487 /nfs/dbraw/zinc/73/74/87/1046737487.db2.gz YAPDTALBJNXZTH-VNHYZAJKSA-N 2 0 357.420 2.675 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001328087272 1048172355 /nfs/dbraw/zinc/17/23/55/1048172355.db2.gz WCEOSKYBSRBAFG-RDJZCZTQSA-N 2 0 359.514 2.829 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(O)c1 ZINC001308671502 1052484488 /nfs/dbraw/zinc/48/44/88/1052484488.db2.gz ATVWVLOSADSIRY-UHFFFAOYSA-N 2 0 361.530 2.559 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCN(C(=O)C(C)(C)C)CC3)cc2)CC1 ZINC000848566784 1060286601 /nfs/dbraw/zinc/28/66/01/1060286601.db2.gz IPEGEGGTRMUTJJ-UHFFFAOYSA-N 2 0 372.557 2.565 20 10 FFCDRP C[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001472281311 1064998484 /nfs/dbraw/zinc/99/84/84/1064998484.db2.gz VBFIUUQCQZBJNV-YZLZLFLDSA-N 2 0 360.546 2.733 20 10 FFCDRP CCOc1ccc(O)c(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c1 ZINC000377701160 512407665 /nfs/dbraw/zinc/40/76/65/512407665.db2.gz SBXMCCCPJXKGIY-DFNIBXOVSA-N 2 0 359.514 2.534 20 10 FFCDRP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155687128 509052579 /nfs/dbraw/zinc/05/25/79/509052579.db2.gz GGYBREJOEJLVPI-CZUORRHYSA-N 2 0 370.335 2.831 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1O ZINC000530240420 517646997 /nfs/dbraw/zinc/64/69/97/517646997.db2.gz ZYYWGVDKSRXPHS-QGZVFWFLSA-N 2 0 366.889 2.839 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]CCCN2CCC[N@H+](C)CC2)cc1F ZINC000152190764 728749505 /nfs/dbraw/zinc/74/95/05/728749505.db2.gz ORFVVDNOHJUDGB-UHFFFAOYSA-N 2 0 350.526 2.789 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1O ZINC000761195225 736705747 /nfs/dbraw/zinc/70/57/47/736705747.db2.gz KKYXKZFLHHFGCF-UHFFFAOYSA-N 2 0 368.905 2.989 20 10 FFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000761203849 736707453 /nfs/dbraw/zinc/70/74/53/736707453.db2.gz MSXZCJSRBRHNGH-MRXNPFEDSA-N 2 0 356.894 2.987 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2Cc1ccc(Br)cc1O ZINC000824938763 743182348 /nfs/dbraw/zinc/18/23/48/743182348.db2.gz LUULCDPFYKWNSI-BFYDXBDKSA-N 2 0 369.303 2.838 20 10 FFCDRP Cc1noc2ncc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cc12 ZINC000895608855 970783328 /nfs/dbraw/zinc/78/33/28/970783328.db2.gz UXLIPALBTFNZRM-UHFFFAOYSA-N 2 0 351.454 2.573 20 10 FFCDRP Cc1cccc(O)c1C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000877028190 1014453941 /nfs/dbraw/zinc/45/39/41/1014453941.db2.gz VRSDFDXLNATYLN-LJQANCHMSA-N 2 0 367.493 2.688 20 10 FFCDRP COc1ccc(C[NH2+]C[C@@H]2CN(C(=O)CCC[NH+](C)C)C[C@H]2C)cc1C ZINC001106599804 988465791 /nfs/dbraw/zinc/46/57/91/988465791.db2.gz OFKDCEIYCLVJCC-IEBWSBKVSA-N 2 0 361.530 2.530 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC(C[NH+](C)C)CC2)c(Br)c1 ZINC001237060475 992008473 /nfs/dbraw/zinc/00/84/73/992008473.db2.gz SBGVVORIARWVNM-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP COc1cccc(C[N@H+](C)CCN2CCN(Cc3ccccc3)CC2)c1O ZINC000809693740 994571295 /nfs/dbraw/zinc/57/12/95/994571295.db2.gz AKZRCBIQPXIOHA-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP COc1ccc2ccc(O)c(C[NH+]3CCN([C@H]4CCC[N@H+](C)C4)CC3)c2c1 ZINC000738215047 999622565 /nfs/dbraw/zinc/62/25/65/999622565.db2.gz RRFYQHNMSKAFPP-SFHVURJKSA-N 2 0 369.509 2.766 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC(C[NH+]3CCCCCC3)CC1)[C@H](O)CO2 ZINC000768439111 1000248436 /nfs/dbraw/zinc/24/84/36/1000248436.db2.gz HPTZRJQQEXLAPV-HXUWFJFHSA-N 2 0 360.498 2.906 20 10 FFCDRP CN(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(F)c1 ZINC001198959778 1004794541 /nfs/dbraw/zinc/79/45/41/1004794541.db2.gz PVJYNOYEKFDQPK-JOCHJYFZSA-N 2 0 370.516 2.970 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850357366 1005810760 /nfs/dbraw/zinc/81/07/60/1005810760.db2.gz HDEGZZWSKRHNIU-IBGZPJMESA-N 2 0 356.466 2.647 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCn4nccc43)cc2F)CC1 ZINC000850432599 1005815278 /nfs/dbraw/zinc/81/52/78/1005815278.db2.gz CHPOSGQXGNYFRV-GOSISDBHSA-N 2 0 357.477 2.789 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850508379 1005819275 /nfs/dbraw/zinc/81/92/75/1005819275.db2.gz MDKVNYWUFAYXMF-CRAIPNDOSA-N 2 0 356.466 2.818 20 10 FFCDRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC000883283931 1006731770 /nfs/dbraw/zinc/73/17/70/1006731770.db2.gz ZEOBTCBWTFQWHU-KPFFTGBYSA-N 2 0 359.514 2.506 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898485 1007802187 /nfs/dbraw/zinc/80/21/87/1007802187.db2.gz HGIGSYUHNAUKDV-DFEHZGFQSA-N 2 0 369.456 2.599 20 10 FFCDRP NC1(C[NH2+][C@H]2CCc3cccc(O)c32)CC[NH+](Cc2ccccc2)CC1 ZINC000817984614 1007838146 /nfs/dbraw/zinc/83/81/46/1007838146.db2.gz VUQXPSSBKMSNJZ-IBGZPJMESA-N 2 0 351.494 2.963 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205545676 1007848398 /nfs/dbraw/zinc/84/83/98/1007848398.db2.gz LQFZEWAFYIZYIK-OAHLLOKOSA-N 2 0 361.255 2.816 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554321 1007884529 /nfs/dbraw/zinc/88/45/29/1007884529.db2.gz QZUPNCKPIYQMCR-GOSISDBHSA-N 2 0 371.481 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3c(F)cccc3F)cc2)CC1 ZINC000886215173 1008603288 /nfs/dbraw/zinc/60/32/88/1008603288.db2.gz FMPUOKUITBWMOT-IBGZPJMESA-N 2 0 361.436 2.540 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@](C)(O)c1ccccc1 ZINC000822517347 1008664572 /nfs/dbraw/zinc/66/45/72/1008664572.db2.gz WHYSRIVUGQEYPV-QFIPXVFZSA-N 2 0 353.510 2.778 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@@H+]1C ZINC000773145614 1009668832 /nfs/dbraw/zinc/66/88/32/1009668832.db2.gz KELGADJYXUYIDH-WIYYLYMNSA-N 3 0 356.558 2.791 20 10 FFCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1[N+](=O)[O-] ZINC000865786825 1010862978 /nfs/dbraw/zinc/86/29/78/1010862978.db2.gz DTPFHFXJIUKEQH-UHFFFAOYSA-N 2 0 354.454 2.945 20 10 FFCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC(C(N)=O)CC2)cc1 ZINC000925778722 1017847255 /nfs/dbraw/zinc/84/72/55/1017847255.db2.gz WYMYZLXURHFDOK-YLJYHZDGSA-N 2 0 372.557 2.789 20 10 FFCDRP Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCNC2(CC[NH2+]CC2)C1 ZINC001222105266 1032760578 /nfs/dbraw/zinc/76/05/78/1032760578.db2.gz YFFUFWIWXJSUBG-UHFFFAOYSA-N 2 0 355.457 2.726 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC4(CCCC[NH2+]4)CC3)cc2)CC1 ZINC001222292710 1032872862 /nfs/dbraw/zinc/87/28/62/1032872862.db2.gz JALHXDWUMYQYJB-UHFFFAOYSA-N 2 0 356.558 2.937 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]2C1 ZINC001120070879 1023229064 /nfs/dbraw/zinc/22/90/64/1023229064.db2.gz CPVQVNSJMPUQAL-TUNNFDKTSA-N 3 0 356.558 2.601 20 10 FFCDRP CCOc1ccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c(O)c1 ZINC000840969288 1029951028 /nfs/dbraw/zinc/95/10/28/1029951028.db2.gz DOPPJOURJWYHBS-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3C[C@@H](c4cccc(F)c4)[C@H]([NH3+])C3)cc2)CC1 ZINC000841104721 1030040159 /nfs/dbraw/zinc/04/01/59/1030040159.db2.gz YTABHGABLCVEDT-FCHUYYIVSA-N 2 0 368.500 2.504 20 10 FFCDRP CN(C)c1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)cc1 ZINC001203933782 1030992095 /nfs/dbraw/zinc/99/20/95/1030992095.db2.gz QLIJVFBVAHBEIQ-UHFFFAOYSA-N 2 0 367.541 2.993 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCC[C@@H](C[NH2+]C)C2)c(O)c1 ZINC001205016905 1031487149 /nfs/dbraw/zinc/48/71/49/1031487149.db2.gz LNBJXPBRAUYBOA-INIZCTEOSA-N 2 0 364.486 2.546 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205635929 1031893946 /nfs/dbraw/zinc/89/39/46/1031893946.db2.gz BGNCFBUENKCFOY-RDJZCZTQSA-N 2 0 351.922 2.983 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3ncccc3C)C2)cc(C[NH+](C)C)c1O ZINC001139259970 1035031612 /nfs/dbraw/zinc/03/16/12/1035031612.db2.gz GCQCFGGGLNJCMB-SFHVURJKSA-N 2 0 371.481 2.819 20 10 FFCDRP CCCCOC(=O)[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411704 1035095194 /nfs/dbraw/zinc/09/51/94/1035095194.db2.gz ZNUJEZROZLHEOH-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP CC(=O)N(C(C)C)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139410906 1035095278 /nfs/dbraw/zinc/09/52/78/1035095278.db2.gz LIMGUPZERGBOOM-UHFFFAOYSA-N 2 0 372.557 2.660 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4cccnc4)C3)cc2)CC1 ZINC001140304533 1035426090 /nfs/dbraw/zinc/42/60/90/1035426090.db2.gz TXDDROLEKUJVKO-QFIPXVFZSA-N 2 0 366.509 2.877 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076710 1036926545 /nfs/dbraw/zinc/92/65/45/1036926545.db2.gz JEPPGTLKYBHGFU-FCHUYYIVSA-N 2 0 368.569 2.596 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235236202 1037427021 /nfs/dbraw/zinc/42/70/21/1037427021.db2.gz CSQUGXBTDNWLCA-JOCHJYFZSA-N 3 0 374.548 2.932 20 10 FFCDRP CCOC(=O)c1c(C[NH+]2CCC(C3C[NH2+]C3)CC2)c2ccccc2n1C ZINC001235338152 1037488179 /nfs/dbraw/zinc/48/81/79/1037488179.db2.gz CGRYYWYYKWRGAF-UHFFFAOYSA-N 2 0 355.482 2.786 20 10 FFCDRP COc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c(OC)c1 ZINC001235947970 1037850151 /nfs/dbraw/zinc/85/01/51/1037850151.db2.gz ITMPIYDMYGLSOA-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3ccc(N(CC)CC)cc3)C[C@H]1C[NH2+]CC2 ZINC001236038545 1037900787 /nfs/dbraw/zinc/90/07/87/1037900787.db2.gz QSMIYRPHACCIFZ-WIYYLYMNSA-N 2 0 359.514 2.507 20 10 FFCDRP [NH3+]C1CN([C@H]2CCC[N@H+](Cc3cc(OCc4ccccc4)ccc3O)C2)C1 ZINC001236079938 1037924006 /nfs/dbraw/zinc/92/40/06/1037924006.db2.gz ULTIGUUDVBIRAJ-FQEVSTJZSA-N 2 0 367.493 2.579 20 10 FFCDRP C[N@H+](Cc1ccc(-n2ccnc2)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236180851 1037968395 /nfs/dbraw/zinc/96/83/95/1037968395.db2.gz ARKBHLXDASXVEX-UHFFFAOYSA-N 2 0 361.493 2.914 20 10 FFCDRP Cc1cccc(O[C@@H]2CCC[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)n1 ZINC001236849327 1038307108 /nfs/dbraw/zinc/30/71/08/1038307108.db2.gz VRNZSYYBEVZITF-GOSISDBHSA-N 2 0 369.465 2.621 20 10 FFCDRP Cc1cc(Br)c(O)c(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c1 ZINC001236930493 1038362767 /nfs/dbraw/zinc/36/27/67/1038362767.db2.gz AXISSJJLWQSPFJ-HNNXBMFYSA-N 2 0 370.335 2.579 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@@H]4CCO)CC3)c(F)c2)CC1 ZINC001236936922 1038366553 /nfs/dbraw/zinc/36/65/53/1038366553.db2.gz USYZUKVMFUBPSB-SFHVURJKSA-N 2 0 361.505 2.562 20 10 FFCDRP CC(C)[N@H+](CCCCCO)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236945687 1038372419 /nfs/dbraw/zinc/37/24/19/1038372419.db2.gz LVJBIVLKOBNFGB-UHFFFAOYSA-N 2 0 351.510 2.951 20 10 FFCDRP c1ccc(C[C@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173840 1039267082 /nfs/dbraw/zinc/26/70/82/1039267082.db2.gz MZGDPLDZJJLQDU-VXKWHMMOSA-N 3 0 364.537 2.549 20 10 FFCDRP Oc1cccc2c1C[N@H+](CC1(O)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001254040154 1040541577 /nfs/dbraw/zinc/54/15/77/1040541577.db2.gz QJTRKGBWTMRWSQ-UHFFFAOYSA-N 2 0 352.478 2.777 20 10 FFCDRP Oc1cc(O)c(CC[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255387999 1041314588 /nfs/dbraw/zinc/31/45/88/1041314588.db2.gz XCOVWESMVWOLNN-GOSISDBHSA-N 2 0 356.466 2.990 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CN(C(=O)CCCC[NH+](C)C)C[C@H]2C)cc1C ZINC001216469388 1042035664 /nfs/dbraw/zinc/03/56/64/1042035664.db2.gz QOEITKZWUSZLQY-IEBWSBKVSA-N 2 0 361.530 2.672 20 10 FFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001279515117 1043211144 /nfs/dbraw/zinc/21/11/44/1043211144.db2.gz YIQKASBRYRUTHN-HOTGVXAUSA-N 2 0 357.420 2.621 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CC[NH+](Cc1cc(C(F)(F)F)ccc1O)CC2 ZINC001279685922 1043467526 /nfs/dbraw/zinc/46/75/26/1043467526.db2.gz JFSZQDCWUDCTBA-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP COc1cc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)cc(C[NH+](C)C)c1O ZINC001279698870 1043489963 /nfs/dbraw/zinc/48/99/63/1043489963.db2.gz QZUSDRFZUQHOAQ-UHFFFAOYSA-N 3 0 361.530 2.770 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC001474333611 1065496052 /nfs/dbraw/zinc/49/60/52/1065496052.db2.gz QZSWPYVAIUEZFV-HDICACEKSA-N 2 0 361.530 2.700 20 10 FFCDRP CCC[NH2+][C@@H](C)C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551311 1078375735 /nfs/dbraw/zinc/37/57/35/1078375735.db2.gz OSIAMALYUUOUDH-XJKSGUPXSA-N 2 0 353.894 2.514 20 10 FFCDRP [NH3+][C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001580368792 1078792756 /nfs/dbraw/zinc/79/27/56/1078792756.db2.gz PKWWRENSEVZWMC-IXDOHACOSA-N 2 0 365.905 2.644 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c(O)c1 ZINC001560751246 1076295968 /nfs/dbraw/zinc/29/59/68/1076295968.db2.gz QIZBKAMYTXKAFP-SFHVURJKSA-N 2 0 356.466 2.566 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000186520159 509751681 /nfs/dbraw/zinc/75/16/81/509751681.db2.gz JQGLKJOTEGXQKO-QAPCUYQASA-N 2 0 356.466 2.818 20 10 FFCDRP OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297592582 511000585 /nfs/dbraw/zinc/00/05/85/511000585.db2.gz HQQNLENNUUCNLM-SLFFLAALSA-N 2 0 352.478 2.852 20 10 FFCDRP C[N@H+](CCOCC[NH3+])Cc1ccc(N2CCCCC2)c(Br)c1 ZINC000863652820 730799243 /nfs/dbraw/zinc/79/92/43/730799243.db2.gz VMRPSGLJQMPITH-UHFFFAOYSA-N 2 0 370.335 2.847 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@]4(CCSC4)C3)cc2)CC1 ZINC000771846935 737760743 /nfs/dbraw/zinc/76/07/43/737760743.db2.gz NXDNZAUWVVXIMH-UYAOXDASSA-N 2 0 361.555 2.583 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)c2c1c(F)ccc2O ZINC000817973240 742225260 /nfs/dbraw/zinc/22/52/60/742225260.db2.gz RJPVQNNHHNXBOW-QKCSRTOESA-N 2 0 361.383 2.505 20 10 FFCDRP COCC1(C[NH2+][C@@H](C)c2cc(Br)ccc2O)CC[NH2+]CC1 ZINC000817973322 742225392 /nfs/dbraw/zinc/22/53/92/742225392.db2.gz CSGSJCCIGHXQFP-LBPRGKRZSA-N 2 0 357.292 2.822 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4oc(=O)[nH]c4c3)cc2)CC1 ZINC000873172737 1013413650 /nfs/dbraw/zinc/41/36/50/1013413650.db2.gz GTXBTXXRGMCSGF-UHFFFAOYSA-N 2 0 352.438 2.575 20 10 FFCDRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 ZINC000067452964 967688244 /nfs/dbraw/zinc/68/82/44/967688244.db2.gz HVXXJCQGKPVVGL-OALUTQOASA-N 2 0 361.530 2.502 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H](C)C3CC[NH+](C)CC3)CC2)cc1 ZINC000162835218 975335356 /nfs/dbraw/zinc/33/53/56/975335356.db2.gz UEBUCLBVERIKBR-IBGZPJMESA-N 2 0 374.573 2.527 20 10 FFCDRP C[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728585 983998799 /nfs/dbraw/zinc/99/87/99/983998799.db2.gz MVRNXXBHSGEHLT-HKUYNNGSSA-N 2 0 372.557 2.611 20 10 FFCDRP CCOc1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c(O)c1 ZINC000809751622 994604472 /nfs/dbraw/zinc/60/44/72/994604472.db2.gz ULHUGLKVRFFPSX-DFNIBXOVSA-N 2 0 359.514 2.534 20 10 FFCDRP CC[C@@H]1[C@@H](C(=O)N2C[C@@H](C)[C@H]([NH2+]Cc3ccc(OC)c(C)c3)C2)CC[N@@H+]1C ZINC001082522342 994815377 /nfs/dbraw/zinc/81/53/77/994815377.db2.gz BVQDIHXNEOZPTQ-GSEOLPGOSA-N 2 0 373.541 2.670 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@@H](c4cccnc4)C3)cc2)CC1 ZINC000824932327 997149572 /nfs/dbraw/zinc/14/95/72/997149572.db2.gz MSLKMSMRFXKMBG-IFMALSPDSA-N 2 0 366.509 2.843 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@](C)(O)c1ccccc1 ZINC000846036226 1000196457 /nfs/dbraw/zinc/19/64/57/1000196457.db2.gz JSTXPCZJNVHALT-AVRDEDQJSA-N 2 0 353.510 2.824 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccnn1C ZINC000774268551 1001827551 /nfs/dbraw/zinc/82/75/51/1001827551.db2.gz WFWYRQJFJDZPGW-KRWDZBQOSA-N 2 0 353.514 2.803 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C2(CCCCC2)C1 ZINC000775735546 1003893627 /nfs/dbraw/zinc/89/36/27/1003893627.db2.gz RUBIQMUPYARTLA-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cc2)CC1 ZINC000775652207 1004948917 /nfs/dbraw/zinc/94/89/17/1004948917.db2.gz IHWZCDZHTMWLKK-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP Cn1nccc1[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775660888 1004985420 /nfs/dbraw/zinc/98/54/20/1004985420.db2.gz ZYZWWPJSMWSBFN-LJQANCHMSA-N 2 0 353.514 2.552 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850508061 1005819111 /nfs/dbraw/zinc/81/91/11/1005819111.db2.gz KDGYCNHDYQUEST-MAUKXSAKSA-N 2 0 356.466 2.818 20 10 FFCDRP COc1cc(OC)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1F ZINC000883283512 1006730287 /nfs/dbraw/zinc/73/02/87/1006730287.db2.gz IIOTVPPTNHHUIF-UHFFFAOYSA-N 2 0 373.472 2.885 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3OCCc4ccccc43)cc2)CC1 ZINC001177816163 1008759257 /nfs/dbraw/zinc/75/92/57/1008759257.db2.gz GBMNRPOONQDCEU-QFIPXVFZSA-N 2 0 351.494 2.842 20 10 FFCDRP CCN(C)c1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1 ZINC000773787058 1009211568 /nfs/dbraw/zinc/21/15/68/1009211568.db2.gz FQPANPSVBCAAJB-CBQGHPETSA-N 2 0 356.558 2.886 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000773147595 1009747986 /nfs/dbraw/zinc/74/79/86/1009747986.db2.gz SZDVCTHQCDGANH-GMAHTHKFSA-N 3 0 368.569 2.935 20 10 FFCDRP COC(=O)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001172768131 1012005562 /nfs/dbraw/zinc/00/55/62/1012005562.db2.gz OTCRSTPTCNECJL-RBUKOAKNSA-N 2 0 359.514 2.650 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@]45COC[C@@]4(C3)CCCC5)cc2)CC1 ZINC000827851966 1018785723 /nfs/dbraw/zinc/78/57/23/1018785723.db2.gz VSMDDEGRBFXXER-SZPZYZBQSA-N 2 0 355.526 2.831 20 10 FFCDRP CCOC(=O)[C@H]1CC2(C[N@@H+]1Cc1ccc3c(c1)CCCN3C)CC[NH2+]CC2 ZINC001222221568 1032832085 /nfs/dbraw/zinc/83/20/85/1032832085.db2.gz NZYWPWINGZCJTC-HXUWFJFHSA-N 2 0 371.525 2.576 20 10 FFCDRP COCCN(Cc1cccnc1)Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001117638849 1021789952 /nfs/dbraw/zinc/78/99/52/1021789952.db2.gz UJYZELKRULFFPP-UHFFFAOYSA-N 2 0 372.488 2.621 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548176 1023725525 /nfs/dbraw/zinc/72/55/25/1023725525.db2.gz JAXCOQHTKNZDCE-WBVHZDCISA-N 2 0 355.482 2.783 20 10 FFCDRP Cc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCC(C(N)=O)CC3)cc2)c1O ZINC000840973657 1029955238 /nfs/dbraw/zinc/95/52/38/1029955238.db2.gz SILFPLFTQYEEJL-UHFFFAOYSA-N 2 0 367.493 2.688 20 10 FFCDRP COc1ccc(N2CCC([NH2+]CCCNCc3cccnc3)CC2)cc1 ZINC000841041457 1029995130 /nfs/dbraw/zinc/99/51/30/1029995130.db2.gz GNHFPIBZPDWOPG-UHFFFAOYSA-N 2 0 354.498 2.829 20 10 FFCDRP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)n(C)n1 ZINC000841867085 1030509441 /nfs/dbraw/zinc/50/94/41/1030509441.db2.gz QYYCJIZNMFAVDU-UHFFFAOYSA-N 2 0 353.514 2.550 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4nsnc43)cc2)CC1 ZINC001203491956 1030728874 /nfs/dbraw/zinc/72/88/74/1030728874.db2.gz QVFDWPDPOKFHNH-UHFFFAOYSA-N 2 0 353.495 2.733 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)c(O)c1 ZINC001204274630 1031202966 /nfs/dbraw/zinc/20/29/66/1031202966.db2.gz RGSXYFNQOXBKQO-UHFFFAOYSA-N 2 0 353.466 2.981 20 10 FFCDRP COc1cc(C[NH+]2CCC(c3noc(C)n3)CC2)cc(C[NH+](C)C)c1O ZINC001139257134 1035030000 /nfs/dbraw/zinc/03/00/00/1035030000.db2.gz SLKRYMKPHJOOQZ-UHFFFAOYSA-N 2 0 360.458 2.533 20 10 FFCDRP COc1cc(CN2CC[NH+](Cc3ccccc3)CC2)cc(C[NH+](C)C)c1O ZINC001139254303 1035030632 /nfs/dbraw/zinc/03/06/32/1035030632.db2.gz GCRJGPLOPOUJEC-UHFFFAOYSA-N 2 0 369.509 2.780 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@H]([NH+]4CCCCC4)C3)cc2)CC1 ZINC001140304096 1035426205 /nfs/dbraw/zinc/42/62/05/1035426205.db2.gz HXKPKZBDCXGWLV-QFIPXVFZSA-N 2 0 356.558 2.889 20 10 FFCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC001232361681 1035623135 /nfs/dbraw/zinc/62/31/35/1035623135.db2.gz BGHLORMLWOHPKY-UHFFFAOYSA-N 2 0 353.514 2.531 20 10 FFCDRP Oc1cc(C(F)(F)F)ccc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001233455008 1036633590 /nfs/dbraw/zinc/63/35/90/1036633590.db2.gz SBHLWLVVGLINDN-UHFFFAOYSA-N 2 0 357.420 2.624 20 10 FFCDRP COc1cc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)cc(C[NH+](C)C)c1O ZINC001235231553 1037424740 /nfs/dbraw/zinc/42/47/40/1037424740.db2.gz ZYUIJCQZJVDLTH-IBGZPJMESA-N 3 0 361.530 2.817 20 10 FFCDRP Cc1ccccc1O[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001235675147 1037677298 /nfs/dbraw/zinc/67/72/98/1037677298.db2.gz PGDFHDWRXLFQNA-HXUWFJFHSA-N 2 0 367.493 2.764 20 10 FFCDRP c1ccc(C[N@H+]2CCC23CN(Cc2ccc(N4CC[NH2+]CC4)cc2)C3)cc1 ZINC001235808353 1037757873 /nfs/dbraw/zinc/75/78/73/1037757873.db2.gz BGFQCINALKWAEU-UHFFFAOYSA-N 2 0 362.521 2.557 20 10 FFCDRP COc1cccc(CCC[N@H+](C)Cc2cc3c(cc2O)OCC[NH2+]C3)c1 ZINC001236042539 1037906697 /nfs/dbraw/zinc/90/66/97/1037906697.db2.gz PXASGEWKQCDVKO-UHFFFAOYSA-N 2 0 356.466 2.947 20 10 FFCDRP Oc1cc2c(cc1CN(Cc1ccccc1)[C@@H]1CCC[NH2+]C1)C[NH2+]CCO2 ZINC001236270222 1038010730 /nfs/dbraw/zinc/01/07/30/1038010730.db2.gz JXSIZMGQCYJORK-HXUWFJFHSA-N 2 0 367.493 2.628 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC3(CCn4c(C)cnc43)CC2)cc1OC ZINC001236752529 1038239140 /nfs/dbraw/zinc/23/91/40/1038239140.db2.gz XCTFYLUDNTYHAX-UHFFFAOYSA-N 2 0 357.454 2.852 20 10 FFCDRP c1ccc(N2C[C@@H]3C[NH+](Cc4ccc(N5CC[NH2+]CC5)cc4)C[C@H]3C2)cc1 ZINC001237036848 1038415429 /nfs/dbraw/zinc/41/54/29/1038415429.db2.gz DQGTUDPWVALXHY-SFTDATJTSA-N 2 0 362.521 2.664 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNC(=O)CC[C@H]([NH3+])c3ccccc3)cc2)CC1 ZINC001262044506 1041527531 /nfs/dbraw/zinc/52/75/31/1041527531.db2.gz KXBWAUOCNZZXIJ-NRFANRHFSA-N 2 0 366.509 2.535 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4ccc[nH]4)C3)CC2)cc1O ZINC001279514532 1043209939 /nfs/dbraw/zinc/20/99/39/1043209939.db2.gz NETQGUIWNLRCDE-UHFFFAOYSA-N 2 0 357.454 2.620 20 10 FFCDRP Cc1c(C[C@@H](C[NH3+])C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cnn1C ZINC001579529545 1078639936 /nfs/dbraw/zinc/63/99/36/1078639936.db2.gz KRHINDKWSWJHMP-IBGZPJMESA-N 2 0 355.530 2.578 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@H](C)N2CC[NH+](C)CC2)c1O ZINC000187167761 510099007 /nfs/dbraw/zinc/09/90/07/510099007.db2.gz TVWAQDQTBLIKJS-UONOGXRCSA-N 2 0 370.335 2.750 20 10 FFCDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc(F)ccc1O ZINC000185322358 510806544 /nfs/dbraw/zinc/80/65/44/510806544.db2.gz YQTACQSYFYNHEB-AWEZNQCLSA-N 2 0 359.445 2.674 20 10 FFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000289509699 511102667 /nfs/dbraw/zinc/10/26/67/511102667.db2.gz UNZJAUPGZVWPJY-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000375785956 512504600 /nfs/dbraw/zinc/50/46/00/512504600.db2.gz CPFQATZMWZXYSJ-FKBYEOEOSA-N 2 0 357.542 2.858 20 10 FFCDRP CC[NH+](CC)CCNC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000436462753 513860920 /nfs/dbraw/zinc/86/09/20/513860920.db2.gz GHNDJTDHEZAYTJ-UHFFFAOYSA-N 2 0 370.541 2.866 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH2+]C(C)(C)C)C1 ZINC000444802499 514337776 /nfs/dbraw/zinc/33/77/76/514337776.db2.gz OFVQIUWCUBQSEW-UHFFFAOYSA-N 2 0 370.541 2.912 20 10 FFCDRP C[C@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000873291359 731897899 /nfs/dbraw/zinc/89/78/99/731897899.db2.gz FTLSXWGZCRFTSR-GXTWGEPZSA-N 2 0 369.303 2.964 20 10 FFCDRP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000756399463 736327696 /nfs/dbraw/zinc/32/76/96/736327696.db2.gz POJQSDRTQGYJFK-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000809741492 741339131 /nfs/dbraw/zinc/33/91/31/741339131.db2.gz OXZDDLZAOQJKRA-GOSISDBHSA-N 2 0 351.922 2.954 20 10 FFCDRP CC[C@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000817972545 742225271 /nfs/dbraw/zinc/22/52/71/742225271.db2.gz MRVFJHJWENLJPF-IRXDYDNUSA-N 2 0 358.452 2.629 20 10 FFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000826100596 743367756 /nfs/dbraw/zinc/36/77/56/743367756.db2.gz RZFAAZLOQSTKSK-UHFFFAOYSA-N 2 0 370.335 2.660 20 10 FFCDRP Cn1ccc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000896495251 971521679 /nfs/dbraw/zinc/52/16/79/971521679.db2.gz KFQXXGGYIPQDBO-UHFFFAOYSA-N 2 0 353.514 2.552 20 10 FFCDRP CN(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC001177170700 1013854361 /nfs/dbraw/zinc/85/43/61/1013854361.db2.gz GHMQJCAQTUDZCZ-HXUWFJFHSA-N 2 0 358.555 2.892 20 10 FFCDRP OC1CCN(c2ccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cc2)CC1 ZINC000876577218 1014309778 /nfs/dbraw/zinc/30/97/78/1014309778.db2.gz YDTZONZKHQFPLC-UHFFFAOYSA-N 2 0 357.542 2.956 20 10 FFCDRP C[NH+]1CCN(C2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)CC1 ZINC000877747332 1014706106 /nfs/dbraw/zinc/70/61/06/1014706106.db2.gz GTSYEJAXQBHXRJ-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@H](C(F)(F)F)O1 ZINC000877824056 1014742576 /nfs/dbraw/zinc/74/25/76/1014742576.db2.gz ONVKVJNICKYFIE-QAPCUYQASA-N 2 0 371.447 2.980 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206027875 1032113802 /nfs/dbraw/zinc/11/38/02/1032113802.db2.gz WZRJOWQKLFFCQU-JKSUJKDBSA-N 2 0 351.922 2.983 20 10 FFCDRP Cn1nccc1[C@H]1[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)CCCN1C ZINC000922119193 987694193 /nfs/dbraw/zinc/69/41/93/987694193.db2.gz OEJBHGXCTQCZDD-GHTZIAJQSA-N 2 0 354.498 2.918 20 10 FFCDRP Cc1c(C[C@H](C[NH3+])C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cnn1C ZINC000903884285 1016287227 /nfs/dbraw/zinc/28/72/27/1016287227.db2.gz WPRJLINZOJGLQG-LJQANCHMSA-N 2 0 357.546 2.823 20 10 FFCDRP CN(C)c1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)cc1 ZINC000903980339 1016355266 /nfs/dbraw/zinc/35/52/66/1016355266.db2.gz PCWAFILOYVTTBO-UFICKVLRSA-N 2 0 354.542 2.666 20 10 FFCDRP CC(C)[NH+]1CCC(N2CC[NH+](Cc3c(O)ccc4ccncc43)CC2)CC1 ZINC000771174800 1001036205 /nfs/dbraw/zinc/03/62/05/1001036205.db2.gz NDYPYZSMDJBXOK-UHFFFAOYSA-N 2 0 368.525 2.931 20 10 FFCDRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792917195 1003230588 /nfs/dbraw/zinc/23/05/88/1003230588.db2.gz CZNZKCXPFDDFCX-OAHLLOKOSA-N 2 0 372.479 2.887 20 10 FFCDRP C=Cn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000775017105 1003314726 /nfs/dbraw/zinc/31/47/26/1003314726.db2.gz PRRHSXBQLWYNNW-UHFFFAOYSA-N 2 0 351.498 2.805 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC(c4nc5ccccc5[nH]4)C3)cc2)CC1 ZINC000775715989 1003773953 /nfs/dbraw/zinc/77/39/53/1003773953.db2.gz NZOWQSNEIMYCJP-UHFFFAOYSA-N 2 0 361.493 2.914 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230105 1006732167 /nfs/dbraw/zinc/73/21/67/1006732167.db2.gz GXNRDKBTOSNXFZ-HNNXBMFYSA-N 2 0 354.498 2.661 20 10 FFCDRP Cc1cc(C[NH3+])cc(NC(=O)NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883574241 1006880074 /nfs/dbraw/zinc/88/00/74/1006880074.db2.gz BLKIKIUEVNRIJE-UHFFFAOYSA-N 2 0 367.497 2.527 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000817916778 1007807978 /nfs/dbraw/zinc/80/79/78/1007807978.db2.gz JXIPPNCQVZIKPQ-WCRBZPEASA-N 3 0 354.542 2.591 20 10 FFCDRP C[C@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000817916680 1007809208 /nfs/dbraw/zinc/80/92/08/1007809208.db2.gz JKXQHYVGFVFPEL-PGRDOPGGSA-N 2 0 356.558 2.839 20 10 FFCDRP COC(=O)CC1CC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)C1 ZINC000818331441 1007904229 /nfs/dbraw/zinc/90/42/29/1007904229.db2.gz FDQKHWWLLYIDFR-UHFFFAOYSA-N 2 0 371.525 2.650 20 10 FFCDRP C[C@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc2ccccc2c1O ZINC000925852512 1017874487 /nfs/dbraw/zinc/87/44/87/1017874487.db2.gz CENLXEUCJFSEJQ-GOEBONIOSA-N 2 0 354.450 2.881 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(N4CCCC4)cc3)C[C@@H]1C[NH2+]CCC2 ZINC001222125478 1032770326 /nfs/dbraw/zinc/77/03/26/1032770326.db2.gz NDXIGWMSQUPOGS-UGKGYDQZSA-N 2 0 371.525 2.652 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000843341541 1031337206 /nfs/dbraw/zinc/33/72/06/1031337206.db2.gz UOFBLEWLWWXPAO-FDFHNCONSA-N 3 0 368.569 2.696 20 10 FFCDRP CC[NH+](CC)[C@@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832274678 1034696011 /nfs/dbraw/zinc/69/60/11/1034696011.db2.gz XEAVNVUMAPJXRC-NHCUHLMSSA-N 2 0 368.525 2.952 20 10 FFCDRP COc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc(C[NH+](C)C)c1O ZINC001139259193 1035032069 /nfs/dbraw/zinc/03/20/69/1035032069.db2.gz MILNVHPCZINVEU-UHFFFAOYSA-N 3 0 361.530 2.770 20 10 FFCDRP Cc1cnccc1O[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411644 1035094647 /nfs/dbraw/zinc/09/46/47/1035094647.db2.gz WMRXPTVCUJPGKQ-NRFANRHFSA-N 2 0 366.509 2.795 20 10 FFCDRP CCOC(=O)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001139411488 1035096005 /nfs/dbraw/zinc/09/60/05/1035096005.db2.gz ORZHUTCLVBGRTM-AZUAARDMSA-N 2 0 373.541 2.850 20 10 FFCDRP Oc1cccc2c1C[N@H+](Cc1cccc(OCCN3CCOCC3)c1)CC2 ZINC001139764363 1035224803 /nfs/dbraw/zinc/22/48/03/1035224803.db2.gz IXAFLZXCYFZZIW-UHFFFAOYSA-N 2 0 368.477 2.662 20 10 FFCDRP CN(C)c1ccc(/C=C/CN2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028825 1035489784 /nfs/dbraw/zinc/48/97/84/1035489784.db2.gz SRTFUQUTRSVFCS-WMWRJIBUSA-N 2 0 356.558 2.868 20 10 FFCDRP CC[C@@H](C(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1)[NH+](C)C ZINC001228661023 1036240533 /nfs/dbraw/zinc/24/05/33/1036240533.db2.gz LWNQPBKNSBPZIM-QRVBRYPASA-N 2 0 361.530 2.861 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001233745651 1036742843 /nfs/dbraw/zinc/74/28/43/1036742843.db2.gz NLDUHNBRYXROCY-LSDHHAIUSA-N 2 0 373.419 2.501 20 10 FFCDRP Cc1cc(CN2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c(O)cc1Br ZINC001235402676 1037530021 /nfs/dbraw/zinc/53/00/21/1037530021.db2.gz XTIXIFMRGUYGDJ-CVEARBPZSA-N 2 0 357.267 2.987 20 10 FFCDRP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236315653 1038040118 /nfs/dbraw/zinc/04/01/18/1038040118.db2.gz MDWKHJIPUIRUAS-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP Cc1ccnc(O[C@H]2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236532877 1038122403 /nfs/dbraw/zinc/12/24/03/1038122403.db2.gz FVUVHYUPXOWINW-NRFANRHFSA-N 2 0 366.509 2.843 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236962321 1038381933 /nfs/dbraw/zinc/38/19/33/1038381933.db2.gz VSUAVUVBRSVBGO-UHFFFAOYSA-N 3 0 356.558 2.698 20 10 FFCDRP c1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)N3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001237188488 1038471280 /nfs/dbraw/zinc/47/12/80/1038471280.db2.gz PHQYVVYRWUVNFT-ZRZAMGCNSA-N 2 0 362.521 2.555 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC(=O)N(CC[NH+](C)C)CC2)cc1 ZINC001209519674 1038948409 /nfs/dbraw/zinc/94/84/09/1038948409.db2.gz DPRPXTQTERKELQ-UHFFFAOYSA-N 2 0 368.525 2.690 20 10 FFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CN1Cc1ccccc1 ZINC001246173810 1039265709 /nfs/dbraw/zinc/26/57/09/1039265709.db2.gz MRIBFKKYYFTDTO-SIKLNZKXSA-N 2 0 364.537 2.849 20 10 FFCDRP C[NH2+]CC[C@@H](C)[N@@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700992 1039442218 /nfs/dbraw/zinc/44/22/18/1039442218.db2.gz HYRWZTYYOYSABC-NQIIRXRSSA-N 2 0 361.530 2.612 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001278578451 1041241783 /nfs/dbraw/zinc/24/17/83/1041241783.db2.gz RNGZSLQSMILFCK-OAQYLSRUSA-N 2 0 361.530 2.640 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149198 1042920071 /nfs/dbraw/zinc/92/00/71/1042920071.db2.gz AVGBJXRWPKIHTI-JOCHJYFZSA-N 2 0 358.574 2.992 20 10 FFCDRP Oc1ccc(F)cc1C[NH2+][C@@]12CC[C@@]([NH2+]CCn3ccnc3)(C1)CCC2 ZINC001279197701 1042941582 /nfs/dbraw/zinc/94/15/82/1042941582.db2.gz XSOSMOALGFOEBY-UXHICEINSA-N 2 0 358.461 2.953 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202857 1046808354 /nfs/dbraw/zinc/80/83/54/1046808354.db2.gz WFSYWIFDXYJWBG-UXHICEINSA-N 3 0 374.548 2.789 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1F ZINC001308366438 1052450796 /nfs/dbraw/zinc/45/07/96/1052450796.db2.gz MNOPEGXKRSCVDM-LJQANCHMSA-N 2 0 357.473 2.748 20 10 FFCDRP CN(C)c1ccc(CN(C)C(=O)C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1 ZINC000366910249 512245195 /nfs/dbraw/zinc/24/51/95/512245195.db2.gz HFOLHHGCHFNOSQ-UHFFFAOYSA-N 2 0 372.557 2.519 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[NH+]2C)C1 ZINC000444236039 514164049 /nfs/dbraw/zinc/16/40/49/514164049.db2.gz KAZPNBIHPQSRLI-KRWDZBQOSA-N 2 0 368.525 2.618 20 10 FFCDRP COc1c([O-])c(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973668 738046380 /nfs/dbraw/zinc/04/63/80/738046380.db2.gz DCWPYCYJRCJKSO-CQSZACIVSA-N 2 0 351.447 2.911 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CC[C@@H](C(F)(F)F)O3)cc2)CC1 ZINC000922457048 738148798 /nfs/dbraw/zinc/14/87/98/738148798.db2.gz GRFDVGMSFFDAPO-SJORKVTESA-N 2 0 357.420 2.638 20 10 FFCDRP C[C@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817971970 742225605 /nfs/dbraw/zinc/22/56/05/742225605.db2.gz IHQWGDWXUUQWON-HZMBPMFUSA-N 2 0 351.800 2.532 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817972128 742225636 /nfs/dbraw/zinc/22/56/36/742225636.db2.gz KBYRPZONMAYCID-DZGCQCFKSA-N 2 0 365.827 2.922 20 10 FFCDRP C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1ccc(Br)cc1O ZINC000826901733 743466495 /nfs/dbraw/zinc/46/64/95/743466495.db2.gz CKIRRBFAMGKFRH-ZDUSSCGKSA-N 2 0 358.324 2.516 20 10 FFCDRP Cn1ncc2c1CC(C)(C)C[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000828018368 961141501 /nfs/dbraw/zinc/14/15/01/961141501.db2.gz JAAFPADQMBSATE-UHFFFAOYSA-N 2 0 367.541 2.756 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000895248587 968749854 /nfs/dbraw/zinc/74/98/54/968749854.db2.gz ONXZLQIPJUQZAM-LJQANCHMSA-N 2 0 356.466 2.566 20 10 FFCDRP Cn1cc(CCC[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cn1 ZINC000877120573 1014480230 /nfs/dbraw/zinc/48/02/30/1014480230.db2.gz HZYSFMBGUSKUAL-UHFFFAOYSA-N 2 0 367.541 2.675 20 10 FFCDRP Cc1ccc(C[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c(O)c1 ZINC000877152685 1014490778 /nfs/dbraw/zinc/49/07/78/1014490778.db2.gz QBPCAMTUPORJTE-UHFFFAOYSA-N 2 0 367.493 2.816 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4[nH]c(=O)ccc43)cc2)CC1 ZINC000809728759 994583212 /nfs/dbraw/zinc/58/32/12/994583212.db2.gz GXRMEHKYGJFXNC-IBGZPJMESA-N 2 0 352.482 2.706 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCN2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000733323410 998962880 /nfs/dbraw/zinc/96/28/80/998962880.db2.gz ZQMGBVDHRWCEAO-UHFFFAOYSA-N 2 0 370.516 2.799 20 10 FFCDRP Cc1c(C[C@H](C[NH3+])C[N@H+](Cc2ccccc2O)C2CCCC2)cnn1C ZINC000903892678 1016291841 /nfs/dbraw/zinc/29/18/41/1016291841.db2.gz LEBQDJSUJQLPGY-QGZVFWFLSA-N 2 0 356.514 2.996 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000846144554 1000218342 /nfs/dbraw/zinc/21/83/42/1000218342.db2.gz LFUIFQMOXYZWAO-HRAATJIYSA-N 2 0 356.466 2.688 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000768465733 1000263427 /nfs/dbraw/zinc/26/34/27/1000263427.db2.gz RLNXPYWOWKHKCA-UTKZUKDTSA-N 2 0 357.542 2.729 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(O)CCCc4ccccc43)cc2)CC1 ZINC000771844875 1001213772 /nfs/dbraw/zinc/21/37/72/1001213772.db2.gz KPAKIDGXZMSMNY-QHCPKHFHSA-N 2 0 365.521 2.752 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)Cc3ccc(F)cc3)cc2)CC1 ZINC000771823461 1001220903 /nfs/dbraw/zinc/22/09/03/1001220903.db2.gz CUCJEYLKKNKXCO-HXUWFJFHSA-N 2 0 371.500 2.518 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775725293 1003835893 /nfs/dbraw/zinc/83/58/93/1003835893.db2.gz RTYIMFQZBCKQCW-GOSISDBHSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccccc1O ZINC000775499679 1004045342 /nfs/dbraw/zinc/04/53/42/1004045342.db2.gz TWSFPAJGHPFLFM-LJQANCHMSA-N 2 0 369.513 2.825 20 10 FFCDRP COc1cc(Br)cc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1O ZINC001205601772 1004166213 /nfs/dbraw/zinc/16/62/13/1004166213.db2.gz GGJUQYJJIIDQBK-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3COc4ccccc4C3)cc2)CC1 ZINC001199037649 1004817332 /nfs/dbraw/zinc/81/73/32/1004817332.db2.gz BQQJTVNRSYOVAF-IBGZPJMESA-N 2 0 351.494 2.779 20 10 FFCDRP COC(=O)[C@@H]1C[C@H]1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000850235110 1005797380 /nfs/dbraw/zinc/79/73/80/1005797380.db2.gz RQHXWOHIDRDAHQ-TYCQWZJGSA-N 2 0 371.525 2.506 20 10 FFCDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817916879 1007809346 /nfs/dbraw/zinc/80/93/46/1007809346.db2.gz MDLJQXYIKJTCMR-IFMALSPDSA-N 3 0 356.558 2.826 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc(F)c1N1CCOCC1 ZINC000817937304 1007815879 /nfs/dbraw/zinc/81/58/79/1007815879.db2.gz XVZBWAISXBHCMA-KFKAGJAMSA-N 2 0 365.468 2.812 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](n3cccn3)C(F)(F)F)cc2)CC1 ZINC000858209503 1008325161 /nfs/dbraw/zinc/32/51/61/1008325161.db2.gz MNIZWRJLEDPIAW-QGZVFWFLSA-N 2 0 367.419 2.528 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C[C@H]3C3CCCC3)cc2)CC1 ZINC000925715298 1017823822 /nfs/dbraw/zinc/82/38/22/1017823822.db2.gz GFEIIXRQTBFJPQ-FCHUYYIVSA-N 2 0 357.542 2.906 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc2ccccc2c1O ZINC000925852518 1017873425 /nfs/dbraw/zinc/87/34/25/1017873425.db2.gz CENLXEUCJFSEJQ-ZBFHGGJFSA-N 2 0 354.450 2.881 20 10 FFCDRP CCOC(=O)CCCOc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c(O)c1 ZINC001206649704 1027983099 /nfs/dbraw/zinc/98/30/99/1027983099.db2.gz YBUUFSSMPXXJNZ-INIZCTEOSA-N 2 0 364.486 2.675 20 10 FFCDRP c1nc2c(c(N3CCCC4=C[C@H]5C[C@H](C[N@H+]6CCCC[C@H]56)[C@@H]43)n1)CC[NH2+]C2 ZINC001155630784 1028826750 /nfs/dbraw/zinc/82/67/50/1028826750.db2.gz XKJUVKGBSDMZTO-XWDORNJCSA-N 2 0 365.525 2.522 20 10 FFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205582053 1031850781 /nfs/dbraw/zinc/85/07/81/1031850781.db2.gz WHGHKZLSXZNJCL-SFHVURJKSA-N 2 0 355.885 2.830 20 10 FFCDRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)o1 ZINC000832279540 1034697552 /nfs/dbraw/zinc/69/75/52/1034697552.db2.gz JQQCBBDXUMFVST-GOSISDBHSA-N 2 0 358.486 2.617 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139257153 1035029697 /nfs/dbraw/zinc/02/96/97/1035029697.db2.gz SYUNZCBSRFSOQR-OAHLLOKOSA-N 2 0 364.486 2.626 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](c3noc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139254059 1035030216 /nfs/dbraw/zinc/03/02/16/1035030216.db2.gz CLWNMMVNYADXFV-OAHLLOKOSA-N 2 0 360.458 2.533 20 10 FFCDRP CCc1noc(C2CC[NH+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)CC2)n1 ZINC001139257968 1035031255 /nfs/dbraw/zinc/03/12/55/1035031255.db2.gz JCIRACTYEYZGJB-UHFFFAOYSA-N 2 0 374.485 2.787 20 10 FFCDRP CCOC(=O)[C@@H]1CCCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259622 1035032082 /nfs/dbraw/zinc/03/20/82/1035032082.db2.gz YXZVNSKIEYQOFG-MRXNPFEDSA-N 2 0 364.486 2.628 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3ncccc3C)C2)cc(C[NH+](C)C)c1O ZINC001139259969 1035032419 /nfs/dbraw/zinc/03/24/19/1035032419.db2.gz GCQCFGGGLNJCMB-GOSISDBHSA-N 2 0 371.481 2.819 20 10 FFCDRP COC(=O)CC[N@H+](Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139409313 1035094043 /nfs/dbraw/zinc/09/40/43/1035094043.db2.gz HWHMXXJBWRCWDN-UHFFFAOYSA-N 2 0 371.481 2.597 20 10 FFCDRP CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139410973 1035094723 /nfs/dbraw/zinc/09/47/23/1035094723.db2.gz OCPCACJNLQCSNQ-JBACZVJFSA-N 2 0 371.525 2.602 20 10 FFCDRP CCCCOC(=O)[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140309320 1035429854 /nfs/dbraw/zinc/42/98/54/1035429854.db2.gz BDWRCEOIWJVUQJ-HXUWFJFHSA-N 2 0 373.541 2.994 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC(COCC[NH+]3CCCC3)CC2)c(O)c1 ZINC001232834135 1036086409 /nfs/dbraw/zinc/08/64/09/1036086409.db2.gz HWMZHRRYYPCCCQ-UHFFFAOYSA-N 2 0 361.530 2.783 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1ccc(N(C)C)cc1O ZINC001232838690 1036094079 /nfs/dbraw/zinc/09/40/79/1036094079.db2.gz BTWAEULIKYPRNQ-UHFFFAOYSA-N 2 0 364.578 2.944 20 10 FFCDRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c1O ZINC001231593281 1037714354 /nfs/dbraw/zinc/71/43/54/1037714354.db2.gz PFRPYCOWJOTYMB-TZIWHRDSSA-N 2 0 367.493 2.819 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1cc(OC)c(O)cc1O ZINC001231637635 1037759772 /nfs/dbraw/zinc/75/97/72/1037759772.db2.gz OYMCDUYCFCMLBU-UHFFFAOYSA-N 2 0 367.534 2.592 20 10 FFCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@]23CCN(CC[NH+](C)C)C3=O)c(O)c1 ZINC001277975419 1037809683 /nfs/dbraw/zinc/80/96/83/1037809683.db2.gz FLUWXDXKSMYQPJ-NRFANRHFSA-N 2 0 359.514 2.644 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001235949983 1037853805 /nfs/dbraw/zinc/85/38/05/1037853805.db2.gz YNPCODWEBHJVOS-QGZVFWFLSA-N 2 0 355.457 2.930 20 10 FFCDRP Cc1nc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)no1 ZINC001236933619 1038365536 /nfs/dbraw/zinc/36/55/36/1038365536.db2.gz YWIGKYWFRNEZJK-QGZVFWFLSA-N 2 0 373.476 2.649 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]4(C3)CC(F)(F)CO4)c(F)c2)CC1 ZINC001236934887 1038366468 /nfs/dbraw/zinc/36/64/68/1038366468.db2.gz AAWVMHJEMDZXPX-SFHVURJKSA-N 2 0 369.431 2.578 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4ccncc4)C3)c(F)c2)CC1 ZINC001236937747 1038367772 /nfs/dbraw/zinc/36/77/72/1038367772.db2.gz DRRRHXWAJRAQML-GOSISDBHSA-N 2 0 354.473 2.962 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCOCC4)CC3)c(F)c2)CC1 ZINC001236941944 1038370713 /nfs/dbraw/zinc/37/07/13/1038370713.db2.gz HRMSZFWUHWBJCJ-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP Cn1ccc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)CC2)n1 ZINC001236941475 1038371327 /nfs/dbraw/zinc/37/13/27/1038371327.db2.gz BUZLPZHUORMZDL-UHFFFAOYSA-N 2 0 371.504 2.691 20 10 FFCDRP c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001246175051 1039266050 /nfs/dbraw/zinc/26/60/50/1039266050.db2.gz RVPJUULFMYMCAC-IRLDBZIGSA-N 2 0 350.510 2.679 20 10 FFCDRP c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001246175052 1039266671 /nfs/dbraw/zinc/26/66/71/1039266671.db2.gz RVPJUULFMYMCAC-RBBKRZOGSA-N 2 0 350.510 2.679 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCC[N@@H+]([C@@H]4CC[NH2+][C@@H](C)C4)C3)C2)cc1 ZINC001246701974 1039440826 /nfs/dbraw/zinc/44/08/26/1039440826.db2.gz JQPWEGGSBQMSNI-DWLFOUALSA-N 2 0 373.541 2.755 20 10 FFCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)CC2)C1 ZINC001278465346 1039476810 /nfs/dbraw/zinc/47/68/10/1039476810.db2.gz ZLGKRRDXCZOKGN-UHFFFAOYSA-N 2 0 357.542 2.956 20 10 FFCDRP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@H+](Cc1cc(Cl)ccc1O)C2 ZINC001278568973 1041205743 /nfs/dbraw/zinc/20/57/43/1041205743.db2.gz LVGJWCCHZLTJDE-LJQANCHMSA-N 2 0 351.922 2.895 20 10 FFCDRP Cc1ccc(C)c(C[NH2+][C@@]23CC[C@@]([NH2+]CC(=O)N(C)C)(C2)CCC3)c1O ZINC001279233780 1042958195 /nfs/dbraw/zinc/95/81/95/1042958195.db2.gz USNRGYIBCVZZLZ-LEWJYISDSA-N 2 0 359.514 2.622 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(O)c(C)c3O)(C1)CCC2 ZINC001279314154 1042996483 /nfs/dbraw/zinc/99/64/83/1042996483.db2.gz SVONHKSARNUIFX-UXHICEINSA-N 2 0 364.486 2.551 20 10 FFCDRP CN1CCCc2cc(C[N@H+]3[C@@H]4CC[C@H]3CC(NCC[NH+](C)C)C4)ccc21 ZINC001279550641 1043244633 /nfs/dbraw/zinc/24/46/33/1043244633.db2.gz AOZDRKOJEZXXMM-SEJPIABJSA-N 2 0 356.558 2.716 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[NH+](C)C)cc1 ZINC001342292241 1050884788 /nfs/dbraw/zinc/88/47/88/1050884788.db2.gz MRSXWVGJRPPAOS-GBSSLUMBSA-N 2 0 372.557 2.625 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001343047085 1051663350 /nfs/dbraw/zinc/66/33/50/1051663350.db2.gz IVEFZUUJMRHHRZ-NHCUHLMSSA-N 2 0 368.525 2.952 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cc1F ZINC001308244636 1052435752 /nfs/dbraw/zinc/43/57/52/1052435752.db2.gz MBRVQLBNAYEPOG-UHFFFAOYSA-N 2 0 370.516 2.929 20 10 FFCDRP COc1ccc(CNC(=[NH2+])NC2CC[NH+](Cc3ccccc3)CC2)c(O)c1 ZINC000849095973 1055637303 /nfs/dbraw/zinc/63/73/03/1055637303.db2.gz VGMMWURBBUXJOI-UHFFFAOYSA-N 2 0 368.481 2.679 20 10 FFCDRP CC(=O)Nc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001473983051 1065433035 /nfs/dbraw/zinc/43/30/35/1065433035.db2.gz RMYPNOFWDBJTAF-UHFFFAOYSA-N 2 0 366.509 2.729 20 10 FFCDRP CC(C)[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[NH+]1CCCCC1 ZINC001558723820 1076063158 /nfs/dbraw/zinc/06/31/58/1076063158.db2.gz WIZIHRLOEUPOQX-NHCUHLMSSA-N 2 0 374.573 2.982 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4c3cnn4C)cc2F)CC1 ZINC000155321243 508976201 /nfs/dbraw/zinc/97/62/01/508976201.db2.gz JUDRWBBVCXLGPQ-IBGZPJMESA-N 2 0 371.504 2.868 20 10 FFCDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000185647659 509283000 /nfs/dbraw/zinc/28/30/00/509283000.db2.gz UHYWLWFXAUMHOY-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1O ZINC000282404470 510963259 /nfs/dbraw/zinc/96/32/59/510963259.db2.gz RUTXQVAQRRUYJN-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cccc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)c1O ZINC000289823865 511116738 /nfs/dbraw/zinc/11/67/38/511116738.db2.gz OGLKJZMNFZHYHK-UHFFFAOYSA-N 2 0 359.514 2.515 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000370697439 513058556 /nfs/dbraw/zinc/05/85/56/513058556.db2.gz GGUJYQSFRLCXQZ-DENIHFKCSA-N 2 0 358.574 2.991 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000370697440 513058855 /nfs/dbraw/zinc/05/88/55/513058855.db2.gz GGUJYQSFRLCXQZ-KNQAVFIVSA-N 2 0 358.574 2.991 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000370697442 513059275 /nfs/dbraw/zinc/05/92/75/513059275.db2.gz GGUJYQSFRLCXQZ-UGKGYDQZSA-N 2 0 358.574 2.991 20 10 FFCDRP CSC1(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC[NH+](C)CC1 ZINC000877539838 732383662 /nfs/dbraw/zinc/38/36/62/732383662.db2.gz UKDVRLAWEBZGLB-UHFFFAOYSA-N 2 0 363.571 2.565 20 10 FFCDRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000751147488 735848885 /nfs/dbraw/zinc/84/88/85/735848885.db2.gz BYMJYLQOPHQXPA-UHFFFAOYSA-N 2 0 367.921 2.762 20 10 FFCDRP Cc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000809741495 741338830 /nfs/dbraw/zinc/33/88/30/741338830.db2.gz OXZDDLZAOQJKRA-SFHVURJKSA-N 2 0 351.922 2.954 20 10 FFCDRP COCC1(C[NH2+][C@H](C)c2cc(Br)ccc2O)CC[NH2+]CC1 ZINC000817973321 742225324 /nfs/dbraw/zinc/22/53/24/742225324.db2.gz CSGSJCCIGHXQFP-GFCCVEGCSA-N 2 0 357.292 2.822 20 10 FFCDRP CCc1nnc(CNCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)s1 ZINC000893226892 971022567 /nfs/dbraw/zinc/02/25/67/971022567.db2.gz SPQWKSOEXVHZAE-UHFFFAOYSA-N 2 0 371.554 2.922 20 10 FFCDRP CC[C@@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(C)cc1O ZINC000873242803 1013442881 /nfs/dbraw/zinc/44/28/81/1013442881.db2.gz FERSLCQRZAZFMD-LJQANCHMSA-N 2 0 351.454 2.981 20 10 FFCDRP COc1ccc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c(O)c1OC ZINC000895116947 967668764 /nfs/dbraw/zinc/66/87/64/967668764.db2.gz XEBJMDCUSCNZHB-MSOLQXFVSA-N 2 0 356.466 2.844 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(I)cc2O)CCC[C@@H]1C[NH3+] ZINC001206014486 1032107794 /nfs/dbraw/zinc/10/77/94/1032107794.db2.gz WXHFNSGQAPMGPR-NWDGAFQWSA-N 2 0 374.266 2.804 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(I)cc2O)CCC[C@H]1C[NH3+] ZINC001206014485 1032108061 /nfs/dbraw/zinc/10/80/61/1032108061.db2.gz WXHFNSGQAPMGPR-NEPJUHHUSA-N 2 0 374.266 2.804 20 10 FFCDRP CN(C)C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000808426406 994109810 /nfs/dbraw/zinc/10/98/10/994109810.db2.gz SBQXHMCULNNBAT-JOCHJYFZSA-N 2 0 370.516 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)cc2)CC1 ZINC000824695652 997059308 /nfs/dbraw/zinc/05/93/08/997059308.db2.gz AGEIYAZUZNJBDX-VSKRKVRLSA-N 2 0 357.542 2.954 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)C23CC[NH+](CC2)C3)cc1C ZINC001085395418 999452114 /nfs/dbraw/zinc/45/21/14/999452114.db2.gz LKMAOZKIMTYSTH-RTBURBONSA-N 2 0 371.525 2.616 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1O ZINC000846166539 1000215137 /nfs/dbraw/zinc/21/51/37/1000215137.db2.gz YZLRJICRDJIKTO-MAUKXSAKSA-N 2 0 356.466 2.818 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C/C=C/CNC(=O)OC(C)(C)C)cc2)CC1 ZINC000789869365 1002222604 /nfs/dbraw/zinc/22/26/04/1002222604.db2.gz LZZHMMOGLAASBM-AATRIKPKSA-N 2 0 374.529 2.609 20 10 FFCDRP CCC[NH+]1CCC([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000102560410 1003904213 /nfs/dbraw/zinc/90/42/13/1003904213.db2.gz TZFIOIKUSNNCIJ-UHFFFAOYSA-N 2 0 374.573 2.671 20 10 FFCDRP CCOC(=O)CC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775738527 1003926597 /nfs/dbraw/zinc/92/65/97/1003926597.db2.gz GUFKRTFQWWEXMI-IBGZPJMESA-N 2 0 373.541 2.994 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c(O)cc1Br ZINC001205579503 1004052388 /nfs/dbraw/zinc/05/23/88/1004052388.db2.gz NPDUOPXQFCKVLR-OAHLLOKOSA-N 2 0 361.255 2.816 20 10 FFCDRP Cn1nccc1[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775660872 1004985650 /nfs/dbraw/zinc/98/56/50/1004985650.db2.gz ZYZWWPJSMWSBFN-IBGZPJMESA-N 2 0 353.514 2.552 20 10 FFCDRP CCCC(=O)NC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667264 1005013475 /nfs/dbraw/zinc/01/34/75/1005013475.db2.gz GWLNLFNANBZWOC-HXUWFJFHSA-N 2 0 372.557 2.567 20 10 FFCDRP COc1ccc(N2CCC([NH2+][C@@H](C)CN(C)CCC[NH+](C)C)CC2)cc1 ZINC000850354028 1005810399 /nfs/dbraw/zinc/81/03/99/1005810399.db2.gz SHWBNUYNOPNNRS-SFHVURJKSA-N 2 0 362.562 2.526 20 10 FFCDRP CCOc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1O ZINC000883283669 1006731074 /nfs/dbraw/zinc/73/10/74/1006731074.db2.gz NWLCVSWRRLQUMU-UHFFFAOYSA-N 2 0 355.482 2.833 20 10 FFCDRP C[C@@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000817916682 1007808273 /nfs/dbraw/zinc/80/82/73/1007808273.db2.gz JKXQHYVGFVFPEL-XMSQKQJNSA-N 2 0 356.558 2.839 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCN3C3CCCCC3)cc2)CC1 ZINC000858222258 1008327852 /nfs/dbraw/zinc/32/78/52/1008327852.db2.gz RUZDWHWSBZGANY-JOCHJYFZSA-N 2 0 356.558 2.935 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cncc(OC)c3C)cc2F)CC1 ZINC000865455855 1010789586 /nfs/dbraw/zinc/78/95/86/1010789586.db2.gz COAHGKPHVXMPIX-UHFFFAOYSA-N 2 0 372.488 2.969 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173622023 1012778579 /nfs/dbraw/zinc/77/85/79/1012778579.db2.gz ITPCGODFOLUKFH-MOPGFXCFSA-N 2 0 359.514 2.650 20 10 FFCDRP c1c(C[N@@H+]2CCOCC3(CC[NH2+]CC3)C2)cc2c3c1CCCN3CCC2 ZINC001222407790 1032948451 /nfs/dbraw/zinc/94/84/51/1032948451.db2.gz NJVYLILXYZSBNR-UHFFFAOYSA-N 2 0 355.526 2.587 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1 ZINC001118006901 1022016282 /nfs/dbraw/zinc/01/62/82/1022016282.db2.gz PQUFAUKIQWACRV-QZTJIDSGSA-N 2 0 373.541 2.635 20 10 FFCDRP COc1ccc(O)c(C[NH2+]CCC2(O)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000717985781 1025255532 /nfs/dbraw/zinc/25/55/32/1025255532.db2.gz RTJGQSKGYXRTGR-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCN(CCC[NH+](C)C)CC2)c2ccccc21 ZINC001204241515 1031180900 /nfs/dbraw/zinc/18/09/00/1031180900.db2.gz HEJCGVMFHHPJFK-UHFFFAOYSA-N 2 0 354.542 2.975 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3cccc(F)c3)cc2)CC1 ZINC000843120047 1031191980 /nfs/dbraw/zinc/19/19/80/1031191980.db2.gz ZZSRKYQCZHRTKJ-QFIPXVFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Cc1ccc(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)cc1 ZINC001204621920 1031393742 /nfs/dbraw/zinc/39/37/42/1031393742.db2.gz RYAVKDVYMNVHQK-UHFFFAOYSA-N 2 0 353.466 2.505 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205627467 1031884640 /nfs/dbraw/zinc/88/46/40/1031884640.db2.gz PQZLSFPWICTYQZ-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139260321 1035031400 /nfs/dbraw/zinc/03/14/00/1035031400.db2.gz KZGRAVJONOQQHC-LJQANCHMSA-N 2 0 371.481 2.901 20 10 FFCDRP CCOC(=O)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139411491 1035094985 /nfs/dbraw/zinc/09/49/85/1035094985.db2.gz ORZHUTCLVBGRTM-UYAOXDASSA-N 2 0 373.541 2.850 20 10 FFCDRP CCOC(=O)[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140304707 1035426435 /nfs/dbraw/zinc/42/64/35/1035426435.db2.gz ZERHJDDBZRKXRQ-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc4ccccc4cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235350845 1037497341 /nfs/dbraw/zinc/49/73/41/1037497341.db2.gz ABJAWSYDQBFNRG-UGKGYDQZSA-N 2 0 368.477 2.910 20 10 FFCDRP Fc1ccccc1N1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235659395 1037667375 /nfs/dbraw/zinc/66/73/75/1037667375.db2.gz SSVROUIEGWSGBY-UHFFFAOYSA-N 2 0 354.473 2.558 20 10 FFCDRP c1ccc(CO[C@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688112 1037683427 /nfs/dbraw/zinc/68/34/27/1037683427.db2.gz NJJVQDQFDDAASI-QFIPXVFZSA-N 2 0 351.494 2.887 20 10 FFCDRP Cc1cccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001231593337 1037714622 /nfs/dbraw/zinc/71/46/22/1037714622.db2.gz PSQZXNHHHGSORT-UHFFFAOYSA-N 2 0 354.498 2.941 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375564 1038062469 /nfs/dbraw/zinc/06/24/69/1038062469.db2.gz KYCNZSGLUNBFPF-GOSISDBHSA-N 2 0 372.557 2.546 20 10 FFCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001236926384 1038358879 /nfs/dbraw/zinc/35/88/79/1038358879.db2.gz DPFMNXSDOFNWIH-UHFFFAOYSA-N 2 0 351.922 2.950 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4cccnc4)C3)c(F)c2)CC1 ZINC001236937423 1038366969 /nfs/dbraw/zinc/36/69/69/1038366969.db2.gz GWLYVBSPZRDQBQ-GOSISDBHSA-N 2 0 354.473 2.962 20 10 FFCDRP FC(F)(F)Oc1ccc(N2CC[NH+]([C@@H]3CCC4(C[NH2+]C4)C3)CC2)cc1 ZINC001246993411 1039566799 /nfs/dbraw/zinc/56/67/99/1039566799.db2.gz HFJROJOTCBGFIB-OAHLLOKOSA-N 2 0 355.404 2.849 20 10 FFCDRP C[N@@H+]1CCC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001254510236 1040760196 /nfs/dbraw/zinc/76/01/96/1040760196.db2.gz UAIUJWAJKNWZOM-IWMITWMQSA-N 2 0 355.482 2.913 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3c(C)ccc(C)c3O)C[C@H]2CC1 ZINC001279235480 1042959278 /nfs/dbraw/zinc/95/92/78/1042959278.db2.gz OTHCPONOKFVHKZ-KDURUIRLSA-N 2 0 362.514 2.773 20 10 FFCDRP Cc1cc(F)cc(C[NH+]2CCC3(C[NH+](CCn4ccnc4)C3)CC2)c1O ZINC001280027505 1044101055 /nfs/dbraw/zinc/10/10/55/1044101055.db2.gz CIDKYGUBZMIEFL-UHFFFAOYSA-N 2 0 358.461 2.634 20 10 FFCDRP c1cc(N2CCCC2)ccc1CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC[NH2+]CC1 ZINC001332474362 1048409531 /nfs/dbraw/zinc/40/95/31/1048409531.db2.gz ZQTUAYGTNYFRIX-SZPZYZBQSA-N 2 0 354.542 2.687 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCCNc3ccccn3)cc2)CC1 ZINC001473978438 1065431071 /nfs/dbraw/zinc/43/10/71/1065431071.db2.gz JFDZDKFYDOEVQY-UHFFFAOYSA-N 2 0 353.514 2.815 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H]3C[C@H](C)[N@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809275 509305780 /nfs/dbraw/zinc/30/57/80/509305780.db2.gz DXFFJDSHGKHVET-DXIQSLLYSA-N 2 0 374.573 2.526 20 10 FFCDRP CCCOc1ccc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(O)c1 ZINC000179517245 509491662 /nfs/dbraw/zinc/49/16/62/509491662.db2.gz VUNSKTKDUDHJHS-INIZCTEOSA-N 2 0 350.503 2.706 20 10 FFCDRP COc1cc(Br)cc(CN2CC[C@@]3(CC[N@H+](C)C3)C2)c1O ZINC000366536665 512077565 /nfs/dbraw/zinc/07/75/65/512077565.db2.gz SPYWKHJTDJNQRU-MRXNPFEDSA-N 2 0 355.276 2.691 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC(C)(C)C[NH+](C)C)C1 ZINC000457249288 515755169 /nfs/dbraw/zinc/75/51/69/515755169.db2.gz TWKFSMUNWDQQTH-UHFFFAOYSA-N 2 0 370.541 2.864 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000873293727 731897615 /nfs/dbraw/zinc/89/76/15/731897615.db2.gz OYLPUIHXJJCJHD-OCCSQVGLSA-N 2 0 369.303 2.964 20 10 FFCDRP CC[C@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817972137 742225591 /nfs/dbraw/zinc/22/55/91/742225591.db2.gz KBYRPZONMAYCID-ZFWWWQNUSA-N 2 0 365.827 2.922 20 10 FFCDRP CC[C@@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000817972544 742225611 /nfs/dbraw/zinc/22/56/11/742225611.db2.gz MRVFJHJWENLJPF-IAGOWNOFSA-N 2 0 358.452 2.629 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(I)cc2O)CCC[C@@H]1C[NH3+] ZINC001206014488 1032106815 /nfs/dbraw/zinc/10/68/15/1032106815.db2.gz WXHFNSGQAPMGPR-VXGBXAGGSA-N 2 0 374.266 2.804 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1 ZINC000922391239 988549130 /nfs/dbraw/zinc/54/91/30/988549130.db2.gz AEVNPGIDRYPAOH-PBASOCQRSA-N 2 0 362.514 2.750 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811518199 995162752 /nfs/dbraw/zinc/16/27/52/995162752.db2.gz GSDMGGMAYZBFTC-SFTDATJTSA-N 2 0 355.526 2.972 20 10 FFCDRP CC[NH+](CC)CC(=O)N1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000103461765 1000086547 /nfs/dbraw/zinc/08/65/47/1000086547.db2.gz IYAULVUKMVDHEP-UHFFFAOYSA-N 2 0 355.482 2.531 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccccc4[C@H]3CO)cc2)CC1 ZINC000775699611 1003706063 /nfs/dbraw/zinc/70/60/63/1003706063.db2.gz AWWNBVASJWQLKQ-JOCHJYFZSA-N 2 0 351.494 2.530 20 10 FFCDRP Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000775654546 1004963385 /nfs/dbraw/zinc/96/33/85/1004963385.db2.gz LOXMJICUOAJZJB-GOSISDBHSA-N 2 0 355.486 2.509 20 10 FFCDRP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+](C)Cc1ccccc1O ZINC000111235261 1006362892 /nfs/dbraw/zinc/36/28/92/1006362892.db2.gz WFDKFFHSEQJUSC-XLIONFOSSA-N 2 0 367.493 2.603 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCN(c4ccccn4)CC3)cc2)CC1 ZINC000883289033 1006733835 /nfs/dbraw/zinc/73/38/35/1006733835.db2.gz BOYYIDSINCSBTE-UHFFFAOYSA-N 2 0 365.525 2.592 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902534 1007804470 /nfs/dbraw/zinc/80/44/70/1007804470.db2.gz SPRADVLULSFUEL-HMXCVIKNSA-N 3 0 374.548 2.978 20 10 FFCDRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918329 1007809938 /nfs/dbraw/zinc/80/99/38/1007809938.db2.gz YRSHSKREEJTCKF-YADHBBJMSA-N 3 0 356.558 2.968 20 10 FFCDRP C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000817940705 1007818019 /nfs/dbraw/zinc/81/80/19/1007818019.db2.gz GXCOZLAVTIMJCC-YWZLYKJASA-N 2 0 354.498 2.805 20 10 FFCDRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773143535 1009693360 /nfs/dbraw/zinc/69/33/60/1009693360.db2.gz AUAMWQOXZXXOKW-WZONZLPQSA-N 2 0 368.569 2.791 20 10 FFCDRP C[C@@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc2ccccc2c1O ZINC000925852508 1017873050 /nfs/dbraw/zinc/87/30/50/1017873050.db2.gz CENLXEUCJFSEJQ-GDBMZVCRSA-N 2 0 354.450 2.881 20 10 FFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1 ZINC001118006907 1022016270 /nfs/dbraw/zinc/01/62/70/1022016270.db2.gz PQUFAUKIQWACRV-ZWKOTPCHSA-N 2 0 373.541 2.635 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC001120072575 1023230421 /nfs/dbraw/zinc/23/04/21/1023230421.db2.gz XHBKQSKFQLHNEF-GBESFXJTSA-N 2 0 361.505 2.824 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@@H]1COC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001141157489 1025537956 /nfs/dbraw/zinc/53/79/56/1025537956.db2.gz JTUWSXNKDJGEJJ-KRWDZBQOSA-N 2 0 372.465 2.946 20 10 FFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(OC)cc1O)C2 ZINC001203623528 1030793366 /nfs/dbraw/zinc/79/33/66/1030793366.db2.gz SZSHCKBGVUQCRG-NQIIRXRSSA-N 2 0 360.498 2.581 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c(C(F)(F)F)c1 ZINC000843125238 1031194057 /nfs/dbraw/zinc/19/40/57/1031194057.db2.gz OSFRWHGVBBRHQV-OAHLLOKOSA-N 2 0 371.447 2.959 20 10 FFCDRP C[C@@H](CC[NH+](C)C)C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353249 1031702923 /nfs/dbraw/zinc/70/29/23/1031702923.db2.gz CRRRYPYBVMVUCF-YOEHRIQHSA-N 2 0 367.921 2.714 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)cc1 ZINC000832272946 1034693908 /nfs/dbraw/zinc/69/39/08/1034693908.db2.gz KHNSLJWFNSLXCA-RTWAWAEBSA-N 2 0 366.509 2.533 20 10 FFCDRP COc1cc(C[NH+]2CCC(c3ncccn3)CC2)cc(C[NH+](C)C)c1O ZINC001139257825 1035031430 /nfs/dbraw/zinc/03/14/30/1035031430.db2.gz HRWXATYVMCXVKB-UHFFFAOYSA-N 2 0 356.470 2.632 20 10 FFCDRP COc1cc(C[NH+]2CCC(c3nc(C)no3)CC2)cc(C[NH+](C)C)c1O ZINC001139258278 1035031813 /nfs/dbraw/zinc/03/18/13/1035031813.db2.gz OVIJPVMNCGLZQI-UHFFFAOYSA-N 2 0 360.458 2.533 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](Oc4cccnc4)C3)cc2)CC1 ZINC001139408601 1035092808 /nfs/dbraw/zinc/09/28/08/1035092808.db2.gz AOAQBYMXUPNKBA-QFIPXVFZSA-N 2 0 366.509 2.877 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](Oc4ccncc4)C3)cc2)CC1 ZINC001139411404 1035095387 /nfs/dbraw/zinc/09/53/87/1035095387.db2.gz KAXCWEZTOZBVPI-JOCHJYFZSA-N 2 0 366.509 2.877 20 10 FFCDRP Cc1cc(N2CC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)CC2)cc[nH+]1 ZINC001140287233 1035419422 /nfs/dbraw/zinc/41/94/22/1035419422.db2.gz KODFUCWBJGKCQE-UHFFFAOYSA-N 2 0 366.509 2.673 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](CCO)Cc3ccccc3)cc2)CC1 ZINC001140300418 1035423888 /nfs/dbraw/zinc/42/38/88/1035423888.db2.gz OVKSZFPLPBNCAW-UHFFFAOYSA-N 2 0 353.510 2.823 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(n4cccn4)CC3)cc2)CC1 ZINC001140306424 1035428027 /nfs/dbraw/zinc/42/80/27/1035428027.db2.gz RMOQOSSFOTZLQB-UHFFFAOYSA-N 2 0 353.514 2.862 20 10 FFCDRP Cc1c(O)ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001140747867 1036045808 /nfs/dbraw/zinc/04/58/08/1036045808.db2.gz BUZNKDDOKKRUDB-UHFFFAOYSA-N 2 0 370.497 2.647 20 10 FFCDRP Cc1ccc(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c(O)c1 ZINC001140949500 1036543765 /nfs/dbraw/zinc/54/37/65/1036543765.db2.gz DDUISYWZTXPDCI-UHFFFAOYSA-N 2 0 354.498 2.941 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158844 1037390319 /nfs/dbraw/zinc/39/03/19/1037390319.db2.gz WGFGCXMJKSNBFY-QFIPXVFZSA-N 3 0 374.548 2.932 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CCN(C3CC[NH2+]CC3)CC2)cc1 ZINC001235700081 1037695176 /nfs/dbraw/zinc/69/51/76/1037695176.db2.gz XVKAXHATVHTEDZ-UHFFFAOYSA-N 2 0 352.526 2.964 20 10 FFCDRP c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CN3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235839457 1037783630 /nfs/dbraw/zinc/78/36/30/1037783630.db2.gz AYBRIZQTLVDPHZ-GOTSBHOMSA-N 2 0 362.521 2.555 20 10 FFCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2CCC[C@@H](N3CC([NH3+])C3)C2)cc1Cl ZINC001236079816 1037923699 /nfs/dbraw/zinc/92/36/99/1037923699.db2.gz YZUVUIRZUFZWSM-OAHLLOKOSA-N 2 0 351.922 2.950 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374569 1038059592 /nfs/dbraw/zinc/05/95/92/1038059592.db2.gz FDWHFLRVBGVRIQ-FQEVSTJZSA-N 2 0 356.558 2.840 20 10 FFCDRP CCCN(CCC[NH+](C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236947437 1038374162 /nfs/dbraw/zinc/37/41/62/1038374162.db2.gz SABXIAYPMNVNHX-UHFFFAOYSA-N 3 0 350.526 2.741 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001237114164 1038447494 /nfs/dbraw/zinc/44/74/94/1038447494.db2.gz CKAKZFZITGDDBQ-HKUYNNGSSA-N 2 0 359.514 2.507 20 10 FFCDRP CCOc1ccc(N2CC[NH+](C3CCC([NH+]4CCOCC4)CC3)CC2)cc1 ZINC001256696319 1038606755 /nfs/dbraw/zinc/60/67/55/1038606755.db2.gz BKZNBJARGVSAGH-UHFFFAOYSA-N 2 0 373.541 2.851 20 10 FFCDRP [NH3+][C@H](c1ccccc1O)[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1O ZINC001246339795 1039316941 /nfs/dbraw/zinc/31/69/41/1039316941.db2.gz HGLJDVKGGXOIRH-DAWVQUQOSA-N 2 0 353.466 2.712 20 10 FFCDRP O=C(c1ccncc1)c1ccccc1Nc1cc[nH+]c(N2CC[NH2+]CC2)c1 ZINC001210271354 1039461420 /nfs/dbraw/zinc/46/14/20/1039461420.db2.gz ORAAJKBXRRKSKX-UHFFFAOYSA-N 2 0 359.433 2.861 20 10 FFCDRP O=c1cccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2O)CC3)[nH]1 ZINC001278551856 1041115638 /nfs/dbraw/zinc/11/56/38/1041115638.db2.gz NISYUUCMAYZKBE-UHFFFAOYSA-N 2 0 353.466 2.981 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cc2F)CC1 ZINC001261579063 1041314660 /nfs/dbraw/zinc/31/46/60/1041314660.db2.gz WWVYWIRWLJJMBC-FQEVSTJZSA-N 2 0 374.548 2.789 20 10 FFCDRP COCCOCN1CCC2(C1)CC[NH+](Cc1cc(F)cc(C)c1O)CC2 ZINC001280028871 1044105326 /nfs/dbraw/zinc/10/53/26/1044105326.db2.gz ZRZBZEYBJPJBSC-UHFFFAOYSA-N 2 0 366.477 2.748 20 10 FFCDRP Cc1ccc([C@H](O)C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)cc1 ZINC001322149045 1045968556 /nfs/dbraw/zinc/96/85/56/1045968556.db2.gz MFCZFWCTEHSHJE-OAQYLSRUSA-N 2 0 357.473 2.709 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cc2F)CC1 ZINC001324758160 1046208149 /nfs/dbraw/zinc/20/81/49/1046208149.db2.gz ANRJFEWROHWOSD-UHFFFAOYSA-N 2 0 360.521 2.542 20 10 FFCDRP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)N1CCc2ccccc21 ZINC001308238063 1052435089 /nfs/dbraw/zinc/43/50/89/1052435089.db2.gz SFCIALFGWGGWIE-IBGZPJMESA-N 2 0 364.537 2.979 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3ncccc3Cl)cc2)CC1 ZINC001461280854 1061278410 /nfs/dbraw/zinc/27/84/10/1061278410.db2.gz MQFGVIKSOSHTEU-UHFFFAOYSA-N 2 0 360.889 2.655 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)cc1 ZINC001560311777 1076262506 /nfs/dbraw/zinc/26/25/06/1076262506.db2.gz ZYKZAGQJZXYTTG-UHFFFAOYSA-N 2 0 360.546 2.565 20 10 FFCDRP CC[C@@H]1[C@@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@@H+]1C ZINC001571388425 1077249796 /nfs/dbraw/zinc/24/97/96/1077249796.db2.gz PYBNYYMDMXOBTH-NZSAHSFTSA-N 2 0 361.530 2.670 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1F ZINC000363891737 511833753 /nfs/dbraw/zinc/83/37/53/511833753.db2.gz UXLNKKCCNBZLSX-UHFFFAOYSA-N 2 0 362.537 2.741 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCN2CCC([NH3+])CC2)c1O ZINC000925809882 738531630 /nfs/dbraw/zinc/53/16/30/738531630.db2.gz BMIFSQLJJPEYIK-LBPRGKRZSA-N 2 0 356.308 2.537 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000873291361 731897662 /nfs/dbraw/zinc/89/76/62/731897662.db2.gz FTLSXWGZCRFTSR-OCCSQVGLSA-N 2 0 369.303 2.964 20 10 FFCDRP C[NH+](C)CCCCC(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000771057402 737689797 /nfs/dbraw/zinc/68/97/97/737689797.db2.gz IYELTURJEIPCJU-QGZVFWFLSA-N 2 0 367.921 2.858 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](n4cc(Cl)cn4)C3)cc2)CC1 ZINC000811520145 741533286 /nfs/dbraw/zinc/53/32/86/741533286.db2.gz KILMKNHTZDESNI-IBGZPJMESA-N 2 0 359.905 2.735 20 10 FFCDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817888576 742220981 /nfs/dbraw/zinc/22/09/81/742220981.db2.gz MRHPUKUSHHMEHT-DYVFJYSZSA-N 2 0 357.420 2.759 20 10 FFCDRP CCON1CCC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000925677119 971767840 /nfs/dbraw/zinc/76/78/40/971767840.db2.gz OEWTYIDUWOXYEE-UHFFFAOYSA-N 2 0 372.557 2.724 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3cc[nH+]cc3C(F)(F)F)cc2)CC1 ZINC001167434869 963185190 /nfs/dbraw/zinc/18/51/90/963185190.db2.gz XCMFFTIFKBFTRI-UHFFFAOYSA-N 2 0 350.388 2.886 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000840759665 972959667 /nfs/dbraw/zinc/95/96/67/972959667.db2.gz ZTVNWQMKRAVLJQ-AYOQOUSVSA-N 2 0 365.468 2.764 20 10 FFCDRP [NH3+]CC[C@H]1CN(c2ncnc3sc4c(c32)CC[NH2+]C4)c2ccccc21 ZINC001168545336 985202101 /nfs/dbraw/zinc/20/21/01/985202101.db2.gz OBCHNVXFFNMBTE-LBPRGKRZSA-N 2 0 351.479 2.921 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126121 986557632 /nfs/dbraw/zinc/55/76/32/986557632.db2.gz GRVUJYMCZHRKFT-RTWAWAEBSA-N 3 0 356.558 2.650 20 10 FFCDRP Cc1cc(CO)cc(C)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000922560475 988690703 /nfs/dbraw/zinc/69/07/03/988690703.db2.gz JBGHNLFVOVTYCP-UHFFFAOYSA-N 2 0 353.510 2.837 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515482 998627137 /nfs/dbraw/zinc/62/71/37/998627137.db2.gz PZLQAGGYENWKOX-SJORKVTESA-N 2 0 354.450 2.757 20 10 FFCDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775652534 1004959130 /nfs/dbraw/zinc/95/91/30/1004959130.db2.gz MSOZRSCDWSLBTB-UHFFFAOYSA-N 3 0 358.574 2.992 20 10 FFCDRP COc1cc(C[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850119795 1005787480 /nfs/dbraw/zinc/78/74/80/1005787480.db2.gz SUKZLKQKZFGHCP-MRXNPFEDSA-N 2 0 363.546 2.671 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnn3-c3ccccc3)cc2)CC1 ZINC000883283949 1006732180 /nfs/dbraw/zinc/73/21/80/1006732180.db2.gz ZVZHKVFFYVJTEF-UHFFFAOYSA-N 2 0 361.493 2.914 20 10 FFCDRP COC(=O)C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000883283933 1006732370 /nfs/dbraw/zinc/73/23/70/1006732370.db2.gz ZEOBTCBWTFQWHU-XKGZKEIXSA-N 2 0 359.514 2.506 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000854231282 1006733776 /nfs/dbraw/zinc/73/37/76/1006733776.db2.gz IMKMAXLXMCDFTH-MRXNPFEDSA-N 2 0 373.541 2.912 20 10 FFCDRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817917583 1007808323 /nfs/dbraw/zinc/80/83/23/1007808323.db2.gz SEJPHCXGRIWFBA-AVRDEDQJSA-N 3 0 356.558 2.696 20 10 FFCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCCN1CC[NH2+]CC1 ZINC000817937112 1007816860 /nfs/dbraw/zinc/81/68/60/1007816860.db2.gz TTZPKWPPUDVFNQ-OAQYLSRUSA-N 2 0 353.510 2.951 20 10 FFCDRP COc1ccc([C@H](NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)[C@@H]2CCC[NH2+]2)cc1 ZINC000817942300 1007820577 /nfs/dbraw/zinc/82/05/77/1007820577.db2.gz NVJSTUJWUXBODW-FSSWDIPSSA-N 2 0 368.525 2.844 20 10 FFCDRP COc1ccc([C@H](NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)[C@H]2CCC[NH2+]2)cc1 ZINC000817942301 1007820607 /nfs/dbraw/zinc/82/06/07/1007820607.db2.gz NVJSTUJWUXBODW-VSKRKVRLSA-N 2 0 368.525 2.844 20 10 FFCDRP NC1(C[NH2+][C@@H]2CCc3cccc(O)c32)CC[NH+](Cc2ccccc2)CC1 ZINC000817984615 1007837129 /nfs/dbraw/zinc/83/71/29/1007837129.db2.gz VUQXPSSBKMSNJZ-LJQANCHMSA-N 2 0 351.494 2.963 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552187 1007881880 /nfs/dbraw/zinc/88/18/80/1007881880.db2.gz IWFBJEKQFIWTDG-FQEVSTJZSA-N 2 0 371.481 2.901 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccccc3)cc2F)CC1 ZINC000819033126 1008027611 /nfs/dbraw/zinc/02/76/11/1008027611.db2.gz NQIIOBSAICYJQX-NRFANRHFSA-N 2 0 357.473 2.791 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)Cc3ccccc3)cc2F)CC1 ZINC000819033876 1008027983 /nfs/dbraw/zinc/02/79/83/1008027983.db2.gz TUJNWWFFDQNOFX-FQEVSTJZSA-N 2 0 371.500 2.661 20 10 FFCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@H]1CCC[NH2+]CC1 ZINC001206598467 1032359072 /nfs/dbraw/zinc/35/90/72/1032359072.db2.gz KHOQRYRKPSLMTO-IBGZPJMESA-N 3 0 362.537 2.930 20 10 FFCDRP CCOC(=O)[C@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000827750485 1018638874 /nfs/dbraw/zinc/63/88/74/1018638874.db2.gz HXKBXOPSQDUZIZ-PZJWPPBQSA-N 2 0 359.514 2.650 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc4ccccc4c3O)C[C@@H]1C[NH2+]CCC2 ZINC001222135600 1032779137 /nfs/dbraw/zinc/77/91/37/1032779137.db2.gz FRBNHYYEJGJOEN-AVRDEDQJSA-N 2 0 368.477 2.910 20 10 FFCDRP Oc1cccc2c1[C@@H]([NH2+]CCN1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000390893009 1019903830 /nfs/dbraw/zinc/90/38/30/1019903830.db2.gz ZNTZDXRLOCKCSR-FQEVSTJZSA-N 2 0 351.494 2.787 20 10 FFCDRP C[C@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1cc(F)ccc1O ZINC000390925373 1019904898 /nfs/dbraw/zinc/90/48/98/1019904898.db2.gz YQQPZVGDTZOSNR-KRWDZBQOSA-N 2 0 357.473 3.000 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3ccc4c(c3)C[NH2+]C4)CC2)cc1 ZINC001164334144 1029248975 /nfs/dbraw/zinc/24/89/75/1029248975.db2.gz ORLVNYJKTUBHDG-UHFFFAOYSA-N 2 0 366.509 2.923 20 10 FFCDRP Cc1ccc(O)c(C[NH2+]Cc2ccc(C[NH+]3CCC(C(N)=O)CC3)cc2)c1 ZINC000840973853 1029955782 /nfs/dbraw/zinc/95/57/82/1029955782.db2.gz XFMXGFLUMTZZMH-UHFFFAOYSA-N 2 0 367.493 2.688 20 10 FFCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001203555535 1030763264 /nfs/dbraw/zinc/76/32/64/1030763264.db2.gz CEEVYBCOPZOFLU-TZIWHRDSSA-N 2 0 353.466 2.510 20 10 FFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(OC)c1O)C2 ZINC001203592677 1030775973 /nfs/dbraw/zinc/77/59/73/1030775973.db2.gz VSJMHQXZFBKCKC-RXVVDRJESA-N 2 0 360.498 2.581 20 10 FFCDRP COc1ccc(C[NH+]2CCC3(CC2)CN(Cc2ccoc2)CCO3)c(O)c1 ZINC001203622096 1030788496 /nfs/dbraw/zinc/78/84/96/1030788496.db2.gz ORDCKXPHQMNLTQ-UHFFFAOYSA-N 2 0 372.465 2.861 20 10 FFCDRP C[NH+](C)CCN(Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001204604814 1031387622 /nfs/dbraw/zinc/38/76/22/1031387622.db2.gz YIRPXHPIBNMMGC-UHFFFAOYSA-N 2 0 352.526 2.660 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H](c2ccccc2)C1 ZINC001204691463 1031412313 /nfs/dbraw/zinc/41/23/13/1031412313.db2.gz FYPHVGDNRCLXET-QFIPXVFZSA-N 2 0 350.510 2.585 20 10 FFCDRP C[C@H](CC[NH+](C)C)C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353241 1031703800 /nfs/dbraw/zinc/70/38/00/1031703800.db2.gz CRRRYPYBVMVUCF-RHSMWYFYSA-N 2 0 367.921 2.714 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3ccncc3C)C2)cc(C[NH+](C)C)c1O ZINC001139260017 1035031180 /nfs/dbraw/zinc/03/11/80/1035031180.db2.gz HTBLJFDGEDGUMN-SFHVURJKSA-N 2 0 371.481 2.819 20 10 FFCDRP CCOC(=O)[C@]1(C)CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259317 1035031767 /nfs/dbraw/zinc/03/17/67/1035031767.db2.gz QYUDWGAJEWVRDL-HXUWFJFHSA-N 2 0 364.486 2.628 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](c3nnc(C)o3)C2)cc(C[NH+](C)C)c1O ZINC001139259291 1035032217 /nfs/dbraw/zinc/03/22/17/1035032217.db2.gz PMEGWTCNYWKRRL-HNNXBMFYSA-N 2 0 360.458 2.533 20 10 FFCDRP CCOC(=O)C1(C)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139409806 1035093788 /nfs/dbraw/zinc/09/37/88/1035093788.db2.gz UJJIAUJSBLIWIB-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@H]3C[NH+]3CCCC3)cc2)CC1 ZINC001139409910 1035094298 /nfs/dbraw/zinc/09/42/98/1035094298.db2.gz UXPIIOQCENAHSR-QFIPXVFZSA-N 2 0 356.558 2.889 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CC(F)(F)CS4)cc2)CC1 ZINC001139412843 1035097216 /nfs/dbraw/zinc/09/72/16/1035097216.db2.gz PWJKCXZSEOKZLV-UHFFFAOYSA-N 2 0 353.482 2.765 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C(=O)OC)[C@H]3C)cc2)CC1 ZINC001140304289 1035426183 /nfs/dbraw/zinc/42/61/83/1035426183.db2.gz LXQWSJNGFMMIEU-XLIONFOSSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](CC(=O)OC)C3)cc2)CC1 ZINC001140305947 1035427626 /nfs/dbraw/zinc/42/76/26/1035427626.db2.gz IVDYNUXSJXXLPU-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CC[C@@H]([NH+]4CCOCC4)CC3)cc2)CC1 ZINC001234660403 1037129105 /nfs/dbraw/zinc/12/91/05/1037129105.db2.gz HKNIDEYVONCJSG-GRGXKFILSA-N 2 0 373.541 2.851 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714025 1037706102 /nfs/dbraw/zinc/70/61/02/1037706102.db2.gz FPLYMTBLKSNNOU-QGZVFWFLSA-N 2 0 367.493 2.581 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCN[C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855683 1037796706 /nfs/dbraw/zinc/79/67/06/1037796706.db2.gz UWISPNSENINJAZ-JOCHJYFZSA-N 2 0 350.510 2.585 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3ccc4ccccc4c3O)C[C@H]1C[NH2+]CC2 ZINC001236041373 1037903777 /nfs/dbraw/zinc/90/37/77/1037903777.db2.gz ROKYWXOVSFRNFV-DYESRHJHSA-N 2 0 354.450 2.520 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CCC(N3CC[NH2+]CC3)CC2)cc1 ZINC001236129720 1037943969 /nfs/dbraw/zinc/94/39/69/1037943969.db2.gz PVDCNUGAWSUYNU-UHFFFAOYSA-N 2 0 352.526 2.964 20 10 FFCDRP CCOC(=O)C1(CC)CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001236264908 1038008401 /nfs/dbraw/zinc/00/84/01/1038008401.db2.gz FNDLCZJWAOWOFI-UHFFFAOYSA-N 2 0 359.514 2.652 20 10 FFCDRP Oc1cc2c(cc1CN(Cc1ccccc1)[C@H]1CCC[NH2+]C1)C[NH2+]CCO2 ZINC001236270221 1038010812 /nfs/dbraw/zinc/01/08/12/1038010812.db2.gz JXSIZMGQCYJORK-FQEVSTJZSA-N 2 0 367.493 2.628 20 10 FFCDRP Cc1ccnc(O[C@H]2CCC[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)c1 ZINC001236533687 1038121813 /nfs/dbraw/zinc/12/18/13/1038121813.db2.gz YBLQIURFTUWBII-SFHVURJKSA-N 2 0 369.465 2.621 20 10 FFCDRP COc1cc(O)c(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c(Cl)c1 ZINC001236806510 1038282066 /nfs/dbraw/zinc/28/20/66/1038282066.db2.gz XOGXPRLYECEOOZ-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP Cc1cccc(O[C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)n1 ZINC001236847302 1038306070 /nfs/dbraw/zinc/30/60/70/1038306070.db2.gz IZIFXWGCDBSHAY-OAQYLSRUSA-N 2 0 366.509 2.843 20 10 FFCDRP CO[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C[C@@H]21 ZINC001236937750 1038366814 /nfs/dbraw/zinc/36/68/14/1038366814.db2.gz DUKQBXFOJXJIEL-LKUPVBHCSA-N 2 0 361.505 2.824 20 10 FFCDRP Cc1nc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)CC2)no1 ZINC001236938896 1038369000 /nfs/dbraw/zinc/36/90/00/1038369000.db2.gz PCRXKTKMHMENTR-UHFFFAOYSA-N 2 0 373.476 2.649 20 10 FFCDRP COc1cccc2c1CC[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246172815 1039263931 /nfs/dbraw/zinc/26/39/31/1039263931.db2.gz IPKFINJDYDCHDT-IBGZPJMESA-N 2 0 351.494 2.752 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2O)CC[N@@H+]1C1CCCCC1 ZINC001237250791 1043074847 /nfs/dbraw/zinc/07/48/47/1043074847.db2.gz XYYVUGXCSVVXDO-SFHVURJKSA-N 2 0 372.557 2.641 20 10 FFCDRP COc1cc(O)c(CN2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1Br ZINC001237418166 1043150276 /nfs/dbraw/zinc/15/02/76/1043150276.db2.gz WOXXGHGTQIRPLN-SMDDNHRTSA-N 2 0 355.276 2.737 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CCC[N@H+](Cc1ccc(C(F)(F)F)cc1O)C2 ZINC001279513414 1043208893 /nfs/dbraw/zinc/20/88/93/1043208893.db2.gz DWMSJANZEODHFG-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP Cc1c(C[C@H](C[NH3+])C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cnn1C ZINC001579529546 1078639662 /nfs/dbraw/zinc/63/96/62/1078639662.db2.gz KRHINDKWSWJHMP-LJQANCHMSA-N 2 0 355.530 2.578 20 10 FFCDRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001560985554 1076316617 /nfs/dbraw/zinc/31/66/17/1076316617.db2.gz FIBMVZFBBZWJQJ-YFVAEKQCSA-N 2 0 373.541 2.896 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4c3cnn4C)cc2F)CC1 ZINC000155321147 508976468 /nfs/dbraw/zinc/97/64/68/508976468.db2.gz JUDRWBBVCXLGPQ-LJQANCHMSA-N 2 0 371.504 2.868 20 10 FFCDRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1O ZINC000155593952 509033592 /nfs/dbraw/zinc/03/35/92/509033592.db2.gz AMUAQHDGASJTOY-IBGZPJMESA-N 2 0 355.482 2.925 20 10 FFCDRP COc1ccc(N2CCC[N@H+](CCCN3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000192724087 509615964 /nfs/dbraw/zinc/61/59/64/509615964.db2.gz QJIPWUWUWFVXPR-UHFFFAOYSA-N 2 0 374.573 2.623 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)C(=O)NCC[NH+](C)C ZINC000756855817 736367321 /nfs/dbraw/zinc/36/73/21/736367321.db2.gz AZNXVBBIDALMAD-CJNGLKHVSA-N 2 0 355.910 2.789 20 10 FFCDRP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502162 738097554 /nfs/dbraw/zinc/09/75/54/738097554.db2.gz PDJPOMRMWGYCQI-CJNGLKHVSA-N 2 0 353.894 2.674 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)c1O ZINC000842479181 747613982 /nfs/dbraw/zinc/61/39/82/747613982.db2.gz PDYKHGKZRZXMHX-IEBWSBKVSA-N 2 0 366.889 2.967 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c2c1c(F)ccc2O ZINC000873243047 1013442694 /nfs/dbraw/zinc/44/26/94/1013442694.db2.gz IVAJWEQKDLQFEG-PXAZEXFGSA-N 2 0 367.428 2.909 20 10 FFCDRP CCn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)c(F)c2)c(C)n1 ZINC000892904834 970363147 /nfs/dbraw/zinc/36/31/47/970363147.db2.gz DNRFLUVXTHKNKR-UHFFFAOYSA-N 2 0 359.493 2.782 20 10 FFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2(N3CCOCC3)CC[NH+](C)CC2)cc1 ZINC000840831976 973405169 /nfs/dbraw/zinc/40/51/69/973405169.db2.gz DSYKJUQFBCQDJY-IBGZPJMESA-N 2 0 374.573 2.590 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1)c1ccccc1O ZINC000840889132 974108468 /nfs/dbraw/zinc/10/84/68/974108468.db2.gz OUAOPOXTCZIGCH-MRXNPFEDSA-N 2 0 367.493 2.940 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000127941549 975552166 /nfs/dbraw/zinc/55/21/66/975552166.db2.gz CCPZFBYICSNTBH-QUCCMNQESA-N 2 0 372.557 2.915 20 10 FFCDRP Cc1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c(O)c1 ZINC000877028374 1014454988 /nfs/dbraw/zinc/45/49/88/1014454988.db2.gz VYBQPSARJOWPFI-HXUWFJFHSA-N 2 0 367.493 2.688 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000760284729 981585632 /nfs/dbraw/zinc/58/56/32/981585632.db2.gz FYNGWTUGSQIXDK-UHFFFAOYSA-N 2 0 361.530 2.700 20 10 FFCDRP CCOCc1cc(C[NH2+]C(C)(C)CCN2CC[NH+](C)CC2)ccc1OC ZINC000185888436 984056742 /nfs/dbraw/zinc/05/67/42/984056742.db2.gz FTBUVDXBXDRTDL-UHFFFAOYSA-N 2 0 363.546 2.737 20 10 FFCDRP CCc1noc([C@H]2CC[C@H]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000922864798 988965974 /nfs/dbraw/zinc/96/59/74/988965974.db2.gz TVWQFLOKVOAPOQ-ROUUACIJSA-N 2 0 369.513 2.810 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@@H]3CC[N@H+](C)[C@@H]3C)C2)cc1C ZINC001086700324 995317897 /nfs/dbraw/zinc/31/78/97/995317897.db2.gz KJVBNHBXOJFUID-GSEOLPGOSA-N 2 0 373.541 2.718 20 10 FFCDRP Cc1ccc2c(c1)nc(C[NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)n2C ZINC000769556788 1000548049 /nfs/dbraw/zinc/54/80/49/1000548049.db2.gz SJEDMLNKBPFVCD-UHFFFAOYSA-N 2 0 363.509 2.923 20 10 FFCDRP Cc1cc([C@](C)(O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)o1 ZINC000771840008 1001211899 /nfs/dbraw/zinc/21/18/99/1001211899.db2.gz CJGGWHURASHTLN-OAQYLSRUSA-N 2 0 357.498 2.646 20 10 FFCDRP COc1c(C)cnc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC000771817677 1001217934 /nfs/dbraw/zinc/21/79/34/1001217934.db2.gz CKWIAGXFOPEYSF-UHFFFAOYSA-N 2 0 354.498 2.749 20 10 FFCDRP CC(C)n1ncc2c1C[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CC2 ZINC000790995947 1002537391 /nfs/dbraw/zinc/53/73/91/1002537391.db2.gz PRZHQCGJNOYTCE-HXUWFJFHSA-N 2 0 367.541 2.863 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)OCCC[NH+](C)C)C1 ZINC000792185737 1002938002 /nfs/dbraw/zinc/93/80/02/1002938002.db2.gz POWGWWZJCZPNBR-UHFFFAOYSA-N 2 0 357.498 2.903 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCCO)Cc3ccccc3)cc2)CC1 ZINC000775681715 1003635490 /nfs/dbraw/zinc/63/54/90/1003635490.db2.gz RYSHOJZYWVNHJL-UHFFFAOYSA-N 2 0 353.510 2.823 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721250 1003792419 /nfs/dbraw/zinc/79/24/19/1003792419.db2.gz UUFJOPPBRSYGRN-NRFANRHFSA-N 3 0 356.558 2.746 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1n1ccnc1 ZINC000775738145 1003930100 /nfs/dbraw/zinc/93/01/00/1003930100.db2.gz UFXMLDGXRQWLFC-GHTZIAJQSA-N 2 0 353.514 2.718 20 10 FFCDRP COc1ccc(OCC[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775647305 1004914333 /nfs/dbraw/zinc/91/43/33/1004914333.db2.gz UNZHALOFJNUBJZ-UHFFFAOYSA-N 2 0 369.509 2.958 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000853093069 1006293192 /nfs/dbraw/zinc/29/31/92/1006293192.db2.gz AUEFUQKXLMOKAT-OAQYLSRUSA-N 3 0 356.558 2.650 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000854231628 1006734454 /nfs/dbraw/zinc/73/44/54/1006734454.db2.gz NBENYDGZGOLZLN-CJNGLKHVSA-N 2 0 363.477 2.660 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3Cc4ccccc4CO3)cc2)CC1 ZINC000858212011 1008325952 /nfs/dbraw/zinc/32/59/52/1008325952.db2.gz ODJAQNBSSPTBBO-QFIPXVFZSA-N 2 0 351.494 2.670 20 10 FFCDRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773143529 1009704088 /nfs/dbraw/zinc/70/40/88/1009704088.db2.gz AUAMWQOXZXXOKW-FDDCHVKYSA-N 2 0 368.569 2.791 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@H]2C1 ZINC001120072577 1023229837 /nfs/dbraw/zinc/22/98/37/1023229837.db2.gz XHBKQSKFQLHNEF-IPMKNSEASA-N 2 0 361.505 2.824 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(OC)ccc3O)cn2)CC1 ZINC000756432498 1023710335 /nfs/dbraw/zinc/71/03/35/1023710335.db2.gz IXPLGOIPBMATKX-MRXNPFEDSA-N 2 0 370.497 2.789 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548171 1023725731 /nfs/dbraw/zinc/72/57/31/1023725731.db2.gz JAXCOQHTKNZDCE-NVXWUHKLSA-N 2 0 355.482 2.783 20 10 FFCDRP COC(=O)[C@@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779431772 1023843112 /nfs/dbraw/zinc/84/31/12/1023843112.db2.gz DQYYZINGBRURDW-FPOVZHCZSA-N 2 0 359.514 2.650 20 10 FFCDRP CN1CC[NH+](CC2(C)CC[NH+](Cc3c(O)ccc4ccncc43)CC2)CC1 ZINC000758261423 1024003723 /nfs/dbraw/zinc/00/37/23/1024003723.db2.gz BAIFSRXADHYPJA-UHFFFAOYSA-N 2 0 368.525 2.790 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3ccc([C@H](C)[NH3+])nc3)CC2)cc1 ZINC001164335738 1029249008 /nfs/dbraw/zinc/24/90/08/1029249008.db2.gz JFRFCQHGWJQGQX-KRWDZBQOSA-N 2 0 369.513 2.734 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccccc3)cc2)CC1 ZINC000841101568 1030037060 /nfs/dbraw/zinc/03/70/60/1030037060.db2.gz WBJIRMWATUCDGD-JOCHJYFZSA-N 2 0 350.510 2.585 20 10 FFCDRP COc1cc(CN2CC[NH+](CC3CCCC3)CC2)cc(C[NH+](C)C)c1O ZINC001139256713 1035030457 /nfs/dbraw/zinc/03/04/57/1035030457.db2.gz HYHRHPNJXLZJCG-UHFFFAOYSA-N 2 0 361.530 2.770 20 10 FFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@]1(O)C(F)(F)F ZINC001139408026 1035092332 /nfs/dbraw/zinc/09/23/32/1035092332.db2.gz ITKASEKKCZTDRG-QAPCUYQASA-N 2 0 371.447 2.574 20 10 FFCDRP CCO[C@@H]1CO[C@@]2(C1)CCC[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001139408434 1035092394 /nfs/dbraw/zinc/09/23/94/1035092394.db2.gz VMLACOGWNJXRGS-FCHUYYIVSA-N 2 0 373.541 2.598 20 10 FFCDRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949656 1036545533 /nfs/dbraw/zinc/54/55/33/1036545533.db2.gz GFTITOLJXDYTTK-IFMALSPDSA-N 2 0 367.493 2.819 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429422 1037543420 /nfs/dbraw/zinc/54/34/20/1037543420.db2.gz UENRAZQRDUTYKQ-OALUTQOASA-N 2 0 374.548 2.789 20 10 FFCDRP CC1CCC([NH+]2CCN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)CC1 ZINC001235670537 1037675163 /nfs/dbraw/zinc/67/51/63/1037675163.db2.gz UKUKQCXTVVPVCZ-UHFFFAOYSA-N 2 0 356.558 2.793 20 10 FFCDRP c1csc(CC[NH+]2CCN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001235691310 1037689244 /nfs/dbraw/zinc/68/92/44/1037689244.db2.gz IVPXDERYSYRPKL-UHFFFAOYSA-N 2 0 370.566 2.518 20 10 FFCDRP c1ccc(COC[C@@H]2CC[N@@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235714910 1037706201 /nfs/dbraw/zinc/70/62/01/1037706201.db2.gz MMRMWPIUQIAYKW-QFIPXVFZSA-N 2 0 351.494 2.887 20 10 FFCDRP Cc1cc(F)ccc1N1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001236154284 1037954429 /nfs/dbraw/zinc/95/44/29/1037954429.db2.gz PIDINUXCKSPOOX-UHFFFAOYSA-N 2 0 368.500 2.866 20 10 FFCDRP COc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(Br)c1 ZINC001236321665 1038046058 /nfs/dbraw/zinc/04/60/58/1038046058.db2.gz VIJSKNUCENLHND-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP Cc1ccnc(OC2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001236533651 1038122512 /nfs/dbraw/zinc/12/25/12/1038122512.db2.gz DZHPFYYZZHXBAV-UHFFFAOYSA-N 2 0 366.509 2.843 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](Oc4cccnc4)C3)c(F)c2)CC1 ZINC001236941216 1038371288 /nfs/dbraw/zinc/37/12/88/1038371288.db2.gz YEOIJZWGOTWXDD-HXUWFJFHSA-N 2 0 370.472 2.626 20 10 FFCDRP CCOc1cccc(C[NH+]2CCC3(CC[N@H+](CCN(C)C)C3)CC2)c1O ZINC001278576039 1041233831 /nfs/dbraw/zinc/23/38/31/1041233831.db2.gz DEYCLWMEJOQAOB-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP COc1cc(O)c(CN2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1Br ZINC001237418164 1043149985 /nfs/dbraw/zinc/14/99/85/1043149985.db2.gz WOXXGHGTQIRPLN-FZMZJTMJSA-N 2 0 355.276 2.737 20 10 FFCDRP CCOC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237485314 1043199297 /nfs/dbraw/zinc/19/92/97/1043199297.db2.gz NVGWVKPEERMTOD-QGZVFWFLSA-N 2 0 360.498 2.940 20 10 FFCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)c(Cl)c3)C[C@H]2CC1 ZINC001279558937 1043254656 /nfs/dbraw/zinc/25/46/56/1043254656.db2.gz HTQKTGYLUFCOGL-HDICACEKSA-N 2 0 363.933 2.950 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1Cl ZINC001279571105 1043274177 /nfs/dbraw/zinc/27/41/77/1043274177.db2.gz DLVKOSKEIAFLQT-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC001308200560 1052430901 /nfs/dbraw/zinc/43/09/01/1052430901.db2.gz JFMWOQCPWYPSAY-UHFFFAOYSA-N 2 0 367.541 2.969 20 10 FFCDRP CCc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)c1O ZINC000848893463 1055314705 /nfs/dbraw/zinc/31/47/05/1055314705.db2.gz DJMYRNVFYQZWHS-UHFFFAOYSA-N 2 0 354.498 2.781 20 10 FFCDRP C[C@@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001472281310 1064998264 /nfs/dbraw/zinc/99/82/64/1064998264.db2.gz VBFIUUQCQZBJNV-PFRQMTDMSA-N 2 0 360.546 2.733 20 10 FFCDRP COCC[NH+](CCOC)C1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000289897865 511120529 /nfs/dbraw/zinc/12/05/29/511120529.db2.gz WRBGBNSKALUEPW-UHFFFAOYSA-N 2 0 356.894 2.605 20 10 FFCDRP C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)CN1CC[NH+](C)CC1 ZINC000280784579 511601721 /nfs/dbraw/zinc/60/17/21/511601721.db2.gz FYHCCDRBFQVQMD-OAHLLOKOSA-N 2 0 372.479 2.745 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN[C@H](C)c3cc(C)n(C)n3)cc2F)CC1 ZINC000282127133 512083191 /nfs/dbraw/zinc/08/31/91/512083191.db2.gz JVEWJHFPWXOUDD-MRXNPFEDSA-N 2 0 359.493 2.860 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)CCN2CC[NH+](C)CC2)cc1F ZINC000185866225 729357822 /nfs/dbraw/zinc/35/78/22/729357822.db2.gz RHYMIMUVNWMJEU-QGZVFWFLSA-N 2 0 350.526 2.788 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@@H](C)C1 ZINC000894256430 734825952 /nfs/dbraw/zinc/82/59/52/734825952.db2.gz QIASBHGHTJGSMA-WMZOPIPTSA-N 2 0 350.503 2.936 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccc(Cl)cc3)cc2)CC1 ZINC000813794878 741764227 /nfs/dbraw/zinc/76/42/27/741764227.db2.gz ZLQFELSENAKUHS-HXUWFJFHSA-N 2 0 359.901 2.915 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)c1O ZINC000817973245 742225192 /nfs/dbraw/zinc/22/51/92/742225192.db2.gz RNWZUHGBUMAJGM-FZMZJTMJSA-N 2 0 365.827 2.841 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)c1O ZINC000841103853 747270272 /nfs/dbraw/zinc/27/02/72/747270272.db2.gz KYQPVKZJJQHZBX-HOTGVXAUSA-N 2 0 354.878 2.773 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c(O)c1C ZINC000873244407 1013444566 /nfs/dbraw/zinc/44/45/66/1013444566.db2.gz RWLHXGZEULOVAH-OAHLLOKOSA-N 2 0 351.454 2.899 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(N(C)C)cc1 ZINC000873247396 1013447484 /nfs/dbraw/zinc/44/74/84/1013447484.db2.gz MAPJJYAYRLAYIO-OAHLLOKOSA-N 2 0 350.470 2.643 20 10 FFCDRP Cc1ccnc(N)c1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000894358019 964989413 /nfs/dbraw/zinc/98/94/13/964989413.db2.gz BJITVYMAJSZSSA-UHFFFAOYSA-N 2 0 365.525 2.794 20 10 FFCDRP COc1ccc(C[NH2+]Cc2ccccc2OCC[NH+](C)C)c(O)c1OC ZINC000892735204 970263687 /nfs/dbraw/zinc/26/36/87/970263687.db2.gz DAGDVTUDQZCGDM-UHFFFAOYSA-N 2 0 360.454 2.640 20 10 FFCDRP COC(=O)c1c(CNC[C@@H]2CC[N@@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172205 978098225 /nfs/dbraw/zinc/09/82/25/978098225.db2.gz DPNIQKTZBBWVTI-ZDUSSCGKSA-N 2 0 359.445 2.678 20 10 FFCDRP Cc1cc(C[NH3+])cc(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000904520341 980291915 /nfs/dbraw/zinc/29/19/15/980291915.db2.gz QMRGOWXIPNIINV-HXUWFJFHSA-N 2 0 369.513 2.944 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3F)cc2)CC1 ZINC000905428735 980438334 /nfs/dbraw/zinc/43/83/34/980438334.db2.gz VNEVHBDEORVYFE-HXUWFJFHSA-N 2 0 361.436 2.540 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](OCc4ccccn4)C3)cc2)CC1 ZINC000877645488 1014657870 /nfs/dbraw/zinc/65/78/70/1014657870.db2.gz MSZNOTSFWZZYPF-QFIPXVFZSA-N 2 0 366.509 2.625 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126119 986557060 /nfs/dbraw/zinc/55/70/60/986557060.db2.gz GRVUJYMCZHRKFT-NHCUHLMSSA-N 3 0 356.558 2.650 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000922391154 988547333 /nfs/dbraw/zinc/54/73/33/988547333.db2.gz UCYGIXDYAVJXDK-JZYPVNQISA-N 2 0 357.542 2.835 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCC4)[C@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811518196 995162618 /nfs/dbraw/zinc/16/26/18/995162618.db2.gz GSDMGGMAYZBFTC-LEWJYISDSA-N 2 0 355.526 2.972 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)cc2)CC1 ZINC000824695648 997058081 /nfs/dbraw/zinc/05/80/81/997058081.db2.gz AGEIYAZUZNJBDX-BDTNDASRSA-N 2 0 357.542 2.954 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C)(C)N(O)C(C)(C)C3)cc2)CC1 ZINC001169974685 1000140875 /nfs/dbraw/zinc/14/08/75/1000140875.db2.gz LAQMQFBDMQHNLT-UHFFFAOYSA-N 2 0 360.546 2.939 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCNC(=O)CC3CCCCC3)cc2)CC1 ZINC000790543300 1002419161 /nfs/dbraw/zinc/41/91/61/1002419161.db2.gz JHFVUEOGDNNQRX-UHFFFAOYSA-N 2 0 372.557 2.615 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)CC[C@H]2CCCC[N@@H+]2C)[NH+](C)C)cc1 ZINC001184426893 1002611870 /nfs/dbraw/zinc/61/18/70/1002611870.db2.gz POUJKGIIBXITMR-WOJBJXKFSA-N 2 0 360.546 2.736 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccccc4[C@@H]3CO)cc2)CC1 ZINC000775699617 1003706179 /nfs/dbraw/zinc/70/61/79/1003706179.db2.gz AWWNBVASJWQLKQ-QFIPXVFZSA-N 2 0 351.494 2.530 20 10 FFCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775657997 1004980794 /nfs/dbraw/zinc/98/07/94/1004980794.db2.gz KJOOMPIVDPDETH-UHFFFAOYSA-N 3 0 358.574 2.991 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(O)cc4CC3)cc2)CC1 ZINC000775666382 1005007675 /nfs/dbraw/zinc/00/76/75/1005007675.db2.gz XETZQPDDLAPQOG-UHFFFAOYSA-N 2 0 351.494 2.745 20 10 FFCDRP Oc1cc2c(cc1C[NH2+]CC1CC[NH+](Cc3ccncc3)CC1)OCO2 ZINC000850361736 1005811137 /nfs/dbraw/zinc/81/11/37/1005811137.db2.gz CJMGQYPKCKYJQV-UHFFFAOYSA-N 2 0 355.438 2.518 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](Cc4ccccc4)C3)cc2)CC1 ZINC000776690637 1006524633 /nfs/dbraw/zinc/52/46/33/1006524633.db2.gz GRLZIHJMXSFCIU-QHCPKHFHSA-N 2 0 365.521 2.882 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnn3CC3CCC3)cc2)CC1 ZINC000883282911 1006730264 /nfs/dbraw/zinc/73/02/64/1006730264.db2.gz KXWQTQBMQHTOKI-UHFFFAOYSA-N 2 0 353.514 2.725 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnc(C(C)(C)C)nc3)cc2)CC1 ZINC000883283458 1006730974 /nfs/dbraw/zinc/73/09/74/1006730974.db2.gz GMUUARNCPIBLCJ-UHFFFAOYSA-N 2 0 353.514 2.816 20 10 FFCDRP COc1ccc(OC)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000883284115 1006732032 /nfs/dbraw/zinc/73/20/32/1006732032.db2.gz FPESDZITLAMYJM-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817890558 1007786561 /nfs/dbraw/zinc/78/65/61/1007786561.db2.gz ZZKFWIIAHUVXAX-CQSZACIVSA-N 2 0 358.461 2.675 20 10 FFCDRP C[NH+]1CCC(O)(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC000796308519 1011799399 /nfs/dbraw/zinc/79/93/99/1011799399.db2.gz DFOLRSLFXACEEK-UHFFFAOYSA-N 2 0 365.521 2.796 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C[C@@H]3C3CCCC3)cc2)CC1 ZINC000925715301 1017823858 /nfs/dbraw/zinc/82/38/58/1017823858.db2.gz GFEIIXRQTBFJPQ-YADHBBJMSA-N 2 0 357.542 2.906 20 10 FFCDRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)CC1 ZINC000800369332 1020257983 /nfs/dbraw/zinc/25/79/83/1020257983.db2.gz OCIXZOTZLAVYKD-HXUWFJFHSA-N 2 0 374.573 2.590 20 10 FFCDRP CC(C)(C)[NH2+]CCC(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000935193878 1021610189 /nfs/dbraw/zinc/61/01/89/1021610189.db2.gz YCNYVJSCJJBHTN-UHFFFAOYSA-N 2 0 372.557 2.613 20 10 FFCDRP C[NH+](C)[C@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]2C1 ZINC001120070883 1023228949 /nfs/dbraw/zinc/22/89/49/1023228949.db2.gz CPVQVNSJMPUQAL-VWPQPMDRSA-N 3 0 356.558 2.601 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(F)ccc3O)cn2)CC1 ZINC000756433176 1023710415 /nfs/dbraw/zinc/71/04/15/1023710415.db2.gz OBRKMXQFWWLGAU-HNNXBMFYSA-N 2 0 358.461 2.919 20 10 FFCDRP c1c2c(nnc1N1CCCC3=C[C@H]4C[C@H](C[N@H+]5CCCC[C@H]45)[C@@H]31)CC[NH2+]C2 ZINC001155640840 1028831360 /nfs/dbraw/zinc/83/13/60/1028831360.db2.gz OMSNAZGUKCSCNH-HKBKIPCKSA-N 2 0 365.525 2.522 20 10 FFCDRP CCOCc1cc(C[NH2+]C2CCC([NH+]3CCNCC3)CC2)ccc1OC ZINC000841087164 1030027395 /nfs/dbraw/zinc/02/73/95/1030027395.db2.gz JRBLJGFINAOTAO-UHFFFAOYSA-N 2 0 361.530 2.538 20 10 FFCDRP NC1(C[NH2+]Cc2ccc3c(c2)CCO3)CC[NH+](Cc2ccccc2)CC1 ZINC000841103826 1030039350 /nfs/dbraw/zinc/03/93/50/1030039350.db2.gz KKRGFXOAHJJCOA-UHFFFAOYSA-N 2 0 351.494 2.705 20 10 FFCDRP CC(C)[N@@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3ccccc3O)CC[C@@H]21 ZINC001203552625 1030762033 /nfs/dbraw/zinc/76/20/33/1030762033.db2.gz PBRJBAXYNIOFLX-AABGKKOBSA-N 2 0 354.498 2.962 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753568 1030907099 /nfs/dbraw/zinc/90/70/99/1030907099.db2.gz FKYFNVLBFUAYAN-CEWLAPEOSA-N 3 0 374.548 2.930 20 10 FFCDRP CC[NH+](CC)CCCN1CC[NH+](Cc2ccc3c(c2)CCCN3C)CC1 ZINC001138356453 1034193350 /nfs/dbraw/zinc/19/33/50/1034193350.db2.gz OLVHTNNLKXBGJP-UHFFFAOYSA-N 2 0 358.574 2.919 20 10 FFCDRP CC[C@H](C(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1)[NH+](C)C ZINC001227057068 1034922369 /nfs/dbraw/zinc/92/23/69/1034922369.db2.gz LWNQPBKNSBPZIM-GUDVDZBRSA-N 2 0 361.530 2.861 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC[C@H]3Cc3ccccc3)cc2)CC1 ZINC001139411088 1035095517 /nfs/dbraw/zinc/09/55/17/1035095517.db2.gz UGTROMPBLQRQFN-HSZRJFAPSA-N 2 0 365.521 2.882 20 10 FFCDRP CN(C)c1ccc(/C=C/C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052738 1035493127 /nfs/dbraw/zinc/49/31/27/1035493127.db2.gz HIESVNJOSZHDHE-IOUFHMPJSA-N 2 0 356.558 2.866 20 10 FFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(I)cc1O ZINC001235718349 1037709511 /nfs/dbraw/zinc/70/95/11/1037709511.db2.gz ZJNSQPXFLMCMAD-UHFFFAOYSA-N 2 0 374.266 2.818 20 10 FFCDRP [NH3+]C1CN([C@H]2CCC[N@H+](Cc3cc(-c4ccc(F)cc4)ccc3O)C2)C1 ZINC001236077489 1037919250 /nfs/dbraw/zinc/91/92/50/1037919250.db2.gz IFVOCQRETYESPV-FQEVSTJZSA-N 2 0 355.457 2.806 20 10 FFCDRP c1ccc(CN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H]2CCC[NH2+]C2)cc1 ZINC001236271644 1038012223 /nfs/dbraw/zinc/01/22/23/1038012223.db2.gz UYXJQUNUSWKIRV-QHCPKHFHSA-N 2 0 364.537 2.850 20 10 FFCDRP c1ccc(C[C@@H]2COCC[N@@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001236304690 1038035072 /nfs/dbraw/zinc/03/50/72/1038035072.db2.gz OIFWYWRKNFTUKH-JOCHJYFZSA-N 2 0 351.494 2.540 20 10 FFCDRP CCc1ccc(C[N@@H+]2CCCn3cnc(COCC[NH+](C)C)c3C2)c(O)c1 ZINC001236788734 1038269250 /nfs/dbraw/zinc/26/92/50/1038269250.db2.gz NZHGGYGUKWIMFX-UHFFFAOYSA-N 2 0 372.513 2.635 20 10 FFCDRP Fc1ccc(N2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001236859881 1038313657 /nfs/dbraw/zinc/31/36/57/1038313657.db2.gz ONZVFKSKUUHIOS-UHFFFAOYSA-N 2 0 368.500 2.948 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CCC3(CC[N@H+](CCn4ccnc4)C3)CC2)c1 ZINC001278616740 1038838582 /nfs/dbraw/zinc/83/85/82/1038838582.db2.gz BIHXWXCVVQSUNP-UHFFFAOYSA-N 2 0 354.498 2.885 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4ccc[nH]4)C3)CC2)c(O)c1 ZINC001278428921 1039234610 /nfs/dbraw/zinc/23/46/10/1039234610.db2.gz WYERAVSGRPWDRN-UHFFFAOYSA-N 2 0 357.454 2.620 20 10 FFCDRP c1ccc(C[C@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173841 1039266730 /nfs/dbraw/zinc/26/67/30/1039266730.db2.gz MZGDPLDZJJLQDU-YADHBBJMSA-N 3 0 364.537 2.549 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@H]4CC[C@H](C)[NH2+]C4)C3)C2)cc1 ZINC001246707580 1039443260 /nfs/dbraw/zinc/44/32/60/1039443260.db2.gz ZAKCDAUNDLTJBL-VCOUNFBDSA-N 2 0 373.541 2.755 20 10 FFCDRP C[NH+](C)CCCN1CC[NH+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CC1 ZINC001249252808 1040654214 /nfs/dbraw/zinc/65/42/14/1040654214.db2.gz WBBOFBMGIROEFQ-UHFFFAOYSA-N 2 0 359.514 2.646 20 10 FFCDRP Oc1ccc([C@@H](O)C[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255382894 1041310847 /nfs/dbraw/zinc/31/08/47/1041310847.db2.gz YDJYRHVAUKMVSE-NQIIRXRSSA-N 2 0 356.466 2.776 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CC3(CCN3CC[NH+](C)C)C2)c2ccccc21 ZINC001279220908 1042950110 /nfs/dbraw/zinc/95/01/10/1042950110.db2.gz FDSKSFDAHLCACN-UHFFFAOYSA-N 2 0 352.526 2.728 20 10 FFCDRP C[NH+](C)CCN1CCC12C[NH+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001279323712 1043000189 /nfs/dbraw/zinc/00/01/89/1043000189.db2.gz GHLXRYGTBSESCC-UHFFFAOYSA-N 2 0 351.494 2.881 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC001279532987 1043231115 /nfs/dbraw/zinc/23/11/15/1043231115.db2.gz ASLVPHJGHYXKBJ-IRLDBZIGSA-N 2 0 356.558 2.745 20 10 FFCDRP COc1ccc(N(C)CC[N@H+](C)Cc2ccnn2-c2cc[nH+]cc2)cc1 ZINC001330818359 1049343230 /nfs/dbraw/zinc/34/32/30/1049343230.db2.gz OOKHFERRZIEVRD-UHFFFAOYSA-N 2 0 351.454 2.844 20 10 FFCDRP COc1ccc(C[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)cc1C ZINC001308233050 1052434885 /nfs/dbraw/zinc/43/48/85/1052434885.db2.gz UIRVDLBMPTXJPD-UHFFFAOYSA-N 2 0 354.498 2.701 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)C2C[NH+](C3CCCCC3)C2)[NH+](C)C)cc1 ZINC001456934650 1060232172 /nfs/dbraw/zinc/23/21/72/1060232172.db2.gz PMDGOTRNJKXGIX-OAQYLSRUSA-N 2 0 372.557 2.736 20 10 FFCDRP COc1cc(Cl)cc(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000377632527 512366728 /nfs/dbraw/zinc/36/67/28/512366728.db2.gz STKREOPPFMOXOC-KRWDZBQOSA-N 2 0 367.921 2.655 20 10 FFCDRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(Br)ccc1O ZINC000282357500 510943806 /nfs/dbraw/zinc/94/38/06/510943806.db2.gz PNJQHGLLYOCJKZ-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP CC(C)[C@H](C[NH2+]Cc1c(O)cccc1Br)N1CC[NH+](C)CC1 ZINC000858094974 730416375 /nfs/dbraw/zinc/41/63/75/730416375.db2.gz RGHCYGBBVKJSPY-INIZCTEOSA-N 2 0 370.335 2.516 20 10 FFCDRP Cc1nnsc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000877121545 732325555 /nfs/dbraw/zinc/32/55/55/732325555.db2.gz SNPLCYDQYRNRCU-UHFFFAOYSA-N 2 0 357.527 2.668 20 10 FFCDRP COc1cc(CN(CC[NH+](C)C)CC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000825916236 743342735 /nfs/dbraw/zinc/34/27/35/743342735.db2.gz KXJJFFBEKNRSQT-UHFFFAOYSA-N 2 0 351.535 2.624 20 10 FFCDRP COCC1(C[NH2+]Cc2cc(Br)cc(C)c2O)CC[NH2+]CC1 ZINC000841068818 747263195 /nfs/dbraw/zinc/26/31/95/747263195.db2.gz XIVCFUKUOXWJPF-UHFFFAOYSA-N 2 0 357.292 2.569 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)c1O ZINC000842478994 747613792 /nfs/dbraw/zinc/61/37/92/747613792.db2.gz NFJIUDNITMXKNM-SJLPKXTDSA-N 2 0 366.889 2.967 20 10 FFCDRP Cc1cc(Br)cc(C[NH+]2CCC(OCCC[NH3+])CC2)c1O ZINC000843056621 747757453 /nfs/dbraw/zinc/75/74/53/747757453.db2.gz SUGMHKYOGQMNNY-UHFFFAOYSA-N 2 0 357.292 2.793 20 10 FFCDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 ZINC000848716073 748993437 /nfs/dbraw/zinc/99/34/37/748993437.db2.gz DPMZREYBOKLOCB-HUUCEWRRSA-N 2 0 357.420 2.902 20 10 FFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2(N3CCOCC3)CC[NH+](C)CC2)cc1 ZINC000840831978 973406971 /nfs/dbraw/zinc/40/69/71/973406971.db2.gz DSYKJUQFBCQDJY-LJQANCHMSA-N 2 0 374.573 2.590 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1O ZINC001206011265 1032107287 /nfs/dbraw/zinc/10/72/87/1032107287.db2.gz BDDIDKWUPGYLKO-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1O ZINC001206011266 1032107835 /nfs/dbraw/zinc/10/78/35/1032107835.db2.gz BDDIDKWUPGYLKO-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](O)(C(F)(F)F)CC3)cc2)CC1 ZINC000809705600 994586179 /nfs/dbraw/zinc/58/61/79/994586179.db2.gz WEDUJKIDTDOTAE-GOSISDBHSA-N 2 0 371.447 2.718 20 10 FFCDRP CO[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1 ZINC000824589212 997000246 /nfs/dbraw/zinc/00/02/46/997000246.db2.gz CIFFEFSOQDLUSM-QFIPXVFZSA-N 2 0 353.510 2.786 20 10 FFCDRP Oc1ccccc1C[N@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000903893115 1016291423 /nfs/dbraw/zinc/29/14/23/1016291423.db2.gz QNSZWNVPLKBWBG-SFHVURJKSA-N 2 0 355.486 2.853 20 10 FFCDRP COc1cccc(O)c1C[NH+]1CCN(CC[N@H+](C)Cc2ccccc2)CC1 ZINC000769329899 1000493749 /nfs/dbraw/zinc/49/37/49/1000493749.db2.gz WELISEYFGHFYBM-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP Cn1c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)nc2cc(F)ccc21 ZINC000771843577 1001213232 /nfs/dbraw/zinc/21/32/32/1001213232.db2.gz TUYRKCIDKULJCE-UHFFFAOYSA-N 2 0 367.472 2.754 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(C)nn3C)cc2F)CC1 ZINC000793524666 1003400363 /nfs/dbraw/zinc/40/03/63/1003400363.db2.gz IXEZOQXMFNRQDI-INIZCTEOSA-N 2 0 359.493 2.860 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C(=O)OC(C)(C)C)CC3)cc2)CC1 ZINC000775678717 1003633678 /nfs/dbraw/zinc/63/36/78/1003633678.db2.gz IWBJEJZMSPPKNG-UHFFFAOYSA-N 2 0 373.541 2.992 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCO)[C@@H]3CCc4ccccc43)cc2)CC1 ZINC000775697266 1003705233 /nfs/dbraw/zinc/70/52/33/1003705233.db2.gz XZNFZRSMOZDOGO-HSZRJFAPSA-N 2 0 365.521 2.920 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721251 1003791798 /nfs/dbraw/zinc/79/17/98/1003791798.db2.gz UUFJOPPBRSYGRN-OAQYLSRUSA-N 3 0 356.558 2.746 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c(O)cc1Br ZINC001205579502 1004052752 /nfs/dbraw/zinc/05/27/52/1004052752.db2.gz NPDUOPXQFCKVLR-HNNXBMFYSA-N 2 0 361.255 2.816 20 10 FFCDRP C[C@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000775833493 1004546197 /nfs/dbraw/zinc/54/61/97/1004546197.db2.gz JZUXNHTUYWMBGU-LAUBAEHRSA-N 2 0 368.525 2.822 20 10 FFCDRP Cc1noc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000775655144 1004955704 /nfs/dbraw/zinc/95/57/04/1004955704.db2.gz WAIPEVUZCMBQMO-UHFFFAOYSA-N 2 0 355.486 2.509 20 10 FFCDRP COc1cccc(OC)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850356049 1005810670 /nfs/dbraw/zinc/81/06/70/1005810670.db2.gz QHSUVGDCSCTEOD-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP COCCOc1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283337 1006730503 /nfs/dbraw/zinc/73/05/03/1006730503.db2.gz BIPNHXOPOBUMNG-UHFFFAOYSA-N 2 0 369.509 2.753 20 10 FFCDRP Cc1n[nH]c(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1C ZINC000886054628 1008527505 /nfs/dbraw/zinc/52/75/05/1008527505.db2.gz IXWLDAXKZIXZDT-UHFFFAOYSA-N 2 0 353.514 2.848 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)OCC[NH2+]C4)cc2)CC1 ZINC000863486052 1010222208 /nfs/dbraw/zinc/22/22/08/1010222208.db2.gz CQTOQHPHVVUGCL-UHFFFAOYSA-N 2 0 352.482 2.533 20 10 FFCDRP C[C@@H](Cn1cccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000123234601 1012496583 /nfs/dbraw/zinc/49/65/83/1012496583.db2.gz MZGBABDKPZDAAQ-SFHVURJKSA-N 2 0 353.514 2.593 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3Cc4cc(F)c(F)cc4C3)cc2)CC1 ZINC001173470873 1012636718 /nfs/dbraw/zinc/63/67/18/1012636718.db2.gz BCKJUWMOFGZLCF-UHFFFAOYSA-N 2 0 357.448 2.974 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCCC[C@]3(CCCC[NH2+]C3)C1)C[NH2+]CCO2 ZINC001222173939 1032801949 /nfs/dbraw/zinc/80/19/49/1032801949.db2.gz ZUVLMZYZMVSAGN-NRFANRHFSA-N 3 0 359.514 2.620 20 10 FFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000902519229 1020250428 /nfs/dbraw/zinc/25/04/28/1020250428.db2.gz YCOWUSIDGJQZJM-QVKFZJNVSA-N 2 0 355.530 2.868 20 10 FFCDRP CCCn1cc([C@H](C)NCc2ccc(N3CC[NH+](CC)CC3)c(F)c2)nn1 ZINC000902795353 1020482268 /nfs/dbraw/zinc/48/22/68/1020482268.db2.gz DOVGYEHZCYARSV-INIZCTEOSA-N 2 0 374.508 2.820 20 10 FFCDRP C[NH+](C)CCOc1ccccc1N1CC[NH+](Cc2ccccc2O)CC1 ZINC000779019012 1022656610 /nfs/dbraw/zinc/65/66/10/1022656610.db2.gz ODRMARKYFPBEDK-UHFFFAOYSA-N 2 0 355.482 2.655 20 10 FFCDRP C[C@@H]([NH3+])c1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC001122413800 1023252101 /nfs/dbraw/zinc/25/21/01/1023252101.db2.gz BAKFVDZRXZIITH-FOIQADDNSA-N 2 0 354.498 2.805 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C[S@@](C)=O)c3ccccc3)cc2)CC1 ZINC000780895454 1028855036 /nfs/dbraw/zinc/85/50/36/1028855036.db2.gz UOUJFVOWETWNRF-HFZDXXHNSA-N 2 0 371.550 2.648 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3cc(Cl)nc4c3CC[NH2+]C4)cc2)CC1 ZINC001156657517 1029293808 /nfs/dbraw/zinc/29/38/08/1029293808.db2.gz MTNKPFOUJIHOTK-UHFFFAOYSA-N 2 0 371.916 2.745 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](n3cc(C[NH3+])nn3)C2)cc1F ZINC000841099721 1030034703 /nfs/dbraw/zinc/03/47/03/1030034703.db2.gz NZUDNHFZWABVQP-KRWDZBQOSA-N 2 0 360.481 2.559 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CCO)c3ccccc3F)cc2)CC1 ZINC000842762370 1030946275 /nfs/dbraw/zinc/94/62/75/1030946275.db2.gz DXROVDVDAPBTHE-OAQYLSRUSA-N 2 0 357.473 2.791 20 10 FFCDRP CCN(CC)c1ccc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)cc1 ZINC001203945459 1030999548 /nfs/dbraw/zinc/99/95/48/1030999548.db2.gz MJVHKMYWMGOZRC-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP Cc1ccc(C[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)c(O)c1 ZINC001204755976 1031428645 /nfs/dbraw/zinc/42/86/45/1031428645.db2.gz HBCIDRBRUZBVHH-UHFFFAOYSA-N 2 0 353.510 2.950 20 10 FFCDRP COc1ccc(Br)c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1O ZINC001205627466 1031885431 /nfs/dbraw/zinc/88/54/31/1031885431.db2.gz PQZLSFPWICTYQZ-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP [NH3+]C[C@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC1(F)F ZINC001205769779 1031983481 /nfs/dbraw/zinc/98/34/81/1031983481.db2.gz KOFZAPUQRVKJHF-HNNXBMFYSA-N 2 0 351.441 2.507 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[C@H]([NH+]4CCCCC4)[C@@H](F)C3)cc2)CC1 ZINC001139411593 1035094846 /nfs/dbraw/zinc/09/48/46/1035094846.db2.gz USQLNYUWUKVGBR-VXKWHMMOSA-N 2 0 374.548 2.837 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cc(CO)ccc4C3)cc2)CC1 ZINC001140302056 1035424904 /nfs/dbraw/zinc/42/49/04/1035424904.db2.gz IZWBXUGCSZPIHG-UHFFFAOYSA-N 2 0 365.521 2.879 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@@H]([NH+]4CCCCC4)C3)cc2)CC1 ZINC001140304095 1035426043 /nfs/dbraw/zinc/42/60/43/1035426043.db2.gz HXKPKZBDCXGWLV-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4nnc(C)o4)C3)cc2)CC1 ZINC001140306001 1035427512 /nfs/dbraw/zinc/42/75/12/1035427512.db2.gz KADQWQWBFLXHHT-IBGZPJMESA-N 2 0 369.513 2.900 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)cc1 ZINC000835038346 1035491697 /nfs/dbraw/zinc/49/16/97/1035491697.db2.gz WGBNVOQZFPMKOM-PLNGDYQASA-N 2 0 356.558 2.914 20 10 FFCDRP CCN(CC)c1ccc(C[NH+]2CCN(CC[NH+](CC)CC)CC2)c(O)c1 ZINC001140852049 1036282254 /nfs/dbraw/zinc/28/22/54/1036282254.db2.gz ZHXYTKBZSZMLPD-UHFFFAOYSA-N 2 0 362.562 2.698 20 10 FFCDRP CCOC(=O)c1c(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c2ccccc2n1C ZINC001233271147 1036478707 /nfs/dbraw/zinc/47/87/07/1036478707.db2.gz OLSDRKBSPHUDMI-CVEARBPZSA-N 2 0 355.482 2.739 20 10 FFCDRP CC[N@H+](C)CCC(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1 ZINC001229523206 1036720866 /nfs/dbraw/zinc/72/08/66/1036720866.db2.gz DJGOHUFFGIGZEH-RTBURBONSA-N 2 0 361.530 2.862 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCCC34CC[NH2+]CC4)cc2)CC1 ZINC001235190170 1037402405 /nfs/dbraw/zinc/40/24/05/1037402405.db2.gz VDKZJJLAGLJNLP-UHFFFAOYSA-N 3 0 356.558 2.937 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714023 1037704389 /nfs/dbraw/zinc/70/43/89/1037704389.db2.gz FPLYMTBLKSNNOU-KRWDZBQOSA-N 2 0 367.493 2.581 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+][C@@H](c4ccccc4)C3)c(F)c2)CC1 ZINC001235857494 1037798278 /nfs/dbraw/zinc/79/82/78/1037798278.db2.gz USUDJHCENKJREO-JOCHJYFZSA-N 2 0 368.500 2.724 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN([C@H]3CC[NH2+]C3)C3CCCCC3)cc2)CC1 ZINC001236654175 1038176081 /nfs/dbraw/zinc/17/60/81/1038176081.db2.gz TXWJWYRXPJVLHR-QFIPXVFZSA-N 2 0 356.558 2.935 20 10 FFCDRP CCN(CC[NH+]1CCCCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236942841 1038370256 /nfs/dbraw/zinc/37/02/56/1038370256.db2.gz NNWSUDGVJUNUFF-UHFFFAOYSA-N 2 0 362.537 2.885 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@@H]4CC[C@H](C)[NH2+]C4)C3)C2)cc1 ZINC001246707578 1039443187 /nfs/dbraw/zinc/44/31/87/1039443187.db2.gz ZAKCDAUNDLTJBL-DWLFOUALSA-N 2 0 373.541 2.755 20 10 FFCDRP COc1cccc(C[N@@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001278562237 1041179648 /nfs/dbraw/zinc/17/96/48/1041179648.db2.gz AUIRPUMECDPIIV-OAQYLSRUSA-N 2 0 361.530 2.640 20 10 FFCDRP CN1CCN(c2ccc(C[N@H+](CCC[NH3+])Cc3ccccc3)cc2F)CC1 ZINC001261483278 1041262692 /nfs/dbraw/zinc/26/26/92/1041262692.db2.gz ORSXASVCOZBOMQ-UHFFFAOYSA-N 2 0 370.516 2.929 20 10 FFCDRP Cc1cccc(C[N@@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c1O ZINC001279290439 1042985989 /nfs/dbraw/zinc/98/59/89/1042985989.db2.gz OPMHYLOZLAVPTD-NRFANRHFSA-N 2 0 354.498 2.885 20 10 FFCDRP COc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(Br)c1 ZINC001279674346 1043445088 /nfs/dbraw/zinc/44/50/88/1043445088.db2.gz IHEKTLXJIFRYAX-BETUJISGSA-N 2 0 369.303 2.937 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CCC[N@H+](Cc1c(O)ccc(F)c1Cl)C2 ZINC001279683606 1043462047 /nfs/dbraw/zinc/46/20/47/1043462047.db2.gz GIWXHDSGLMDUPH-UHFFFAOYSA-N 2 0 355.885 2.644 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCCO4)CC3)cc2F)CC1 ZINC001320576223 1045430780 /nfs/dbraw/zinc/43/07/80/1045430780.db2.gz SCVQHIGPNCHOKF-NRFANRHFSA-N 2 0 361.505 2.969 20 10 FFCDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CCN(C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919361 1048095399 /nfs/dbraw/zinc/09/53/99/1048095399.db2.gz ZPIXTBBLVVSNJG-QGZVFWFLSA-N 3 0 360.521 2.542 20 10 FFCDRP C[NH+]1CCN(c2cc[nH+]c(NCc3cc(Cl)cc(F)c3O)c2)CC1 ZINC001461682176 1061376871 /nfs/dbraw/zinc/37/68/71/1061376871.db2.gz HGFSNYDYUDMNCZ-UHFFFAOYSA-N 2 0 350.825 2.944 20 10 FFCDRP CC[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC001474275743 1065483547 /nfs/dbraw/zinc/48/35/47/1065483547.db2.gz WHAXQINNLMTSMV-SFHVURJKSA-N 2 0 361.530 2.896 20 10 FFCDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000113334492 508261851 /nfs/dbraw/zinc/26/18/51/508261851.db2.gz JTLJPBVMYZNCLE-UHFFFAOYSA-N 2 0 361.873 2.627 20 10 FFCDRP COCCC[NH+]1CCC([NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000159129747 508796539 /nfs/dbraw/zinc/79/65/39/508796539.db2.gz BDJXPXHLZIEOOQ-UHFFFAOYSA-N 2 0 361.530 2.755 20 10 FFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000186601916 509796842 /nfs/dbraw/zinc/79/68/42/509796842.db2.gz NOWRIQVTCKONRS-KGLIPLIRSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c1O ZINC000187167729 510098380 /nfs/dbraw/zinc/09/83/80/510098380.db2.gz TVWAQDQTBLIKJS-ZIAGYGMSSA-N 2 0 370.335 2.750 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH+](C)C2CC2)C1 ZINC000444020582 514102653 /nfs/dbraw/zinc/10/26/53/514102653.db2.gz FOVQYHYDOAZYFL-UHFFFAOYSA-N 2 0 368.525 2.618 20 10 FFCDRP C[NH2+][C@@H](C)Cc1noc(Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)n1 ZINC000572521771 518231421 /nfs/dbraw/zinc/23/14/21/518231421.db2.gz SHNSRDUKQPVGEJ-HNNXBMFYSA-N 2 0 367.497 2.990 20 10 FFCDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(OC)ccc2O)CC1 ZINC000180547861 729218142 /nfs/dbraw/zinc/21/81/42/729218142.db2.gz RKGUQVNXSJGUAC-UHFFFAOYSA-N 2 0 350.503 2.971 20 10 FFCDRP Cc1cc(Br)cc(C[NH+]2CCC3(CO[C@@H](C[NH3+])C3)CC2)c1O ZINC000904392260 736248304 /nfs/dbraw/zinc/24/83/04/736248304.db2.gz OGXRQHDCBFKMRG-OAHLLOKOSA-N 2 0 369.303 2.793 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)c2c1c(F)ccc2O ZINC000817973241 742225206 /nfs/dbraw/zinc/22/52/06/742225206.db2.gz RJPVQNNHHNXBOW-SCDSUCTJSA-N 2 0 361.383 2.505 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000839183563 746797054 /nfs/dbraw/zinc/79/70/54/746797054.db2.gz YPEMIBHFMWEGEX-GFCCVEGCSA-N 2 0 357.292 2.985 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902496 748132333 /nfs/dbraw/zinc/13/23/33/748132333.db2.gz OABNKSZPCOYCAH-RCBQFDQVSA-N 2 0 354.878 2.773 20 10 FFCDRP Cc1nc2ccccc2nc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895605889 970792947 /nfs/dbraw/zinc/79/29/47/970792947.db2.gz BNMYFYRGTCCVDZ-UHFFFAOYSA-N 2 0 361.493 2.980 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCC[NH+](C)C2)C1 ZINC000683479818 960768296 /nfs/dbraw/zinc/76/82/96/960768296.db2.gz LUUKJYKJZLTWAM-QGZVFWFLSA-N 2 0 368.525 2.618 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)c2ccc(C[NH+](C)C)cc2)[NH+](C)C)cc1 ZINC000891254235 962612991 /nfs/dbraw/zinc/61/29/91/962612991.db2.gz XRFSHHLXJRBMER-NRFANRHFSA-N 2 0 368.525 2.847 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3cc(O[C@@H]4CCOC4)cc[nH+]3)cc2)CC1 ZINC001167436893 963263811 /nfs/dbraw/zinc/26/38/11/963263811.db2.gz FHROAKCAWMLAEE-HXUWFJFHSA-N 2 0 368.481 2.613 20 10 FFCDRP c1cnn(C2CC([NH2+]Cc3ccc(N4CC[NH+](CC5CC5)CC4)cc3)C2)c1 ZINC000877121552 1014480992 /nfs/dbraw/zinc/48/09/92/1014480992.db2.gz SODBMOXCMGWNNA-UHFFFAOYSA-N 2 0 365.525 2.908 20 10 FFCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(N3CCC(O)CC3)cc1)CC2 ZINC000877684072 1014675807 /nfs/dbraw/zinc/67/58/07/1014675807.db2.gz PBBHVFCQGKGJAF-UHFFFAOYSA-N 2 0 357.542 2.956 20 10 FFCDRP CCO[C@]12CCC[C@@]1([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CCO2 ZINC000897974314 982560004 /nfs/dbraw/zinc/56/00/04/982560004.db2.gz GBCYPIPVYLCQNL-RTWAWAEBSA-N 2 0 359.514 2.604 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(Br)c1 ZINC001206024980 1032111849 /nfs/dbraw/zinc/11/18/49/1032111849.db2.gz LWBYVGJYWDBUOY-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879650587 1015626061 /nfs/dbraw/zinc/62/60/61/1015626061.db2.gz IKETWWAAGJMAIB-LNLFQRSKSA-N 2 0 367.493 2.822 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1O ZINC000846141881 1000217502 /nfs/dbraw/zinc/21/75/02/1000217502.db2.gz BGTDEOPYFQHPSK-KRWDZBQOSA-N 2 0 369.509 2.999 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775725294 1003835293 /nfs/dbraw/zinc/83/52/93/1003835293.db2.gz RTYIMFQZBCKQCW-SFHVURJKSA-N 2 0 359.514 2.602 20 10 FFCDRP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+](C)Cc1ccccc1O ZINC000111235259 1006362425 /nfs/dbraw/zinc/36/24/25/1006362425.db2.gz WFDKFFHSEQJUSC-YLJYHZDGSA-N 2 0 367.493 2.603 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-n4ccnc4)cc3)cc2)CC1 ZINC000883284823 1006732244 /nfs/dbraw/zinc/73/22/44/1006732244.db2.gz YCEDWXYWLSPFIO-UHFFFAOYSA-N 3 0 361.493 2.914 20 10 FFCDRP COc1cccc([C@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)OC)c1 ZINC000858204675 1008324343 /nfs/dbraw/zinc/32/43/43/1008324343.db2.gz QULHMTPWSFEPOO-QFIPXVFZSA-N 2 0 369.509 2.924 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167517 1032797642 /nfs/dbraw/zinc/79/76/42/1032797642.db2.gz NALGAQXTMSMXER-QFIPXVFZSA-N 3 0 372.557 2.548 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC4(CCCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001222298339 1032875526 /nfs/dbraw/zinc/87/55/26/1032875526.db2.gz SRCNNSOYLRONRB-UHFFFAOYSA-N 2 0 360.521 2.686 20 10 FFCDRP COC1(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCOCC1 ZINC000758426967 1024106754 /nfs/dbraw/zinc/10/67/54/1024106754.db2.gz SLNGEERLBWFRSS-UHFFFAOYSA-N 2 0 373.541 2.504 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCOC(F)(F)C(F)(F)F)cc2)CC1 ZINC001203565822 1030766730 /nfs/dbraw/zinc/76/67/30/1030766730.db2.gz JSJHFNWAHLVXEE-UHFFFAOYSA-N 2 0 367.362 2.700 20 10 FFCDRP Oc1ccc(Cl)cc1C[N@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001203656833 1030808115 /nfs/dbraw/zinc/80/81/15/1030808115.db2.gz ZDJZKEQBGKOTOF-UHFFFAOYSA-N 2 0 360.889 2.896 20 10 FFCDRP CC[N@H+](C)[C@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281723 1034698977 /nfs/dbraw/zinc/69/89/77/1034698977.db2.gz VWJSDHRARUKKQD-UXHICEINSA-N 2 0 354.498 2.562 20 10 FFCDRP COc1cc(C[N@H+](C)Cc2ccc3c(c2)OCCO3)cc(C[NH+](C)C)c1O ZINC001139253349 1035029963 /nfs/dbraw/zinc/02/99/63/1035029963.db2.gz RSVGQEZPVMPTKU-UHFFFAOYSA-N 2 0 372.465 2.866 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(Oc4cccnc4)CC3)cc2)CC1 ZINC001139409649 1035094333 /nfs/dbraw/zinc/09/43/33/1035094333.db2.gz ONJJFKVCTVFRFC-UHFFFAOYSA-N 2 0 366.509 2.877 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC([NH+]4CCC(F)CC4)CC3)cc2)CC1 ZINC001139412836 1035097001 /nfs/dbraw/zinc/09/70/01/1035097001.db2.gz PSAYUDLWKRUGDZ-UHFFFAOYSA-N 2 0 374.548 2.837 20 10 FFCDRP COC(=O)[C@@H]1CCC[N@@H+](C2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673250 1035194321 /nfs/dbraw/zinc/19/43/21/1035194321.db2.gz FJPAYOKCRZTHMT-LJQANCHMSA-N 2 0 373.541 2.910 20 10 FFCDRP Oc1ccc(F)cc1C[N@H+]1CCc2ncc(C[NH+]3CCCCC3)n2CC1 ZINC001140054693 1035323260 /nfs/dbraw/zinc/32/32/60/1035323260.db2.gz WTBKEOCSVMAYRT-UHFFFAOYSA-N 2 0 358.461 2.772 20 10 FFCDRP Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1C ZINC000835075580 1035512449 /nfs/dbraw/zinc/51/24/49/1035512449.db2.gz YSDCIVDRZDUVQO-QFIPXVFZSA-N 2 0 367.537 2.748 20 10 FFCDRP CC[NH+](CC)CCN1CC[NH+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233451232 1036632088 /nfs/dbraw/zinc/63/20/88/1036632088.db2.gz CJGMUGDFXPKKBV-UHFFFAOYSA-N 2 0 359.436 2.870 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cc2)CC1 ZINC001235043767 1037324704 /nfs/dbraw/zinc/32/47/04/1037324704.db2.gz HDTWUVOOADUCQG-JOCHJYFZSA-N 3 0 356.558 2.937 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCCC[C@@]34CCC[NH2+]C4)cc2)CC1 ZINC001235167287 1037392031 /nfs/dbraw/zinc/39/20/31/1037392031.db2.gz HGEDOOXDQBHWFD-QFIPXVFZSA-N 2 0 356.558 2.937 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCC[N@H+](CC4CC[NH2+]CC4)C3)C2)cc1 ZINC001207435381 1037437160 /nfs/dbraw/zinc/43/71/60/1037437160.db2.gz MXWMAONNDUNJCI-JOCHJYFZSA-N 2 0 373.541 2.614 20 10 FFCDRP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@H+](Cc1ccc(C)cc1O)C2 ZINC001235322482 1037475928 /nfs/dbraw/zinc/47/59/28/1037475928.db2.gz YFKUULLOAFFBAQ-SIKLNZKXSA-N 2 0 372.509 2.846 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3c(O)ccc(F)c3Cl)C[C@@H]1CC[NH2+]CC2 ZINC001235352241 1037497273 /nfs/dbraw/zinc/49/72/73/1037497273.db2.gz NHVYGMVZJBXMCR-SGTLLEGYSA-N 2 0 370.852 2.549 20 10 FFCDRP Cc1ccccc1O[C@@H]1CC[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001235674552 1037677237 /nfs/dbraw/zinc/67/72/37/1037677237.db2.gz KADJVWZNMPTZSP-GOSISDBHSA-N 2 0 354.450 2.836 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H](Oc3ccccc3)C1)C[NH2+]CCO2 ZINC001235693213 1037687333 /nfs/dbraw/zinc/68/73/33/1037687333.db2.gz WCKMYSYLJFDBAM-LJQANCHMSA-N 2 0 354.450 2.918 20 10 FFCDRP CC(C)OCC[NH+](CCOC(C)C)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235694308 1037690750 /nfs/dbraw/zinc/69/07/50/1037690750.db2.gz BSXFMCSPDKICJY-UHFFFAOYSA-N 2 0 363.546 2.748 20 10 FFCDRP CCOC(=O)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001255339255 1041275106 /nfs/dbraw/zinc/27/51/06/1041275106.db2.gz RSVKQXCXHZEDDW-RTBURBONSA-N 2 0 359.514 2.650 20 10 FFCDRP CCc1cccc(C[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1O ZINC000848900431 1055332506 /nfs/dbraw/zinc/33/25/06/1055332506.db2.gz LKOCKGNINFXPCY-UHFFFAOYSA-N 2 0 355.482 2.536 20 10 FFCDRP [NH2+]=C(NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)Nc1ccccn1 ZINC000849052421 1055600129 /nfs/dbraw/zinc/60/01/29/1055600129.db2.gz GBVBWHDRWGBTNQ-UHFFFAOYSA-N 2 0 364.497 2.750 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cc2)CC1 ZINC000849350574 1056835285 /nfs/dbraw/zinc/83/52/85/1056835285.db2.gz QUEKZBDACKIILZ-OAQYLSRUSA-N 3 0 356.558 2.650 20 10 FFCDRP C[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001472281308 1064998546 /nfs/dbraw/zinc/99/85/46/1064998546.db2.gz VBFIUUQCQZBJNV-AXVVYFOYSA-N 2 0 360.546 2.733 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCCN2CC[NH+](C)CC2)c1O ZINC000186948851 509968127 /nfs/dbraw/zinc/96/81/27/509968127.db2.gz ZGVAIYHKAJUVKZ-AWEZNQCLSA-N 2 0 370.335 2.751 20 10 FFCDRP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)C[NH+](C)C)C1 ZINC000584521097 518380295 /nfs/dbraw/zinc/38/02/95/518380295.db2.gz FGEDJAAIFWRDQL-KRWDZBQOSA-N 2 0 370.541 2.722 20 10 FFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@@]2(CC[NH2+]C2)CO1 ZINC000903732237 736161394 /nfs/dbraw/zinc/16/13/94/736161394.db2.gz DLZILQSMORGGCX-NVXWUHKLSA-N 2 0 369.303 2.745 20 10 FFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H](C(N)=O)C2)c1O ZINC000808693099 741252956 /nfs/dbraw/zinc/25/29/56/741252956.db2.gz WAPVYKFEGHJBID-ZIAGYGMSSA-N 2 0 353.894 2.592 20 10 FFCDRP Cc1cc(O)c(C[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C)cc1Cl ZINC000825396416 743263381 /nfs/dbraw/zinc/26/33/81/743263381.db2.gz TVPCGGNSJRKTJR-INIZCTEOSA-N 2 0 355.910 2.536 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125309 747777424 /nfs/dbraw/zinc/77/74/24/747777424.db2.gz RUHHKOOHCFBBLU-STQMWFEESA-N 2 0 369.303 2.985 20 10 FFCDRP COc1cc(C[NH2+]CCCC[NH+]2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000850031099 749288571 /nfs/dbraw/zinc/28/85/71/749288571.db2.gz AAGDVJOZDWXBJM-UHFFFAOYSA-N 2 0 350.503 2.900 20 10 FFCDRP C[C@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(N(C)C)cc1 ZINC000873247395 1013447031 /nfs/dbraw/zinc/44/70/31/1013447031.db2.gz MAPJJYAYRLAYIO-HNNXBMFYSA-N 2 0 350.470 2.643 20 10 FFCDRP OC1CCN(c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000876771003 1014386253 /nfs/dbraw/zinc/38/62/53/1014386253.db2.gz SISHHXBECUKUTH-FQEVSTJZSA-N 2 0 357.542 2.956 20 10 FFCDRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000877144861 1014489371 /nfs/dbraw/zinc/48/93/71/1014489371.db2.gz XZENLQJPDLZLBN-UHFFFAOYSA-N 2 0 353.510 2.999 20 10 FFCDRP COc1cc(O)c(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1OC ZINC000904472387 980282598 /nfs/dbraw/zinc/28/25/98/980282598.db2.gz FTEZBKODIKPMSO-IIBYNOLFSA-N 2 0 370.449 2.755 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)Nc2cccc(C[NH3+])c2)[NH+](C)C)cc1 ZINC000904504277 980288328 /nfs/dbraw/zinc/28/83/28/980288328.db2.gz OTKJXTQUZWUBNV-LJQANCHMSA-N 2 0 355.486 2.636 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)C(C)(C)[C@H]([NH3+])c2ccccc2)cc1 ZINC000841846539 981952760 /nfs/dbraw/zinc/95/27/60/981952760.db2.gz PLECOQQOOIJKEV-RTBURBONSA-N 2 0 354.498 2.595 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000922391156 988547866 /nfs/dbraw/zinc/54/78/66/988547866.db2.gz UCYGIXDYAVJXDK-QPSOZROKSA-N 2 0 357.542 2.835 20 10 FFCDRP C[C@@H]([NH2+][C@H](C)c1ccccc1O)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000879648283 1015623580 /nfs/dbraw/zinc/62/35/80/1015623580.db2.gz IKETWWAAGJMAIB-LMMKCTJWSA-N 2 0 367.493 2.822 20 10 FFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)CC1 ZINC000809755207 994604777 /nfs/dbraw/zinc/60/47/77/994604777.db2.gz ICKUMBBQWLNZDD-OAQYLSRUSA-N 3 0 356.558 2.602 20 10 FFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903878510 1016283159 /nfs/dbraw/zinc/28/31/59/1016283159.db2.gz WJLFPTFGPOQEPD-LJQANCHMSA-N 2 0 357.546 2.824 20 10 FFCDRP CC(C)[N@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1ccc(N(C)C)cc1 ZINC000734058176 999186915 /nfs/dbraw/zinc/18/69/15/999186915.db2.gz IWALQDWLLVGRRK-UHFFFAOYSA-N 2 0 374.573 2.952 20 10 FFCDRP CC(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768530145 1000285307 /nfs/dbraw/zinc/28/53/07/1000285307.db2.gz ZGIYUOASMPLVEI-HXUWFJFHSA-N 2 0 373.541 2.992 20 10 FFCDRP CCOC(=O)C1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000792196731 1002941100 /nfs/dbraw/zinc/94/11/00/1002941100.db2.gz LSWXTHZJZWWXGK-UHFFFAOYSA-N 2 0 359.514 2.652 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2ccc3c(c2)[C@@H](C[NH3+])CCC3)cc1 ZINC000852790761 1006184874 /nfs/dbraw/zinc/18/48/74/1006184874.db2.gz BBEAKZYTWSYKNE-WIYYLYMNSA-N 2 0 366.509 2.561 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)cc2)CC1 ZINC000883283852 1006730074 /nfs/dbraw/zinc/73/00/74/1006730074.db2.gz VOGBWDIMWXNMEM-UHFFFAOYSA-N 2 0 361.493 2.914 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(C(C)(C)O)cc3)cc2)CC1 ZINC000775331648 1007343176 /nfs/dbraw/zinc/34/31/76/1007343176.db2.gz ZYQOKULHMFUYOZ-UHFFFAOYSA-N 2 0 353.510 2.956 20 10 FFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc(OC)c(C)cc3O)CC2)CC1 ZINC000817373357 1007567390 /nfs/dbraw/zinc/56/73/90/1007567390.db2.gz OVTIFUOTPJGMMU-UHFFFAOYSA-N 2 0 361.530 2.701 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)Cc3ccccc3)cc2F)CC1 ZINC000819033877 1008028037 /nfs/dbraw/zinc/02/80/37/1008028037.db2.gz TUJNWWFFDQNOFX-HXUWFJFHSA-N 2 0 371.500 2.661 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)CC2)cc1 ZINC000858090919 1008300185 /nfs/dbraw/zinc/30/01/85/1008300185.db2.gz VPQAAGLGJVPZEJ-IBGZPJMESA-N 2 0 374.573 2.670 20 10 FFCDRP COC(=O)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001172768132 1012004546 /nfs/dbraw/zinc/00/45/46/1012004546.db2.gz OTCRSTPTCNECJL-RTBURBONSA-N 2 0 359.514 2.650 20 10 FFCDRP FC(F)Oc1ccc(N2CCC([NH2+][C@H]3[C@@H]4[NH2+]C[C@H]5C[C@H]3C[C@H]45)CC2)cc1 ZINC000925577443 1017792914 /nfs/dbraw/zinc/79/29/14/1017792914.db2.gz OQQOKVHIWUUKQV-ZGXYDKCCSA-N 2 0 363.452 2.843 20 10 FFCDRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000756643477 1023739700 /nfs/dbraw/zinc/73/97/00/1023739700.db2.gz UYASSVJRTQZFSO-AWEZNQCLSA-N 2 0 365.493 2.809 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)c1 ZINC000756855107 1023760631 /nfs/dbraw/zinc/76/06/31/1023760631.db2.gz CMQWFAXXNXFTNT-PXNSSMCTSA-N 2 0 369.509 2.640 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)c(F)c2)CC1 ZINC001204742711 1031423286 /nfs/dbraw/zinc/42/32/86/1031423286.db2.gz REMMUPDGJGHGQB-UHFFFAOYSA-N 3 0 360.521 2.543 20 10 FFCDRP Cc1cccc(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)c1 ZINC001204863615 1031455620 /nfs/dbraw/zinc/45/56/20/1031455620.db2.gz MOPLBKAYYFQCPU-UHFFFAOYSA-N 2 0 353.466 2.505 20 10 FFCDRP CCOC(=O)[C@H]1CCCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259621 1035031157 /nfs/dbraw/zinc/03/11/57/1035031157.db2.gz YXZVNSKIEYQOFG-INIZCTEOSA-N 2 0 364.486 2.628 20 10 FFCDRP CCc1nnc(C2CC[NH+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)CC2)o1 ZINC001139258773 1035032054 /nfs/dbraw/zinc/03/20/54/1035032054.db2.gz VUTLXEROTQORKG-UHFFFAOYSA-N 2 0 374.485 2.787 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(Oc4ccccn4)CC3)cc2)CC1 ZINC001139409979 1035093808 /nfs/dbraw/zinc/09/38/08/1035093808.db2.gz YXBGUBHDGMHEAE-UHFFFAOYSA-N 2 0 366.509 2.877 20 10 FFCDRP CCOC(=O)C1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140302705 1035425703 /nfs/dbraw/zinc/42/57/03/1035425703.db2.gz YISWFEVOFGZBKQ-UHFFFAOYSA-N 2 0 359.514 2.604 20 10 FFCDRP CCNC(=O)OC1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140305578 1035427690 /nfs/dbraw/zinc/42/76/90/1035427690.db2.gz CSZLDQSRHQAGJB-UHFFFAOYSA-N 2 0 374.529 2.539 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@@H](F)CO4)CC3)cc2)CC1 ZINC001140306570 1035428021 /nfs/dbraw/zinc/42/80/21/1035428021.db2.gz UAYCGGCJNCUVJW-LJQANCHMSA-N 2 0 361.505 2.922 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001232839461 1036095131 /nfs/dbraw/zinc/09/51/31/1036095131.db2.gz QWHIWFHWNYJJRJ-DENIHFKCSA-N 2 0 373.541 2.639 20 10 FFCDRP CCOC(=O)c1c(C[NH+]2CC3(C2)CC[NH+](C)CC3)c2ccccc2n1C ZINC001233272869 1036480357 /nfs/dbraw/zinc/48/03/57/1036480357.db2.gz FNSOFIHEVMWQGN-UHFFFAOYSA-N 2 0 355.482 2.883 20 10 FFCDRP C[NH+]1CCN(c2ccccc2C[N@@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001140975886 1036608295 /nfs/dbraw/zinc/60/82/95/1036608295.db2.gz YZELUNNWYCZCHZ-UHFFFAOYSA-N 2 0 367.493 2.798 20 10 FFCDRP CCOC(=O)c1c(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c2ccccc2n1C ZINC001235092233 1037360584 /nfs/dbraw/zinc/36/05/84/1037360584.db2.gz IVXIIDMZISHYLL-UHFFFAOYSA-N 2 0 355.482 2.931 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc(Cl)c(C)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235353239 1037499976 /nfs/dbraw/zinc/49/99/76/1037499976.db2.gz XNAFXBGTCCADDC-KXBFYZLASA-N 2 0 366.889 2.719 20 10 FFCDRP COC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cc(C)cc3O)CC2)C1 ZINC001231850696 1037946820 /nfs/dbraw/zinc/94/68/20/1037946820.db2.gz UCDHNBZNWQAYAI-QGZVFWFLSA-N 2 0 360.498 2.858 20 10 FFCDRP Oc1cc2c(cc1C[N@H+](Cc1ccccc1)C1CC[NH2+]CC1)C[NH2+]CCO2 ZINC001236300417 1038029857 /nfs/dbraw/zinc/02/98/57/1038029857.db2.gz AVZMILAVAXYPAI-UHFFFAOYSA-N 3 0 367.493 2.628 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)CC[NH2+]C4)CC2)c(C)c1 ZINC001236368773 1038061395 /nfs/dbraw/zinc/06/13/95/1038061395.db2.gz VNZLAKAIZIIDMV-UHFFFAOYSA-N 2 0 351.494 2.972 20 10 FFCDRP C[NH+]1CCN(c2cccc(C[N@@H+]3CCCc4cc(O)c(O)cc4C3)c2)CC1 ZINC001236894648 1038340941 /nfs/dbraw/zinc/34/09/41/1038340941.db2.gz RXZMIAFNGSTFQP-UHFFFAOYSA-N 2 0 367.493 2.798 20 10 FFCDRP Cc1cc(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c(O)cc1Br ZINC001236932895 1038364678 /nfs/dbraw/zinc/36/46/78/1038364678.db2.gz OQRSFUANRKVTPS-HNNXBMFYSA-N 2 0 370.335 2.579 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccccc3)c(F)c2)CC1 ZINC001210227749 1039436936 /nfs/dbraw/zinc/43/69/36/1039436936.db2.gz QCHHHOUIQFCLOP-JOCHJYFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC2(CCC[N@H+](CCn3ccnc3)C2)CC1 ZINC001278551293 1041109703 /nfs/dbraw/zinc/10/97/03/1041109703.db2.gz GGDPUSMEGKRJRW-UHFFFAOYSA-N 2 0 354.498 2.967 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CCC[N@H+](Cc4cn[nH]c4)C3)CC2)cc1O ZINC001279142166 1042916039 /nfs/dbraw/zinc/91/60/39/1042916039.db2.gz PFQQCKQCQUGWJX-UHFFFAOYSA-N 2 0 356.470 2.699 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001279229862 1042956042 /nfs/dbraw/zinc/95/60/42/1042956042.db2.gz DORYMTKMFNHMSP-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP CN(C)c1ccc(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c(Cl)c1 ZINC001279333950 1043007907 /nfs/dbraw/zinc/00/79/07/1043007907.db2.gz UTVXPISDWJMOAZ-UHFFFAOYSA-N 2 0 364.965 2.865 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)c1O ZINC001279476335 1043159626 /nfs/dbraw/zinc/15/96/26/1043159626.db2.gz IWUCUNRSBINGTD-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP COC(=O)c1c(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c2ccccc2n1C ZINC001279595452 1043312057 /nfs/dbraw/zinc/31/20/57/1043312057.db2.gz LXYOHSYSPYLZNX-IYBDPMFKSA-N 2 0 355.482 2.739 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc(Cl)cc(C)c3O)CC[C@@H]2C1 ZINC001237686575 1043312638 /nfs/dbraw/zinc/31/26/38/1043312638.db2.gz RYTIMCKZRFZSFJ-CRAIPNDOSA-N 2 0 368.905 2.523 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCC3(CC[N@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001279667765 1043433298 /nfs/dbraw/zinc/43/32/98/1043433298.db2.gz PKNXQYKMHBYTSB-UHFFFAOYSA-N 2 0 361.530 2.559 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC001326037773 1046737246 /nfs/dbraw/zinc/73/72/46/1046737246.db2.gz YAPDTALBJNXZTH-NFAWXSAZSA-N 2 0 357.420 2.675 20 10 FFCDRP COCC[N@@H+](Cc1ccc(Br)cc1O)CC1CC[NH+](C)CC1 ZINC001308894181 1052513820 /nfs/dbraw/zinc/51/38/20/1052513820.db2.gz AXQZWGBSTRULAP-UHFFFAOYSA-N 2 0 371.319 2.945 20 10 FFCDRP CCC[NH2+][C@@H](C)C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551308 1078375807 /nfs/dbraw/zinc/37/58/07/1078375807.db2.gz OSIAMALYUUOUDH-BBRMVZONSA-N 2 0 353.894 2.514 20 10 FFCDRP CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722855 1076063257 /nfs/dbraw/zinc/06/32/57/1076063257.db2.gz DFEIEGXJVXGLSG-AZUAARDMSA-N 2 0 360.546 2.594 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(N4CCCC4)cc3)cn2)CC1 ZINC001560259024 1076257359 /nfs/dbraw/zinc/25/73/59/1076257359.db2.gz UWSFKDAGUVCUGO-UHFFFAOYSA-N 2 0 365.525 2.723 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(N(C)C)cc1 ZINC000090038697 507903615 /nfs/dbraw/zinc/90/36/15/507903615.db2.gz BUPCDZRFZBSVBD-QGZVFWFLSA-N 2 0 368.525 2.895 20 10 FFCDRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000181010647 510236972 /nfs/dbraw/zinc/23/69/72/510236972.db2.gz LFEABPOULAKDKW-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1O ZINC000725846020 734395955 /nfs/dbraw/zinc/39/59/55/734395955.db2.gz UMFJXVVGZYUDFZ-UONOGXRCSA-N 2 0 355.276 2.880 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC([C@@H]3OCCC[C@@H]3[NH3+])CC2)c1O ZINC000842479180 747613725 /nfs/dbraw/zinc/61/37/25/747613725.db2.gz PDYKHGKZRZXMHX-HKUYNNGSSA-N 2 0 366.889 2.967 20 10 FFCDRP C[NH2+]CCC1CC[NH+](Cc2cc(Br)cc(OC)c2O)CC1 ZINC000843057892 747757805 /nfs/dbraw/zinc/75/78/05/747757805.db2.gz WTYMFCVIIVQCCJ-UHFFFAOYSA-N 2 0 357.292 2.985 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)CCn3cccn3)cc2F)CC1 ZINC000157758232 984639237 /nfs/dbraw/zinc/63/92/37/984639237.db2.gz DPKSOWWOZKGXPT-QGZVFWFLSA-N 2 0 359.493 2.733 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515480 998627214 /nfs/dbraw/zinc/62/72/14/998627214.db2.gz PZLQAGGYENWKOX-IAGOWNOFSA-N 2 0 354.450 2.757 20 10 FFCDRP CCc1cccc(NC(=O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000771834208 1001210244 /nfs/dbraw/zinc/21/02/44/1001210244.db2.gz MVPVAPGMKPIHKK-UHFFFAOYSA-N 2 0 366.509 2.729 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](O)c1cccc(F)c1 ZINC000771842016 1001211276 /nfs/dbraw/zinc/21/12/76/1001211276.db2.gz HNVAFIWTGQUEAL-HRAATJIYSA-N 2 0 357.473 2.789 20 10 FFCDRP C[C@@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000775833492 1004545902 /nfs/dbraw/zinc/54/59/02/1004545902.db2.gz JZUXNHTUYWMBGU-DYESRHJHSA-N 2 0 368.525 2.822 20 10 FFCDRP C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677364 1005003674 /nfs/dbraw/zinc/00/36/74/1005003674.db2.gz ALYUPMOOZROXIG-AQNXPRMDSA-N 2 0 358.574 2.894 20 10 FFCDRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001201625549 1005245587 /nfs/dbraw/zinc/24/55/87/1005245587.db2.gz BNNVBCLYPYCLCH-OAQYLSRUSA-N 2 0 352.478 2.868 20 10 FFCDRP CC1CCC2(CC1)OC[C@H](C[NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)O2 ZINC001201728012 1005256941 /nfs/dbraw/zinc/25/69/41/1005256941.db2.gz WFXBZJJLANATGB-QUENFVSXSA-N 2 0 373.541 2.850 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)cc2)CC1 ZINC000883283687 1006730376 /nfs/dbraw/zinc/73/03/76/1006730376.db2.gz OTUZXOXTRNHOMF-UHFFFAOYSA-N 2 0 362.477 2.982 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000854231629 1006734337 /nfs/dbraw/zinc/73/43/37/1006734337.db2.gz NBENYDGZGOLZLN-CZUORRHYSA-N 2 0 363.477 2.660 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898484 1007802849 /nfs/dbraw/zinc/80/28/49/1007802849.db2.gz HGIGSYUHNAUKDV-DACLVMHWSA-N 2 0 369.456 2.599 20 10 FFCDRP CC[NH+]1CCC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000775420939 1007848312 /nfs/dbraw/zinc/84/83/12/1007848312.db2.gz HARMBUXSOREHRB-UHFFFAOYSA-N 2 0 356.558 2.793 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3Cc4c[nH]nc4CC(C)(C)C3)cc2)CC1 ZINC000828013789 1032579267 /nfs/dbraw/zinc/57/92/67/1032579267.db2.gz KOJUURSOEBGWCV-UHFFFAOYSA-N 2 0 353.514 2.746 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c(O)c1 ZINC000756644176 1023739358 /nfs/dbraw/zinc/73/93/58/1023739358.db2.gz ZBKNQDJTGZLOHB-MRXNPFEDSA-N 2 0 361.530 2.978 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cc(OC)cc[nH+]3)CC2)cc1 ZINC001156256785 1029114714 /nfs/dbraw/zinc/11/47/14/1029114714.db2.gz GUZQMVVLQMNABH-UHFFFAOYSA-N 2 0 356.470 2.723 20 10 FFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000840932897 1029931273 /nfs/dbraw/zinc/93/12/73/1029931273.db2.gz VOQPDBGTRQIZMF-UHFFFAOYSA-N 2 0 368.525 2.642 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)C[NH2+]CCO4)cc2)CC1 ZINC000841082432 1030025037 /nfs/dbraw/zinc/02/50/37/1030025037.db2.gz LGETZSNJWOGLOQ-UHFFFAOYSA-N 2 0 352.482 2.533 20 10 FFCDRP Cc1ccc(C)c(N2CC[NH+](Cc3cc4c(cc3O)OCC[NH2+]C4)CC2)c1 ZINC001204621940 1031393389 /nfs/dbraw/zinc/39/33/89/1031393389.db2.gz SSHBKSPTBODWFM-UHFFFAOYSA-N 2 0 367.493 2.813 20 10 FFCDRP C[C@@H](CC[NH+](C)C)C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353246 1031703863 /nfs/dbraw/zinc/70/38/63/1031703863.db2.gz CRRRYPYBVMVUCF-WMLDXEAASA-N 2 0 367.921 2.714 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205627465 1031884562 /nfs/dbraw/zinc/88/45/62/1031884562.db2.gz PQZLSFPWICTYQZ-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(O)c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cc1Br ZINC001205638274 1031896352 /nfs/dbraw/zinc/89/63/52/1031896352.db2.gz LVAZEYYOJNZBHH-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001205690985 1031938163 /nfs/dbraw/zinc/93/81/63/1031938163.db2.gz ZTSKNPYJALYQIG-OAQYLSRUSA-N 2 0 356.466 2.647 20 10 FFCDRP CC[NH+](CC)[C@@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832274677 1034695927 /nfs/dbraw/zinc/69/59/27/1034695927.db2.gz XEAVNVUMAPJXRC-LEWJYISDSA-N 2 0 368.525 2.952 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)CC[C@H]([NH3+])CC2CCCCC2)cc1 ZINC000832282018 1034699334 /nfs/dbraw/zinc/69/93/34/1034699334.db2.gz XHMAOAZMUGFFHI-AZUAARDMSA-N 2 0 360.546 2.947 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139259181 1035032321 /nfs/dbraw/zinc/03/23/21/1035032321.db2.gz LPEDXHVTSWCVRZ-SFHVURJKSA-N 2 0 357.454 2.511 20 10 FFCDRP C[NH+]1CCC(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)CC1 ZINC001139409302 1035094240 /nfs/dbraw/zinc/09/42/40/1035094240.db2.gz HFKAYYJLMGIJJP-UHFFFAOYSA-N 3 0 370.585 2.992 20 10 FFCDRP C[NH+]1CCN(C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)c2ccccc2)CC1 ZINC000834562299 1035407916 /nfs/dbraw/zinc/40/79/16/1035407916.db2.gz IXKNOAAAQYWEEJ-UXHICEINSA-N 2 0 351.494 2.958 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCN(C)c4ncccc4C3)cc2)CC1 ZINC001140305447 1035427467 /nfs/dbraw/zinc/42/74/67/1035427467.db2.gz YYCDOVVFOJVPJB-UHFFFAOYSA-N 2 0 365.525 2.676 20 10 FFCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309875 1035429711 /nfs/dbraw/zinc/42/97/11/1035429711.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 3 0 356.558 2.602 20 10 FFCDRP CN(C)c1ccc(CN2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093260 /nfs/dbraw/zinc/09/32/60/1036093260.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 0 373.541 2.781 20 10 FFCDRP Oc1cc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc(O)c1O ZINC001233012661 1036247636 /nfs/dbraw/zinc/24/76/36/1036247636.db2.gz MLPSLKHLSLNZNU-UHFFFAOYSA-N 2 0 369.465 2.687 20 10 FFCDRP Cc1cc(N2CC[NH+](Cc3cc(O)c(O)cc3O)CC2)c2ccccc2[nH+]1 ZINC001233482730 1036648969 /nfs/dbraw/zinc/64/89/69/1036648969.db2.gz ADROQCMDFLFNHB-UHFFFAOYSA-N 2 0 365.433 2.982 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235039969 1037322433 /nfs/dbraw/zinc/32/24/33/1037322433.db2.gz PSNIEUJRARMKAX-NRFANRHFSA-N 2 0 360.521 2.686 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(N4CCCC4)cc3)C[C@@H]1CC[NH2+]CC2 ZINC001235349283 1037495675 /nfs/dbraw/zinc/49/56/75/1037495675.db2.gz LRQXMNSBZNGCQD-UGKGYDQZSA-N 2 0 371.525 2.652 20 10 FFCDRP NC(=O)C1CC[NH+](C2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)CC1 ZINC001231591184 1037707574 /nfs/dbraw/zinc/70/75/74/1037707574.db2.gz XJYPOVYXMUQZCS-UHFFFAOYSA-N 2 0 367.493 2.707 20 10 FFCDRP Cc1ccc([C@]2(C)C[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)CCO2)cc1 ZINC001235948385 1037850452 /nfs/dbraw/zinc/85/04/52/1037850452.db2.gz MXTQUROUJLMPOZ-QFIPXVFZSA-N 2 0 368.477 2.930 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@H](N3CC(C[NH3+])C3)C2)cc1 ZINC001236078739 1037919705 /nfs/dbraw/zinc/91/97/05/1037919705.db2.gz JPHDZRQGEYMGAW-QFIPXVFZSA-N 2 0 352.526 2.949 20 10 FFCDRP CCCCN(CCCC)c1ccc(C[NH+]2CC(N3CC[NH2+]CC3)C2)c(O)c1 ZINC001236161410 1037957784 /nfs/dbraw/zinc/95/77/84/1037957784.db2.gz OXVHCRMXTYSZBT-UHFFFAOYSA-N 2 0 374.573 2.888 20 10 FFCDRP CC(C)CN(Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@@H]1CCC[NH2+]C1 ZINC001236474826 1038106355 /nfs/dbraw/zinc/10/63/55/1038106355.db2.gz NYRJMNNKNMVYNW-HXUWFJFHSA-N 2 0 362.537 2.788 20 10 FFCDRP CN(C)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1c(O)cccc1Cl)CC2 ZINC001278491664 1039894618 /nfs/dbraw/zinc/89/46/18/1039894618.db2.gz YEBHTRPVAJARDQ-UHFFFAOYSA-N 2 0 351.922 2.895 20 10 FFCDRP Cc1cccc(O)c1C[N@H+]1CC[C@@H]2[C@H]1CCC(=O)N2CC1CC[NH+](C)CC1 ZINC001237487915 1043200543 /nfs/dbraw/zinc/20/05/43/1043200543.db2.gz GCQFTBXPZDPRFE-WOJBJXKFSA-N 2 0 371.525 2.608 20 10 FFCDRP COc1cc(CN2CC3(C2)C[NH+](C2CCCC2)C3)cc(C[NH+](C)C)c1O ZINC001279698508 1043490229 /nfs/dbraw/zinc/49/02/29/1043490229.db2.gz MPPTXZWSSLXRTD-UHFFFAOYSA-N 2 0 359.514 2.523 20 10 FFCDRP COc1ccc(C[N@H+](C)Cc2ccc(N3CCN(C)CC3)c(F)c2)cc1O ZINC001319933520 1045306676 /nfs/dbraw/zinc/30/66/76/1045306676.db2.gz VAMBLRRKWAPHDV-UHFFFAOYSA-N 2 0 373.472 2.924 20 10 FFCDRP Cc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)ccc2c[nH+]cn21 ZINC001289600296 1047707289 /nfs/dbraw/zinc/70/72/89/1047707289.db2.gz PXWZYLFMQQEXHN-HXUWFJFHSA-N 2 0 365.481 2.741 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@@H](C)C1 ZINC001334956362 1053165259 /nfs/dbraw/zinc/16/52/59/1053165259.db2.gz PGWCRUSPMBWRAF-RDJZCZTQSA-N 2 0 366.502 2.636 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cncnc3C)cc2F)CC1 ZINC000848529612 1060227915 /nfs/dbraw/zinc/22/79/15/1060227915.db2.gz YQZHEHHAWVQTDN-OAHLLOKOSA-N 2 0 357.477 2.917 20 10 FFCDRP CC(C)[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[NH+]1CCCCC1 ZINC001558723819 1076063700 /nfs/dbraw/zinc/06/37/00/1076063700.db2.gz WIZIHRLOEUPOQX-LEWJYISDSA-N 2 0 374.573 2.982 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066518 508038746 /nfs/dbraw/zinc/03/87/46/508038746.db2.gz JWBQLYQBLVSSJW-KNQAVFIVSA-N 2 0 355.526 2.972 20 10 FFCDRP CCOc1ccc(O)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1 ZINC000363893730 511834945 /nfs/dbraw/zinc/83/49/45/511834945.db2.gz XNLMSYXLNXCXPC-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[C@H](C)[NH+](C)C)C1 ZINC000617758419 520705067 /nfs/dbraw/zinc/70/50/67/520705067.db2.gz OYIFTLQQEIYLMX-KRWDZBQOSA-N 2 0 370.541 2.864 20 10 FFCDRP C[NH2+]C1(CNC(=O)Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)CCC1 ZINC000630004430 522579089 /nfs/dbraw/zinc/57/90/89/522579089.db2.gz XVWOIUMFJDPYAO-UHFFFAOYSA-N 2 0 368.525 2.666 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000858245390 730420720 /nfs/dbraw/zinc/42/07/20/730420720.db2.gz RVZDVVLCJROWEA-LBPRGKRZSA-N 2 0 357.292 2.985 20 10 FFCDRP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000756400051 736327779 /nfs/dbraw/zinc/32/77/79/736327779.db2.gz ULHZPVUDJZJXRR-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817888575 742220973 /nfs/dbraw/zinc/22/09/73/742220973.db2.gz MRHPUKUSHHMEHT-CXAGYDPISA-N 2 0 357.420 2.759 20 10 FFCDRP C[C@@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc(Cl)ccc1O ZINC000817971972 742225231 /nfs/dbraw/zinc/22/52/31/742225231.db2.gz IHQWGDWXUUQWON-QMTHXVAHSA-N 2 0 351.800 2.532 20 10 FFCDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901918 748131843 /nfs/dbraw/zinc/13/18/43/748131843.db2.gz IWIDOMYMRZTBGS-XGWLTEMNSA-N 2 0 369.303 2.873 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4c(=O)cc[nH]c4c3)cc2)CC1 ZINC000895206559 968436251 /nfs/dbraw/zinc/43/62/51/968436251.db2.gz VFJUVAODBSKSBI-UHFFFAOYSA-N 2 0 362.477 2.570 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1O ZINC001205996038 1032099995 /nfs/dbraw/zinc/09/99/95/1032099995.db2.gz UBZLOASGUMMLBV-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2ccc(C[NH+]3CCCCC3)o2)cc1 ZINC000911666127 983862427 /nfs/dbraw/zinc/86/24/27/983862427.db2.gz HLRXCQNHYGOXMA-LJQANCHMSA-N 2 0 370.497 2.761 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206011531 1032108016 /nfs/dbraw/zinc/10/80/16/1032108016.db2.gz DGPJJNKOOHXZKZ-RDJZCZTQSA-N 2 0 351.922 2.983 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(O)cc1Br ZINC001206025645 1032112837 /nfs/dbraw/zinc/11/28/37/1032112837.db2.gz OPQHEGFPEZRGIR-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP CC[N@H+](CC(=O)N1CCCCCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809713765 994589893 /nfs/dbraw/zinc/58/98/93/994589893.db2.gz LFNOWCSJVKFOMB-UHFFFAOYSA-N 2 0 372.557 2.663 20 10 FFCDRP C[NH2+]CCc1ccccc1C(=O)N(C)c1ccc(OCC[NH+](C)C)cc1 ZINC000844181819 997697956 /nfs/dbraw/zinc/69/79/56/997697956.db2.gz BUBFTOOWDXIDOA-UHFFFAOYSA-N 2 0 355.482 2.666 20 10 FFCDRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)cc1 ZINC000844221190 997714339 /nfs/dbraw/zinc/71/43/39/997714339.db2.gz AESJJIVHKPOAGR-LJQANCHMSA-N 2 0 369.509 2.958 20 10 FFCDRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccccc2O)C2CCCC2)CC1 ZINC000733613163 999028123 /nfs/dbraw/zinc/02/81/23/999028123.db2.gz AXICFJCULVABSW-UHFFFAOYSA-N 2 0 359.514 2.737 20 10 FFCDRP CC(C)[N@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC000903884135 1016287337 /nfs/dbraw/zinc/28/73/37/1016287337.db2.gz SMWUZPCIXPRRNY-IBGZPJMESA-N 2 0 356.518 2.679 20 10 FFCDRP C[C@H](O)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1F ZINC000846017370 1000194087 /nfs/dbraw/zinc/19/40/87/1000194087.db2.gz NTOLWEIYQXSECM-KKSFZXQISA-N 2 0 357.473 2.789 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cccc(OC)c3O)cn2)CC1 ZINC000846140855 1000217795 /nfs/dbraw/zinc/21/77/95/1000217795.db2.gz GYKQBKWFKORPER-MRXNPFEDSA-N 2 0 370.497 2.789 20 10 FFCDRP COC(=O)CC(C)(C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001183532934 1002312982 /nfs/dbraw/zinc/31/29/82/1002312982.db2.gz ILVAPSMYSFZMIE-QGZVFWFLSA-N 2 0 361.530 2.896 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)[NH+](C)C)cc1 ZINC001184426888 1002611552 /nfs/dbraw/zinc/61/15/52/1002611552.db2.gz POUJKGIIBXITMR-PMACEKPBSA-N 2 0 360.546 2.736 20 10 FFCDRP COc1cc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)ccc1O ZINC000775647837 1004922296 /nfs/dbraw/zinc/92/22/96/1004922296.db2.gz CMLCOLXNUDEWMB-UHFFFAOYSA-N 2 0 355.482 2.785 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775648792 1004931490 /nfs/dbraw/zinc/93/14/90/1004931490.db2.gz XKAYQHDXTKCKTR-GOSISDBHSA-N 2 0 374.529 2.537 20 10 FFCDRP c1nc2n(c1C[NH2+]Cc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CCC2 ZINC000850234424 1005797346 /nfs/dbraw/zinc/79/73/46/1005797346.db2.gz GMAGZIQSAVKLBY-UHFFFAOYSA-N 2 0 365.525 2.651 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3COc4cc(F)ccc4C3)cc2)CC1 ZINC000850381827 1005812165 /nfs/dbraw/zinc/81/21/65/1005812165.db2.gz JYKZVARYEVTPMV-IBGZPJMESA-N 2 0 355.457 2.671 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850508069 1005819246 /nfs/dbraw/zinc/81/92/46/1005819246.db2.gz KDGYCNHDYQUEST-YJBOKZPZSA-N 2 0 356.466 2.818 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000854231281 1006734547 /nfs/dbraw/zinc/73/45/47/1006734547.db2.gz IMKMAXLXMCDFTH-INIZCTEOSA-N 2 0 373.541 2.912 20 10 FFCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 ZINC000817889965 1007796613 /nfs/dbraw/zinc/79/66/13/1007796613.db2.gz QYYGMYGRXAQPHC-RLLQIKCJSA-N 2 0 372.557 2.789 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817902958 1007805350 /nfs/dbraw/zinc/80/53/50/1007805350.db2.gz CLSKLMQPSFCFSE-DOPJRALCSA-N 2 0 369.456 2.599 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](O)(c4ccc(F)cc4)C3)cc2)CC1 ZINC000777439481 1011293271 /nfs/dbraw/zinc/29/32/71/1011293271.db2.gz HZSPTAAADDUHKZ-JOCHJYFZSA-N 2 0 369.484 2.671 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNC(=[NH2+])Nc3ccccc3)CC2)cc1 ZINC000303359149 1012044807 /nfs/dbraw/zinc/04/48/07/1012044807.db2.gz AVPNJYCLCMQZJI-UHFFFAOYSA-N 2 0 367.497 2.844 20 10 FFCDRP CCOC(=O)[C@@H]1CC2(C[N@@H+]1Cc1c(C)n(C)c3ccccc31)CC[NH2+]CC2 ZINC001222220826 1032832897 /nfs/dbraw/zinc/83/28/97/1032832897.db2.gz HQAVYXWOZNIYHA-FQEVSTJZSA-N 2 0 369.509 2.994 20 10 FFCDRP C[C@H](CNC(=O)C[NH2+][C@H](C)c1ccccc1O)[NH2+][C@H](C)c1ccccc1O ZINC000931555585 1020513284 /nfs/dbraw/zinc/51/32/84/1020513284.db2.gz YVEMKJQVEXVAIO-BZUAXINKSA-N 2 0 371.481 2.604 20 10 FFCDRP CCN(C)c1cc(C)[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC001156650672 1029286033 /nfs/dbraw/zinc/28/60/33/1029286033.db2.gz BRDKYEGIGCLYBW-UHFFFAOYSA-N 2 0 354.502 2.605 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccccc3)cc2)CC1 ZINC000841101570 1030037609 /nfs/dbraw/zinc/03/76/09/1030037609.db2.gz WBJIRMWATUCDGD-QFIPXVFZSA-N 2 0 350.510 2.585 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H](O)CN1CCc2ccccc2C1)c1ccc(F)cc1[O-] ZINC000796691411 1030883319 /nfs/dbraw/zinc/88/33/19/1030883319.db2.gz BXKAXEROPLOFHF-QUCCMNQESA-N 2 0 358.457 2.991 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753585 1030906849 /nfs/dbraw/zinc/90/68/49/1030906849.db2.gz FKYFNVLBFUAYAN-TYPHKJRUSA-N 3 0 374.548 2.930 20 10 FFCDRP CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)cc1 ZINC000843048279 1031159343 /nfs/dbraw/zinc/15/93/43/1031159343.db2.gz WVKKZUXBHYMIIC-LJQANCHMSA-N 2 0 360.546 2.600 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128883 1031196175 /nfs/dbraw/zinc/19/61/75/1031196175.db2.gz YIXGTLZIKMJBAJ-OALUTQOASA-N 2 0 361.505 2.874 20 10 FFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)cc2F)C[C@H](C)O1 ZINC000843342110 1031336592 /nfs/dbraw/zinc/33/65/92/1031336592.db2.gz JDMMUPWHBYECIC-CSFFLVESSA-N 2 0 361.505 2.917 20 10 FFCDRP COc1cc(C[NH+]2CCC3(CC(F)(F)CO3)CC2)cc(C[NH+](C)C)c1O ZINC001139256173 1035030117 /nfs/dbraw/zinc/03/01/17/1035030117.db2.gz VTEQNYRPWUSGQC-UHFFFAOYSA-N 2 0 370.440 2.853 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC4(C3)CC[N@H+](CC3CC3)C4)cc2)CC1 ZINC001140303710 1035426346 /nfs/dbraw/zinc/42/63/46/1035426346.db2.gz QWJLJCGQXKACEF-UHFFFAOYSA-N 2 0 368.569 2.746 20 10 FFCDRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949954 1036545056 /nfs/dbraw/zinc/54/50/56/1036545056.db2.gz LCNGOGAYDOTAJA-IFMALSPDSA-N 2 0 367.493 2.819 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCCC[C@]34CCC[NH2+]C4)cc2)CC1 ZINC001235167286 1037391897 /nfs/dbraw/zinc/39/18/97/1037391897.db2.gz HGEDOOXDQBHWFD-JOCHJYFZSA-N 2 0 356.558 2.937 20 10 FFCDRP c1cncc(COc2ccc(N3CC[NH+](CC4CC[NH2+]CC4)CC3)cc2)c1 ZINC001207443003 1037445487 /nfs/dbraw/zinc/44/54/87/1037445487.db2.gz KKDWDRUFYFSOQX-UHFFFAOYSA-N 2 0 366.509 2.782 20 10 FFCDRP Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235423696 1037541401 /nfs/dbraw/zinc/54/14/01/1037541401.db2.gz GJFKMRLIVCSYRZ-ROUUACIJSA-N 2 0 361.505 2.874 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001235693086 1037689218 /nfs/dbraw/zinc/68/92/18/1037689218.db2.gz RCLOVJLMUISFOI-OAQYLSRUSA-N 2 0 367.493 2.845 20 10 FFCDRP Cc1cc(C[NH+]2CCC(N3CC[NH2+]CC3)CC2)c(C)n1-c1ccccc1 ZINC001236129022 1037942943 /nfs/dbraw/zinc/94/29/43/1037942943.db2.gz NBQAGIRBZCTHPC-UHFFFAOYSA-N 2 0 352.526 2.964 20 10 FFCDRP COc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1Br ZINC001236321885 1038044346 /nfs/dbraw/zinc/04/43/46/1038044346.db2.gz OUOGLKRUGFNPOV-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP COc1ccc2c(c1)C[N@@H+](Cc1cc3c(cc1O)OCC[NH2+]C3)CCC2 ZINC001236433496 1038086528 /nfs/dbraw/zinc/08/65/28/1038086528.db2.gz IWNJYMUGBJURKJ-UHFFFAOYSA-N 2 0 354.450 2.831 20 10 FFCDRP Cc1cccc(OC2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)n1 ZINC001236533803 1038122623 /nfs/dbraw/zinc/12/26/23/1038122623.db2.gz HPPWMWDKXBYZHW-UHFFFAOYSA-N 2 0 366.509 2.843 20 10 FFCDRP CCCCC[NH+]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236937864 1038366922 /nfs/dbraw/zinc/36/69/22/1038366922.db2.gz GDXJXLAQNCEJSQ-UHFFFAOYSA-N 2 0 362.537 2.885 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001237110498 1038446519 /nfs/dbraw/zinc/44/65/19/1038446519.db2.gz FEUIUWKKAIIKAR-LSDHHAIUSA-N 2 0 373.419 2.501 20 10 FFCDRP Oc1cc(Br)ccc1C[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256683496 1038601507 /nfs/dbraw/zinc/60/15/07/1038601507.db2.gz DHQNXWHZKDFWDZ-UHFFFAOYSA-N 2 0 369.303 2.888 20 10 FFCDRP CCOC(=O)[C@]1(C)CCCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001209845937 1039260176 /nfs/dbraw/zinc/26/01/76/1039260176.db2.gz PNLLZHHCGKZLCR-OAQYLSRUSA-N 2 0 359.514 2.652 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCCN([C@H]4CCCC[NH2+]C4)C3)C2)cc1 ZINC001246704096 1039443210 /nfs/dbraw/zinc/44/32/10/1039443210.db2.gz OQUZRRMRMGREFG-RBBKRZOGSA-N 2 0 373.541 2.756 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@]34CC[C@@]([NH2+]C)(C3)CCC4)cc2)CC1 ZINC001278473679 1039544872 /nfs/dbraw/zinc/54/48/72/1039544872.db2.gz ACQMAVZVDWHSEP-YADHBBJMSA-N 3 0 356.558 2.983 20 10 FFCDRP C[NH+]1CCN(c2ccc(-c3nc4ccccc4n3[C@H]3CC[NH2+]C3)cc2)CC1 ZINC001247050054 1039587756 /nfs/dbraw/zinc/58/77/56/1039587756.db2.gz ZGZSTEWPLHEPIJ-IBGZPJMESA-N 2 0 361.493 2.990 20 10 FFCDRP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001249201222 1040626444 /nfs/dbraw/zinc/62/64/44/1040626444.db2.gz LBDDXYPMAOKXEI-LJQANCHMSA-N 2 0 360.498 2.948 20 10 FFCDRP C[N@@H+]1CCC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001254510235 1040759725 /nfs/dbraw/zinc/75/97/25/1040759725.db2.gz UAIUJWAJKNWZOM-IPHXSNPTSA-N 2 0 355.482 2.913 20 10 FFCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3Cl)C[C@H]2CC1 ZINC001279657041 1043414922 /nfs/dbraw/zinc/41/49/22/1043414922.db2.gz GGMNKVVAICTXCP-CALCHBBNSA-N 2 0 363.933 2.950 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001322573829 1046138484 /nfs/dbraw/zinc/13/84/84/1046138484.db2.gz CEBLPGFMXNQABJ-UHFFFAOYSA-N 2 0 374.548 2.885 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769727 1051689886 /nfs/dbraw/zinc/68/98/86/1051689886.db2.gz ZFVHTKKODYQKHE-SFTDATJTSA-N 2 0 372.557 2.879 20 10 FFCDRP Cc1noc(C)c1C[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001200639696 1058901596 /nfs/dbraw/zinc/90/15/96/1058901596.db2.gz JSSAYHUIOPZJKL-AWEZNQCLSA-N 2 0 360.477 2.903 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)C[N@H+](C)C(C)C)C2)cc1C ZINC001479494692 1062484395 /nfs/dbraw/zinc/48/43/95/1062484395.db2.gz KTWTVEGWEGLDBD-RBUKOAKNSA-N 2 0 361.530 2.718 20 10 FFCDRP C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560330043 1076264531 /nfs/dbraw/zinc/26/45/31/1076264531.db2.gz BJQIWQHDCXTWJO-XMSQKQJNSA-N 2 0 353.510 2.693 20 10 FFCDRP COc1cccc(C[NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)c1O ZINC000192357992 509480120 /nfs/dbraw/zinc/48/01/20/509480120.db2.gz UGQYTVQOSFBHNF-IBGZPJMESA-N 2 0 356.466 2.782 20 10 FFCDRP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Cl)ccc3O)CC2)CC1 ZINC000363864246 511816242 /nfs/dbraw/zinc/81/62/42/511816242.db2.gz CXOPEEYNJADLMY-UHFFFAOYSA-N 2 0 351.922 2.895 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]2CCC[C@H]21 ZINC000375785954 512505554 /nfs/dbraw/zinc/50/55/54/512505554.db2.gz CPFQATZMWZXYSJ-BHIFYINESA-N 2 0 357.542 2.858 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)c1O ZINC000925849023 738536128 /nfs/dbraw/zinc/53/61/28/738536128.db2.gz GJLAFVKIXXEXKM-GXTWGEPZSA-N 2 0 352.862 2.690 20 10 FFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)C1 ZINC000902390027 735941205 /nfs/dbraw/zinc/94/12/05/735941205.db2.gz FRHNFOYMXCJVPH-HNNXBMFYSA-N 2 0 353.457 2.669 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC2CC[NH+](CCC(F)(F)F)CC2)cc1 ZINC000841045922 747260663 /nfs/dbraw/zinc/26/06/63/747260663.db2.gz SUSULDWESGNUAI-QGZVFWFLSA-N 2 0 358.452 2.759 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1O ZINC000843059183 747757574 /nfs/dbraw/zinc/75/75/74/747757574.db2.gz FNXMXIARYOLRTI-LEWSCRJBSA-N 2 0 355.276 2.723 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1O ZINC000843059182 747757753 /nfs/dbraw/zinc/75/77/53/747757753.db2.gz FNXMXIARYOLRTI-GDLCADMTSA-N 2 0 355.276 2.723 20 10 FFCDRP CN(C)c1ccc([C@H](C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)N(C)C)cc1 ZINC000898447447 976469214 /nfs/dbraw/zinc/46/92/14/976469214.db2.gz KIXXYZDUHUSXHT-NRFANRHFSA-N 2 0 364.497 2.726 20 10 FFCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781454 1014391204 /nfs/dbraw/zinc/39/12/04/1014391204.db2.gz LTYUPTDJRWPICM-FQEVSTJZSA-N 2 0 357.542 2.811 20 10 FFCDRP COc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001168236743 981124736 /nfs/dbraw/zinc/12/47/36/981124736.db2.gz ZBZOKTVRZMYGSY-HXUWFJFHSA-N 2 0 351.494 2.704 20 10 FFCDRP Cc1noc(C[C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000897579000 982310030 /nfs/dbraw/zinc/31/00/30/982310030.db2.gz LQWVCWBTJLXYFB-IBGZPJMESA-N 2 0 369.513 2.585 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(Br)c1 ZINC001206024977 1032112518 /nfs/dbraw/zinc/11/25/18/1032112518.db2.gz LWBYVGJYWDBUOY-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000808718622 994229578 /nfs/dbraw/zinc/22/95/78/994229578.db2.gz PNDCKDOQSJZPSZ-OAHLLOKOSA-N 2 0 359.470 2.977 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4[nH]c(=O)ccc43)cc2)CC1 ZINC000809728760 994583459 /nfs/dbraw/zinc/58/34/59/994583459.db2.gz GXRMEHKYGJFXNC-LJQANCHMSA-N 2 0 352.482 2.706 20 10 FFCDRP COc1ccc(N2CCC([NH2+]C3CC[NH+]([C@@H]4CCC[C@H]4O)CC3)CC2)cc1 ZINC000812839133 995548731 /nfs/dbraw/zinc/54/87/31/995548731.db2.gz HZWLUTIRACPKJL-FGZHOGPDSA-N 2 0 373.541 2.631 20 10 FFCDRP O=C(C[N@@H+](Cc1ccccc1O)C1CCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000731845595 998271742 /nfs/dbraw/zinc/27/17/42/998271742.db2.gz FOZBYJLUFUBGHB-UHFFFAOYSA-N 2 0 371.525 2.880 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(O)CCCc4ccccc43)cc2)CC1 ZINC000771844636 1001213837 /nfs/dbraw/zinc/21/38/37/1001213837.db2.gz KPAKIDGXZMSMNY-HSZRJFAPSA-N 2 0 365.521 2.752 20 10 FFCDRP CC(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccnn1C ZINC000788077100 1001754819 /nfs/dbraw/zinc/75/48/19/1001754819.db2.gz SNDHQHDJRHRDHC-FQEVSTJZSA-N 2 0 355.530 2.701 20 10 FFCDRP CN(C)c1ccc(C[NH2+]C2CCN(CC[NH+](C)C)CC2)c(C(F)(F)F)c1 ZINC000792903048 1003223921 /nfs/dbraw/zinc/22/39/21/1003223921.db2.gz FNMLDRKNJBSRKU-UHFFFAOYSA-N 2 0 372.479 2.887 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000850357756 1005811012 /nfs/dbraw/zinc/81/10/12/1005811012.db2.gz ULRBINCKYKMRBP-LJQANCHMSA-N 2 0 357.473 2.748 20 10 FFCDRP C[C@@H]1CCC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1CCC[NH3+] ZINC000852759991 1006171278 /nfs/dbraw/zinc/17/12/78/1006171278.db2.gz SVBFSAHAHJPUEH-YLJYHZDGSA-N 2 0 360.546 2.550 20 10 FFCDRP Fc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1N1CCOCC1 ZINC000853094167 1006295407 /nfs/dbraw/zinc/29/54/07/1006295407.db2.gz ZQOLNAQGIWVEMA-IBGZPJMESA-N 2 0 361.505 2.874 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000809750456 1013019560 /nfs/dbraw/zinc/01/95/60/1013019560.db2.gz XCKGYUJEONFFLH-IBGZPJMESA-N 2 0 373.541 2.992 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C[C@@H]3C3CCCC3)cc2)CC1 ZINC000925715299 1017822023 /nfs/dbraw/zinc/82/20/23/1017822023.db2.gz GFEIIXRQTBFJPQ-FGZHOGPDSA-N 2 0 357.542 2.906 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]34CCC[NH2+]CC4)cc2)CC1 ZINC001222314085 1032887259 /nfs/dbraw/zinc/88/72/59/1032887259.db2.gz BXHGMCQMWCXYDA-QFIPXVFZSA-N 3 0 356.558 2.937 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@](C)(O)c3ccccc3)cc2)CC1 ZINC000778213364 1021130859 /nfs/dbraw/zinc/13/08/59/1021130859.db2.gz ILTYFOPLFOHIEG-QFIPXVFZSA-N 2 0 353.510 2.826 20 10 FFCDRP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc4c(cc3O)CCC4)CC2)CC1 ZINC000758253201 1023997961 /nfs/dbraw/zinc/99/79/61/1023997961.db2.gz LRJYOBCTORMORA-UHFFFAOYSA-N 2 0 357.542 2.730 20 10 FFCDRP COc1cccc(C[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c1O ZINC000093104979 1027606511 /nfs/dbraw/zinc/60/65/11/1027606511.db2.gz FZXQTDSXPWILQO-UHFFFAOYSA-N 2 0 369.509 2.650 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c1O ZINC001204341708 1031237994 /nfs/dbraw/zinc/23/79/94/1031237994.db2.gz KSELGWIYVZCBSX-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H](C(=O)OC)CC[C@H]3C)cc2)CC1 ZINC001140302003 1035425125 /nfs/dbraw/zinc/42/51/25/1035425125.db2.gz HEPGLZLGFQWBIL-IEBWSBKVSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(C(=O)OC)C3)cc2)CC1 ZINC001140303841 1035426011 /nfs/dbraw/zinc/42/60/11/1035426011.db2.gz BNROVDFICJMJPA-OAQYLSRUSA-N 2 0 359.514 2.604 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000835045309 1035492311 /nfs/dbraw/zinc/49/23/11/1035492311.db2.gz UQSKMDUWCWQZIN-AATRIKPKSA-N 2 0 354.498 2.891 20 10 FFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(I)cc1O)CC2 ZINC001232980806 1036214439 /nfs/dbraw/zinc/21/44/39/1036214439.db2.gz WQRNOOZDIFSEIG-UHFFFAOYSA-N 2 0 372.250 2.524 20 10 FFCDRP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@H+](Cc1cc(C)ccc1O)C2 ZINC001235319301 1037474593 /nfs/dbraw/zinc/47/45/93/1037474593.db2.gz AETCDKSBIOYCFV-SIKLNZKXSA-N 2 0 372.509 2.846 20 10 FFCDRP COc1ccc(Br)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)c1O ZINC001231554633 1037677873 /nfs/dbraw/zinc/67/78/73/1037677873.db2.gz AHDDJMIHHSTQFT-UHFFFAOYSA-N 2 0 355.276 2.691 20 10 FFCDRP C[C@@]1(c2ccc(F)cc2)C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCO1 ZINC001235962116 1037861799 /nfs/dbraw/zinc/86/17/99/1037861799.db2.gz JHZCDKIYGDYXPI-QFIPXVFZSA-N 2 0 369.484 2.983 20 10 FFCDRP COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236114068 1037938182 /nfs/dbraw/zinc/93/81/82/1037938182.db2.gz ZLTZQYYMMLKOHV-KRWDZBQOSA-N 2 0 369.509 2.873 20 10 FFCDRP Oc1cc(O)c(CC[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255388000 1041313782 /nfs/dbraw/zinc/31/37/82/1041313782.db2.gz XCOVWESMVWOLNN-SFHVURJKSA-N 2 0 356.466 2.990 20 10 FFCDRP Cc1cc(O)c(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)cc1Cl ZINC001279433634 1043108626 /nfs/dbraw/zinc/10/86/26/1043108626.db2.gz XVTXTNYRPVSWIU-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001279680614 1043456729 /nfs/dbraw/zinc/45/67/29/1043456729.db2.gz FEUIUWKKAIIKAR-GJZGRUSLSA-N 2 0 373.419 2.501 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CCC[NH+](C)C4)C3)cc2)CC1 ZINC001279709568 1043510251 /nfs/dbraw/zinc/51/02/51/1043510251.db2.gz HKAGTLVZQSYIJM-QFIPXVFZSA-N 3 0 356.558 2.746 20 10 FFCDRP Cc1cccc(C)c1NC(=O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001461022906 1061188767 /nfs/dbraw/zinc/18/87/67/1061188767.db2.gz RECLXXUTVBXCPA-UHFFFAOYSA-N 2 0 366.509 2.784 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc4c(c3)CCO4)cc2)CC1 ZINC001474111725 1065458704 /nfs/dbraw/zinc/45/87/04/1065458704.db2.gz HEVSOIYKRUVAAN-UHFFFAOYSA-N 2 0 351.494 2.706 20 10 FFCDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1O ZINC000185648172 509284999 /nfs/dbraw/zinc/28/49/99/509284999.db2.gz YZNUGOOBPYLWCV-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000185322092 510804970 /nfs/dbraw/zinc/80/49/70/510804970.db2.gz PAVKZIRKPUPHDJ-INIZCTEOSA-N 2 0 355.482 2.843 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000375786513 512506613 /nfs/dbraw/zinc/50/66/13/512506613.db2.gz MSVKTZYLUJLQNL-IHPCNDPISA-N 2 0 361.505 2.749 20 10 FFCDRP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)CC[NH+](C)C)C1 ZINC000444245529 514166693 /nfs/dbraw/zinc/16/66/93/514166693.db2.gz XPIMQFLQMCAZIG-KRWDZBQOSA-N 2 0 370.541 2.864 20 10 FFCDRP Oc1ccc(Br)cc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530249629 517656621 /nfs/dbraw/zinc/65/66/21/517656621.db2.gz WTZSKHHAPCWBSF-INIZCTEOSA-N 2 0 369.303 2.745 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)CCC[NH+](C)C)C1 ZINC000571027422 518890870 /nfs/dbraw/zinc/89/08/70/518890870.db2.gz JIFWMCRLFXGGET-UHFFFAOYSA-N 2 0 370.541 2.818 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC2CC([NH+](C)C)C2)C1 ZINC000622008575 523210642 /nfs/dbraw/zinc/21/06/42/523210642.db2.gz UGJXVGTXWDQNPG-UHFFFAOYSA-N 2 0 368.525 2.617 20 10 FFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000858174268 730418746 /nfs/dbraw/zinc/41/87/46/730418746.db2.gz QUBMVAJYNBFMRV-UHFFFAOYSA-N 2 0 354.489 2.537 20 10 FFCDRP COCC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)CC1CC[NH+](C)CC1 ZINC000879125114 732650902 /nfs/dbraw/zinc/65/09/02/732650902.db2.gz PPJVKEUGBXCTOA-UHFFFAOYSA-N 2 0 352.450 2.524 20 10 FFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1C[C@]2(CC[NH2+]C2)CO1 ZINC000903732238 736161260 /nfs/dbraw/zinc/16/12/60/736161260.db2.gz DLZILQSMORGGCX-RDJZCZTQSA-N 2 0 369.303 2.745 20 10 FFCDRP Cc1cc(Br)cc(C[N@@H+](C)CCCN(C)CC[NH+](C)C)c1O ZINC000809787409 741343994 /nfs/dbraw/zinc/34/39/94/741343994.db2.gz CDOAXWPVBDKJFZ-UHFFFAOYSA-N 2 0 372.351 2.778 20 10 FFCDRP C[C@H]([NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1)C1CC[NH+](C)CC1 ZINC000840761001 747175601 /nfs/dbraw/zinc/17/56/01/747175601.db2.gz MZYQGWYAEMBNTC-AWEZNQCLSA-N 2 0 353.457 2.621 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1O ZINC000843126322 747777364 /nfs/dbraw/zinc/77/73/64/747777364.db2.gz JIFJUPKDVYLMNM-UHFFFAOYSA-N 2 0 355.276 2.739 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC000895608117 970783046 /nfs/dbraw/zinc/78/30/46/970783046.db2.gz XSHUWTIJJVLXAI-UHFFFAOYSA-N 3 0 365.525 2.592 20 10 FFCDRP CN(C)c1ccc([C@@H](C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)N(C)C)cc1 ZINC000898447448 976469566 /nfs/dbraw/zinc/46/95/66/976469566.db2.gz KIXXYZDUHUSXHT-OAQYLSRUSA-N 2 0 364.497 2.726 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)Nc2ccccc2C[NH3+])[NH+](C)C)cc1 ZINC000904621948 980305597 /nfs/dbraw/zinc/30/55/97/980305597.db2.gz FVJVDTMROLOCKE-LJQANCHMSA-N 2 0 355.486 2.636 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4[nH]c(=O)oc43)cc2)CC1 ZINC000922332104 988425748 /nfs/dbraw/zinc/42/57/48/988425748.db2.gz CGKQKVWYLGONBW-UHFFFAOYSA-N 2 0 352.438 2.575 20 10 FFCDRP CCOc1cccc(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1O ZINC000922394143 988556498 /nfs/dbraw/zinc/55/64/98/988556498.db2.gz VNDSXXHFBSHVFO-DEPWHIHDSA-N 2 0 362.514 2.750 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CN(C(=O)[C@@H](C(C)C)[NH+](C)C)C[C@H]2C)cc1C ZINC001082724724 995361067 /nfs/dbraw/zinc/36/10/67/995361067.db2.gz FBRZJZNFBVCNAY-YVWKXTFCSA-N 2 0 361.530 2.526 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000846144561 1000218826 /nfs/dbraw/zinc/21/88/26/1000218826.db2.gz LFUIFQMOXYZWAO-IIBYNOLFSA-N 2 0 356.466 2.688 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000775652622 1004959197 /nfs/dbraw/zinc/95/91/97/1004959197.db2.gz OFSOZMNTZNPIQV-UHFFFAOYSA-N 2 0 354.454 2.979 20 10 FFCDRP COc1cc(C[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850249456 1005799124 /nfs/dbraw/zinc/79/91/24/1005799124.db2.gz CJIIJRCRNSALQQ-INIZCTEOSA-N 2 0 363.546 2.814 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](Cc4ccccc4)C3)cc2)CC1 ZINC000776690622 1006523930 /nfs/dbraw/zinc/52/39/30/1006523930.db2.gz GRLZIHJMXSFCIU-HSZRJFAPSA-N 2 0 365.521 2.882 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCC4(CCOCC4)CO3)cc2)CC1 ZINC000883255525 1006718663 /nfs/dbraw/zinc/71/86/63/1006718663.db2.gz YFQXIFXWLMSYMG-OAQYLSRUSA-N 2 0 373.541 2.504 20 10 FFCDRP CC[C@@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1ccc(N(C)C)cc1 ZINC000854231623 1006734492 /nfs/dbraw/zinc/73/44/92/1006734492.db2.gz MWQGKNAZCPFRBQ-HXUWFJFHSA-N 2 0 360.546 2.784 20 10 FFCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(I)cc2O)CC1 ZINC001206319003 1032222910 /nfs/dbraw/zinc/22/29/10/1032222910.db2.gz XGZXGERQRPSCSL-HNNXBMFYSA-N 2 0 374.266 2.948 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC[NH2+]C4)CC3)cc2)CC1 ZINC001222452570 1032983230 /nfs/dbraw/zinc/98/32/30/1032983230.db2.gz HDFOMNCSZKCHLS-UHFFFAOYSA-N 3 0 356.558 2.794 20 10 FFCDRP Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCN[C@H]2CC[NH2+]CC[C@@H]21 ZINC001222510914 1033020956 /nfs/dbraw/zinc/02/09/56/1033020956.db2.gz KIOKWBVDRHLMLG-PMACEKPBSA-N 2 0 355.457 2.724 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(F)ccc3O)cn2)CC1 ZINC000756433179 1023710399 /nfs/dbraw/zinc/71/03/99/1023710399.db2.gz OBRKMXQFWWLGAU-OAHLLOKOSA-N 2 0 358.461 2.919 20 10 FFCDRP CN1CCOc2cc(C[NH+]3CCC(COCC[NH+]4CCCC4)CC3)ccc21 ZINC001141140767 1025507563 /nfs/dbraw/zinc/50/75/63/1025507563.db2.gz PIRLKOFTOBXSDI-UHFFFAOYSA-N 2 0 373.541 2.840 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)c1 ZINC000092426953 1027316419 /nfs/dbraw/zinc/31/64/19/1027316419.db2.gz SOXAPTKCNJFSIZ-UHFFFAOYSA-N 2 0 361.530 2.617 20 10 FFCDRP COCC[C@H](Cc1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000784626334 1030724083 /nfs/dbraw/zinc/72/40/83/1030724083.db2.gz ZVUJWWAJOVYZCB-LJQANCHMSA-N 2 0 357.498 2.769 20 10 FFCDRP CCOc1cccc(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1O ZINC001203608323 1030783566 /nfs/dbraw/zinc/78/35/66/1030783566.db2.gz LZAMWWQVQLSXQY-HDICACEKSA-N 2 0 353.466 2.750 20 10 FFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cc(OC)ccc1O)C2 ZINC001203671920 1030818280 /nfs/dbraw/zinc/81/82/80/1030818280.db2.gz ZCLDCUMSQQPOCR-RXVVDRJESA-N 2 0 360.498 2.581 20 10 FFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205579647 1031849021 /nfs/dbraw/zinc/84/90/21/1031849021.db2.gz PPVDWNRICKNGCI-GOSISDBHSA-N 2 0 355.885 2.830 20 10 FFCDRP CN(C)c1ccc(/C=C/c2ccc(NC(=O)[C@@H]([NH3+])CCC[NH3+])cc2)cc1 ZINC001219203664 1033553230 /nfs/dbraw/zinc/55/32/30/1033553230.db2.gz LOXBMGYRHBVJMZ-XJDXJNMNSA-N 2 0 352.482 2.928 20 10 FFCDRP CCOC(=O)CCC1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235695085 1037691526 /nfs/dbraw/zinc/69/15/26/1037691526.db2.gz ZECSHDXHTYRUJK-UHFFFAOYSA-N 2 0 359.514 2.652 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC001236072682 1037914517 /nfs/dbraw/zinc/91/45/17/1037914517.db2.gz VLTHCSRKXBCVNO-FQEVSTJZSA-N 2 0 364.537 2.803 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC[C@@H](N3CC(C[NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236081144 1037923513 /nfs/dbraw/zinc/92/35/13/1037923513.db2.gz YZVSDYYFKCFJJW-JOCHJYFZSA-N 2 0 352.526 2.949 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001236433430 1038086800 /nfs/dbraw/zinc/08/68/00/1038086800.db2.gz ICHJUJPIZKYQFO-HXUWFJFHSA-N 2 0 359.514 2.583 20 10 FFCDRP Cc1cccnc1O[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236535418 1038122739 /nfs/dbraw/zinc/12/27/39/1038122739.db2.gz HJHSENZJRORSGG-OAQYLSRUSA-N 2 0 366.509 2.843 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4cccnc4)C3)c(F)c2)CC1 ZINC001236941215 1038370416 /nfs/dbraw/zinc/37/04/16/1038370416.db2.gz YEOIJZWGOTWXDD-FQEVSTJZSA-N 2 0 370.472 2.626 20 10 FFCDRP Fc1cccc(O[C@@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236949237 1038375061 /nfs/dbraw/zinc/37/50/61/1038375061.db2.gz GUPOZVDKCAOMBL-OAQYLSRUSA-N 2 0 355.457 2.889 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C)C2)cc1 ZINC001209520254 1038948537 /nfs/dbraw/zinc/94/85/37/1038948537.db2.gz SNOFUECMIWWMIL-HXUWFJFHSA-N 2 0 368.525 2.736 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H]3CC[NH2+][C@H](C(C)C)C3)CC2)cc1 ZINC001246185120 1039267637 /nfs/dbraw/zinc/26/76/37/1039267637.db2.gz SFBFQWJTAWPANX-UGKGYDQZSA-N 2 0 374.573 2.574 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)COCc2ccccc2)CC1 ZINC001252306291 1039490032 /nfs/dbraw/zinc/49/00/32/1039490032.db2.gz YTRNFRNLCIMYKI-NRFANRHFSA-N 2 0 370.493 2.524 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3Cc4ccc([N+](=O)[O-])cc4C3)cc2)CC1 ZINC001254583778 1040816479 /nfs/dbraw/zinc/81/64/79/1040816479.db2.gz OCUFZHZUSJOQRO-IBGZPJMESA-N 2 0 366.465 2.604 20 10 FFCDRP COc1ccc(O)c(C[N@@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1 ZINC001278571427 1041217023 /nfs/dbraw/zinc/21/70/23/1041217023.db2.gz RLAXYPYPVJCPCW-OAQYLSRUSA-N 2 0 361.530 2.640 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)c(Cl)c1 ZINC001279665149 1043428163 /nfs/dbraw/zinc/42/81/63/1043428163.db2.gz IAYAEPXLMBDVLG-UHFFFAOYSA-N 2 0 367.921 2.514 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCC[N@@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769725 1051690484 /nfs/dbraw/zinc/69/04/84/1051690484.db2.gz ZFVHTKKODYQKHE-NHCUHLMSSA-N 2 0 372.557 2.879 20 10 FFCDRP Cc1cc(CC(=O)N(CC[NH+](C)C)CC[NH+](C)C)c(C)n1-c1ccccc1 ZINC001306598646 1052152835 /nfs/dbraw/zinc/15/28/35/1052152835.db2.gz KVZFDFMTTWFGKH-UHFFFAOYSA-N 2 0 370.541 2.588 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@H](C)C1 ZINC001334956363 1053165572 /nfs/dbraw/zinc/16/55/72/1053165572.db2.gz PGWCRUSPMBWRAF-WBVHZDCISA-N 2 0 366.502 2.636 20 10 FFCDRP CN1CCN(c2ccc(C[N@H+](CCCO)Cc3ccccc3)cc2F)CC1 ZINC001337033492 1054426158 /nfs/dbraw/zinc/42/61/58/1054426158.db2.gz VRGAXZNUHKFQIV-UHFFFAOYSA-N 2 0 371.500 2.962 20 10 FFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001349523867 1055317641 /nfs/dbraw/zinc/31/76/41/1055317641.db2.gz YEWZGZYMZSRVGN-UHFFFAOYSA-N 2 0 356.489 2.587 20 10 FFCDRP [NH3+][C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001580368793 1078793571 /nfs/dbraw/zinc/79/35/71/1078793571.db2.gz PKWWRENSEVZWMC-YESZJQIVSA-N 2 0 365.905 2.644 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccccc3Cl)cc2)CC1 ZINC001560342949 1076266059 /nfs/dbraw/zinc/26/60/59/1076266059.db2.gz MRJYZPGQFPDOSL-FQEVSTJZSA-N 2 0 359.901 2.915 20 10 FFCDRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001560985552 1076316874 /nfs/dbraw/zinc/31/68/74/1076316874.db2.gz FIBMVZFBBZWJQJ-HFSMHLIXSA-N 2 0 373.541 2.896 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(N(C)C)cc1 ZINC000159145099 508799240 /nfs/dbraw/zinc/79/92/40/508799240.db2.gz UYLNNMPEAAHAOD-QGZVFWFLSA-N 2 0 353.514 2.750 20 10 FFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000166057244 509594590 /nfs/dbraw/zinc/59/45/90/509594590.db2.gz AMILYSQKGNWWFL-WMZOPIPTSA-N 2 0 367.509 2.670 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000185322157 510806705 /nfs/dbraw/zinc/80/67/05/510806705.db2.gz LYMHMQUCHKORMI-HNNXBMFYSA-N 2 0 371.481 2.543 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000375786514 512506194 /nfs/dbraw/zinc/50/61/94/512506194.db2.gz MSVKTZYLUJLQNL-YSIASYRMSA-N 2 0 361.505 2.749 20 10 FFCDRP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)C[NH+](C)C)C1 ZINC000584521098 518381165 /nfs/dbraw/zinc/38/11/65/518381165.db2.gz FGEDJAAIFWRDQL-QGZVFWFLSA-N 2 0 370.541 2.722 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cc1F ZINC000185866204 729357814 /nfs/dbraw/zinc/35/78/14/729357814.db2.gz RHYMIMUVNWMJEU-KRWDZBQOSA-N 2 0 350.526 2.788 20 10 FFCDRP C[C@@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000873291362 731897773 /nfs/dbraw/zinc/89/77/73/731897773.db2.gz FTLSXWGZCRFTSR-TZMCWYRMSA-N 2 0 369.303 2.964 20 10 FFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)C1 ZINC000902390028 735941279 /nfs/dbraw/zinc/94/12/79/735941279.db2.gz FRHNFOYMXCJVPH-OAHLLOKOSA-N 2 0 353.457 2.669 20 10 FFCDRP COC(=O)/C=C\c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000895607596 970782718 /nfs/dbraw/zinc/78/27/18/970782718.db2.gz QMNBMJQBQYBUHL-KTKRTIGZSA-N 2 0 369.465 2.507 20 10 FFCDRP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)cccc1Cl ZINC001275837282 1013065694 /nfs/dbraw/zinc/06/56/94/1013065694.db2.gz FRBWKLVQYYWWHZ-IBGZPJMESA-N 2 0 365.905 2.564 20 10 FFCDRP COc1ccc2ccc(O)c(C[NH+]3CCC(N4CC[NH+](C)CC4)CC3)c2c1 ZINC000872731977 1013253360 /nfs/dbraw/zinc/25/33/60/1013253360.db2.gz MZQGYHNIVICZEK-UHFFFAOYSA-N 2 0 369.509 2.766 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895555961 970736160 /nfs/dbraw/zinc/73/61/60/970736160.db2.gz DBBGNEMBHGJSSA-SFHVURJKSA-N 2 0 352.482 2.629 20 10 FFCDRP CN(C)c1ccc([C@H](CNC2CC[NH+](C[C@@H]3CCCO3)CC2)[NH+](C)C)cc1 ZINC000898448143 976459705 /nfs/dbraw/zinc/45/97/05/976459705.db2.gz PYAFZLHTRZLDTB-VXKWHMMOSA-N 2 0 374.573 2.588 20 10 FFCDRP Clc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn1 ZINC000877121803 1014480150 /nfs/dbraw/zinc/48/01/50/1014480150.db2.gz WKFFOMXUJCAXSW-UHFFFAOYSA-N 2 0 371.916 2.952 20 10 FFCDRP C[NH2+]Cc1cccc(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000904510736 980289670 /nfs/dbraw/zinc/28/96/70/980289670.db2.gz SIAOCMDHIJYKQS-HXUWFJFHSA-N 2 0 369.513 2.896 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(-c2noc(CC3([NH3+])CC[NH2+]CC3)n2)cc1 ZINC001212168528 984543199 /nfs/dbraw/zinc/54/31/99/984543199.db2.gz BUAVFNYDFJKCCH-UHFFFAOYSA-N 2 0 351.454 2.768 20 10 FFCDRP C[NH+](C)CC[C@H](NCc1ccc(N2CC[NH+](C)CC2)cc1)c1cccnc1 ZINC000922627610 988765824 /nfs/dbraw/zinc/76/58/24/988765824.db2.gz KIEPKJRBZJMCCN-QFIPXVFZSA-N 2 0 367.541 2.616 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)c3ccc(Cl)cc3)cc2)CC1 ZINC000808431673 994128184 /nfs/dbraw/zinc/12/81/84/994128184.db2.gz XFSSMTVTEZBQLF-LJQANCHMSA-N 2 0 373.928 2.958 20 10 FFCDRP COC(=O)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000809733448 994584189 /nfs/dbraw/zinc/58/41/89/994584189.db2.gz WUMOHWVBVWNVSY-UHFFFAOYSA-N 2 0 353.466 2.515 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@@H](c4ccncc4)C3)cc2)CC1 ZINC000824955703 997157477 /nfs/dbraw/zinc/15/74/77/997157477.db2.gz YOBNHAVZSKAMEY-RBBKRZOGSA-N 2 0 366.509 2.843 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CO[C@H](C2CC2)C1 ZINC000825379285 997350785 /nfs/dbraw/zinc/35/07/85/997350785.db2.gz MMZTZQRXNNHRGR-UNMCSNQZSA-N 2 0 355.526 2.876 20 10 FFCDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4c(O)cc(O)cc4O)C[C@H]3C2)cc1 ZINC001144509681 998622400 /nfs/dbraw/zinc/62/24/00/998622400.db2.gz IAHCBODPQHNKNR-IAGOWNOFSA-N 2 0 354.450 2.676 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)Cc2[nH]cnc2C)cc1C ZINC001085406345 999465393 /nfs/dbraw/zinc/46/53/93/999465393.db2.gz ASGPNMCQQJHGEZ-QZTJIDSGSA-N 2 0 370.497 2.795 20 10 FFCDRP CN(C)c1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)cc1 ZINC000903980337 1016356251 /nfs/dbraw/zinc/35/62/51/1016356251.db2.gz PCWAFILOYVTTBO-BUMKJDKQSA-N 2 0 354.542 2.666 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cccc(OC)c3O)cn2)CC1 ZINC000846140854 1000217136 /nfs/dbraw/zinc/21/71/36/1000217136.db2.gz GYKQBKWFKORPER-INIZCTEOSA-N 2 0 370.497 2.789 20 10 FFCDRP COc1ccc([C@H](C[NH3+])C[N@H+](C)CCN(C)c2ccc(OC)cc2)cc1 ZINC000846225776 1000235191 /nfs/dbraw/zinc/23/51/91/1000235191.db2.gz UKCVXULLJVVDKW-GOSISDBHSA-N 2 0 357.498 2.814 20 10 FFCDRP COC(=O)CC1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000771840911 1001211847 /nfs/dbraw/zinc/21/18/47/1001211847.db2.gz ATAGNXACPUXPME-UHFFFAOYSA-N 2 0 359.514 2.794 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](O)c1cccc(F)c1 ZINC000771842018 1001212074 /nfs/dbraw/zinc/21/20/74/1001212074.db2.gz HNVAFIWTGQUEAL-IERDGZPVSA-N 2 0 357.473 2.789 20 10 FFCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859893 /nfs/dbraw/zinc/85/98/93/1003859893.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 3 0 356.558 2.602 20 10 FFCDRP COC(=O)c1ccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775654493 1004963433 /nfs/dbraw/zinc/96/34/33/1004963433.db2.gz LDWNDZYMHDMINB-UHFFFAOYSA-N 2 0 367.493 2.857 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850508064 1005819350 /nfs/dbraw/zinc/81/93/50/1005819350.db2.gz KDGYCNHDYQUEST-QAPCUYQASA-N 2 0 356.466 2.818 20 10 FFCDRP CN(C(=O)c1cccc2c1CC[NH2+]C2)c1ccc(OCC[NH+](C)C)cc1 ZINC000852865520 1006211708 /nfs/dbraw/zinc/21/17/08/1006211708.db2.gz GCKVWOWWUHWZTI-UHFFFAOYSA-N 2 0 353.466 2.549 20 10 FFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000817893796 1007799890 /nfs/dbraw/zinc/79/98/90/1007799890.db2.gz HYORPLQHUIMVNT-BHIFYINESA-N 2 0 357.542 2.906 20 10 FFCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCCN1CC[NH2+]CC1 ZINC000817937110 1007815856 /nfs/dbraw/zinc/81/58/56/1007815856.db2.gz TTZPKWPPUDVFNQ-NRFANRHFSA-N 2 0 353.510 2.951 20 10 FFCDRP C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccc(N2CCNC2=O)cc1 ZINC000817941534 1007817957 /nfs/dbraw/zinc/81/79/57/1007817957.db2.gz KLSKFGUTIIDBKU-MGPUTAFESA-N 2 0 367.497 2.633 20 10 FFCDRP CCOC(=O)CN(CC[NH3+])c1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001170996678 1008776293 /nfs/dbraw/zinc/77/62/93/1008776293.db2.gz ZHHBWCDWKIJMKQ-UHFFFAOYSA-N 2 0 353.466 2.531 20 10 FFCDRP CN(CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc(F)cc1 ZINC001177956907 1008814668 /nfs/dbraw/zinc/81/46/68/1008814668.db2.gz ZWPJOPRIXZBCSW-UHFFFAOYSA-N 2 0 370.516 2.799 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001222276760 1032863268 /nfs/dbraw/zinc/86/32/68/1032863268.db2.gz HYXTYDBWVDALFS-OAQYLSRUSA-N 2 0 360.521 2.543 20 10 FFCDRP CCN(CC)c1ccc(CN(C)CC(=O)NC2CC[NH+](CC)CC2)cc1 ZINC000759644472 1024701541 /nfs/dbraw/zinc/70/15/41/1024701541.db2.gz UCMZPSYRKRSHHV-UHFFFAOYSA-N 2 0 360.546 2.565 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045363 1030000044 /nfs/dbraw/zinc/00/00/44/1030000044.db2.gz KGLCABMQESXADY-ZPMCFJSWSA-N 2 0 352.526 2.863 20 10 FFCDRP Cc1ccccc1N1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001204864495 1031457154 /nfs/dbraw/zinc/45/71/54/1031457154.db2.gz VJMGDOVTTWMECD-UHFFFAOYSA-N 2 0 353.466 2.505 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000832273011 1034693985 /nfs/dbraw/zinc/69/39/85/1034693985.db2.gz LHRFOBGPUZVZTB-NRFANRHFSA-N 2 0 366.509 2.778 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)cc1 ZINC000832272947 1034694666 /nfs/dbraw/zinc/69/46/66/1034694666.db2.gz KHNSLJWFNSLXCA-SFTDATJTSA-N 2 0 366.509 2.533 20 10 FFCDRP CCOC(=O)CC1CC[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)CC1 ZINC001139255085 1035030804 /nfs/dbraw/zinc/03/08/04/1035030804.db2.gz MNXPGUVQCXZCDI-UHFFFAOYSA-N 2 0 364.486 2.628 20 10 FFCDRP CCOC(=O)[C@]1(C)CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139408630 1035092477 /nfs/dbraw/zinc/09/24/77/1035092477.db2.gz NYYKMSHYQHAVOL-JOCHJYFZSA-N 2 0 373.541 2.994 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[NH+](C)CC4)CC3)cc2)CC1 ZINC001139411106 1035095023 /nfs/dbraw/zinc/09/50/23/1035095023.db2.gz VHLXFNOENCFYSB-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001140304394 1035426309 /nfs/dbraw/zinc/42/63/09/1035426309.db2.gz NHDVDXBRVDPBBZ-IBGZPJMESA-N 2 0 373.541 2.992 20 10 FFCDRP c1ccc2c(c1)CCN1CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C[C@@H]21 ZINC001236058707 1037909828 /nfs/dbraw/zinc/90/98/28/1037909828.db2.gz AJKVQZKINWRIKI-QHCPKHFHSA-N 2 0 362.521 2.511 20 10 FFCDRP c1ccc(C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C2CC[NH2+]CC2)cc1 ZINC001236299170 1038030590 /nfs/dbraw/zinc/03/05/90/1038030590.db2.gz DLNAWWJNOPWBSL-UHFFFAOYSA-N 3 0 364.537 2.850 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCCOC4)CC3)c(F)c2)CC1 ZINC001236943403 1038371174 /nfs/dbraw/zinc/37/11/74/1038371174.db2.gz RJALHIUFRGVGTF-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCN(C4CCCC4)C3)cc2)CC1 ZINC001256898912 1038649847 /nfs/dbraw/zinc/64/98/47/1038649847.db2.gz AOHYUWKDWLSSBB-HXUWFJFHSA-N 2 0 356.558 2.935 20 10 FFCDRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700996 1039441139 /nfs/dbraw/zinc/44/11/39/1039441139.db2.gz HYRWZTYYOYSABC-RXVVDRJESA-N 2 0 361.530 2.612 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cccc(OC)c3O)(C1)CCC2 ZINC001278562931 1041181281 /nfs/dbraw/zinc/18/12/81/1041181281.db2.gz OPYWMKIXYYNAJV-UXHICEINSA-N 2 0 364.486 2.546 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC3(C[NH+](CCn4ccnc4)C3)CC2)cc1 ZINC001279149373 1042920407 /nfs/dbraw/zinc/92/04/07/1042920407.db2.gz GBDQJXUBWIEHJO-UHFFFAOYSA-N 2 0 353.514 2.547 20 10 FFCDRP c1ccc(COc2ccc(N3CC[NH+](CCC4C[NH2+]C4)CC3)cc2)cc1 ZINC001237250697 1043074695 /nfs/dbraw/zinc/07/46/95/1043074695.db2.gz WZVMIZNYSKIVDB-UHFFFAOYSA-N 2 0 351.494 2.997 20 10 FFCDRP CN1CCCc2cc(C[N@@H+]3CCCC4(CN(CC[NH+](C)C)C4)C3)ccc21 ZINC001279550702 1043244705 /nfs/dbraw/zinc/24/47/05/1043244705.db2.gz BKUFUBCCIJNNMU-UHFFFAOYSA-N 2 0 356.558 2.528 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(F)cc(C)c3O)(C1)CCC2 ZINC001280028251 1044102935 /nfs/dbraw/zinc/10/29/35/1044102935.db2.gz QDODSAMUUQKKNN-UXHICEINSA-N 2 0 366.477 2.985 20 10 FFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC001320425414 1045406165 /nfs/dbraw/zinc/40/61/65/1045406165.db2.gz YCZXFRUDEKYWDI-ULQDDVLXSA-N 2 0 361.530 2.931 20 10 FFCDRP CCC(CC)(CC(=O)OC)[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001322325479 1046044943 /nfs/dbraw/zinc/04/49/43/1046044943.db2.gz NHGYRHWBQLDAJA-UHFFFAOYSA-N 2 0 365.493 2.789 20 10 FFCDRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccc(CC[NH3+])cc3)c2)CC1 ZINC001340269043 1050673159 /nfs/dbraw/zinc/67/31/59/1050673159.db2.gz JRQOJBFDJMLWPG-UHFFFAOYSA-N 2 0 366.509 2.971 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@@H](C)C1 ZINC001334956360 1053165389 /nfs/dbraw/zinc/16/53/89/1053165389.db2.gz PGWCRUSPMBWRAF-DOTOQJQBSA-N 2 0 366.502 2.636 20 10 FFCDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001200244514 1056140286 /nfs/dbraw/zinc/14/02/86/1056140286.db2.gz VAQVQCARGLENRS-LJQANCHMSA-N 2 0 362.537 2.788 20 10 FFCDRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc4c(cc3O)OCO4)cc2)CC1 ZINC000377116216 512130583 /nfs/dbraw/zinc/13/05/83/512130583.db2.gz VGACJWBIBBDCMP-UHFFFAOYSA-N 2 0 370.449 2.884 20 10 FFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000166057468 509594531 /nfs/dbraw/zinc/59/45/31/509594531.db2.gz AMILYSQKGNWWFL-AEFFLSMTSA-N 2 0 367.509 2.670 20 10 FFCDRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(F)ccc3O)c2)C1 ZINC000180704613 510063270 /nfs/dbraw/zinc/06/32/70/510063270.db2.gz ZBNQOYQLEXCTJV-QGZVFWFLSA-N 2 0 371.456 2.518 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[C@H]21 ZINC000375785955 512505236 /nfs/dbraw/zinc/50/52/36/512505236.db2.gz CPFQATZMWZXYSJ-FDFHNCONSA-N 2 0 357.542 2.858 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NCC2([NH+](C)C)CC2)C1 ZINC000416308190 513702025 /nfs/dbraw/zinc/70/20/25/513702025.db2.gz PBNGSDLVPFGDOZ-UHFFFAOYSA-N 2 0 368.525 2.618 20 10 FFCDRP COc1cc(Br)cc(C[N@H+](C)CC2CC[NH+](C)CC2)c1O ZINC000093088716 728473963 /nfs/dbraw/zinc/47/39/63/728473963.db2.gz FXHLVEUCHMOORI-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP C[C@H]([NH2+]CCCCCN1CC[NH2+]CC1)c1ccc(Br)cc1O ZINC000925844496 738535282 /nfs/dbraw/zinc/53/52/82/738535282.db2.gz LOETZHZGQWQWAT-AWEZNQCLSA-N 2 0 370.335 2.881 20 10 FFCDRP C[C@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000873293725 731897690 /nfs/dbraw/zinc/89/76/90/731897690.db2.gz OYLPUIHXJJCJHD-JSGCOSHPSA-N 2 0 369.303 2.964 20 10 FFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000725846018 734396078 /nfs/dbraw/zinc/39/60/78/734396078.db2.gz UMFJXVVGZYUDFZ-KGLIPLIRSA-N 2 0 355.276 2.880 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000839183564 746797064 /nfs/dbraw/zinc/79/70/64/746797064.db2.gz YPEMIBHFMWEGEX-LBPRGKRZSA-N 2 0 357.292 2.985 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)c2cccc(C[NH+](C)C)c2)[NH+](C)C)cc1 ZINC000891254096 962608614 /nfs/dbraw/zinc/60/86/14/962608614.db2.gz VNPHEJNPVKXQQY-OAQYLSRUSA-N 2 0 368.525 2.847 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H](C)C3CC[NH+](C)CC3)CC2)cc1 ZINC000162835346 975334854 /nfs/dbraw/zinc/33/48/54/975334854.db2.gz UEBUCLBVERIKBR-LJQANCHMSA-N 2 0 374.573 2.527 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+]C3CCC([NH+](C)C)CC3)CC2)cc1 ZINC001168295077 982710954 /nfs/dbraw/zinc/71/09/54/982710954.db2.gz SUUJDFCDZWDRFI-UHFFFAOYSA-N 2 0 374.573 2.670 20 10 FFCDRP COCCOc1ccc(N2CC[NH+](C3CCC([NH+](C)C)CC3)CC2)cc1 ZINC001168329432 982934611 /nfs/dbraw/zinc/93/46/11/982934611.db2.gz TXZACNCURVZSCM-UHFFFAOYSA-N 2 0 361.530 2.707 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206027872 1032114345 /nfs/dbraw/zinc/11/43/45/1032114345.db2.gz WZRJOWQKLFFCQU-HZPDHXFCSA-N 2 0 351.922 2.983 20 10 FFCDRP CCOc1ccc(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391440 988549468 /nfs/dbraw/zinc/54/94/68/988549468.db2.gz CTUJFQVXHWCNKP-CWJKEVGVSA-N 2 0 362.514 2.750 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3c[nH]c(=O)c4ccccc34)cc2)CC1 ZINC000922493613 988643525 /nfs/dbraw/zinc/64/35/25/988643525.db2.gz KORNFCJKNINJHN-UHFFFAOYSA-N 2 0 362.477 2.982 20 10 FFCDRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000180924549 991578427 /nfs/dbraw/zinc/57/84/27/991578427.db2.gz HOSGRAMYGLDKMP-UHFFFAOYSA-N 2 0 371.456 2.647 20 10 FFCDRP [NH3+]CCN(c1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C12CC3CC(CC(C3)C1)C2 ZINC001170626651 995038912 /nfs/dbraw/zinc/03/89/12/995038912.db2.gz ILXREQLRJXPIBT-UHFFFAOYSA-N 2 0 356.470 2.932 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](CO)(c4ccccc4)C3)cc2)CC1 ZINC000812781456 995533181 /nfs/dbraw/zinc/53/31/81/995533181.db2.gz UXXHEWNCXIRDIW-QHCPKHFHSA-N 2 0 365.521 2.574 20 10 FFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@H]1CO[C@H](C2CC2)C1 ZINC000825379283 997351760 /nfs/dbraw/zinc/35/17/60/997351760.db2.gz MMZTZQRXNNHRGR-IRLDBZIGSA-N 2 0 355.526 2.876 20 10 FFCDRP Cc1cc([C@@](C)(O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)o1 ZINC000771840007 1001211485 /nfs/dbraw/zinc/21/14/85/1001211485.db2.gz CJGGWHURASHTLN-NRFANRHFSA-N 2 0 357.498 2.646 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)c3ccc(F)cc3)cc2)CC1 ZINC000771863447 1001223436 /nfs/dbraw/zinc/22/34/36/1001223436.db2.gz GAZQXMKLMLPQSE-OAQYLSRUSA-N 2 0 357.473 2.575 20 10 FFCDRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000130191945 1006513054 /nfs/dbraw/zinc/51/30/54/1006513054.db2.gz YFDSPOMMNXJHMM-UHFFFAOYSA-N 2 0 353.466 2.508 20 10 FFCDRP COc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1OC ZINC000883284454 1006732504 /nfs/dbraw/zinc/73/25/04/1006732504.db2.gz OAOYIEAUEDOBKC-UHFFFAOYSA-N 2 0 355.482 2.745 20 10 FFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(C(=O)CCC[NH2+]C)CC2)cc1 ZINC000854232613 1006733556 /nfs/dbraw/zinc/73/35/56/1006733556.db2.gz VMNPVGGOFMEWOE-KRWDZBQOSA-N 2 0 360.546 2.784 20 10 FFCDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCC(C(N)=O)CC2)cc1 ZINC000925778715 1017847578 /nfs/dbraw/zinc/84/75/78/1017847578.db2.gz WYMYZLXURHFDOK-FXAWDEMLSA-N 2 0 372.557 2.789 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000827750484 1018639129 /nfs/dbraw/zinc/63/91/29/1018639129.db2.gz HXKBXOPSQDUZIZ-FPOVZHCZSA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC000827786318 1018664169 /nfs/dbraw/zinc/66/41/69/1018664169.db2.gz ISUSUIIAXZBZCT-QAPCUYQASA-N 2 0 371.447 2.980 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001222276759 1032862879 /nfs/dbraw/zinc/86/28/79/1032862879.db2.gz HYXTYDBWVDALFS-NRFANRHFSA-N 2 0 360.521 2.543 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)cc2F)CC1 ZINC000902796093 1020483324 /nfs/dbraw/zinc/48/33/24/1020483324.db2.gz MUYDUHRAMHPRMX-GSORCUFDSA-N 2 0 373.516 2.871 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1O ZINC001119446515 1022773367 /nfs/dbraw/zinc/77/33/67/1022773367.db2.gz ZLRVKXYWHBGFLD-LJQANCHMSA-N 2 0 356.466 2.566 20 10 FFCDRP COc1cccc(O)c1C[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000840970657 1029953859 /nfs/dbraw/zinc/95/38/59/1029953859.db2.gz VNIBDGYYGSQMPI-UHFFFAOYSA-N 2 0 356.466 2.518 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CNC(=O)C(C)(C)[C@@H]([NH3+])c2ccccc2)cc1 ZINC000841846529 1030499199 /nfs/dbraw/zinc/49/91/99/1030499199.db2.gz PLECOQQOOIJKEV-MOPGFXCFSA-N 2 0 354.498 2.595 20 10 FFCDRP Oc1ccccc1C[NH+]1CCC2(CC1)COCC[N@H+](Cc1ccncc1)C2 ZINC001203555965 1030764678 /nfs/dbraw/zinc/76/46/78/1030764678.db2.gz LDRPFYADGIWPIE-UHFFFAOYSA-N 2 0 367.493 2.902 20 10 FFCDRP Oc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc1O ZINC001203878613 1030951708 /nfs/dbraw/zinc/95/17/08/1030951708.db2.gz IHDPQJUECFVTJB-UHFFFAOYSA-N 2 0 353.466 2.981 20 10 FFCDRP COc1cc(C[N@H+]2C[C@H]3c4ccccc4C(=O)[C@H]3C2)cc(C[NH+](C)C)c1O ZINC001139254638 1035030648 /nfs/dbraw/zinc/03/06/48/1035030648.db2.gz KEPXHKQFGDIWIG-OALUTQOASA-N 2 0 366.461 2.874 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259316 1035031887 /nfs/dbraw/zinc/03/18/87/1035031887.db2.gz QYUDWGAJEWVRDL-FQEVSTJZSA-N 2 0 364.486 2.628 20 10 FFCDRP CCC(=O)N(CC)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139411281 1035095038 /nfs/dbraw/zinc/09/50/38/1035095038.db2.gz DCILTLCJPBMUHM-UHFFFAOYSA-N 2 0 372.557 2.661 20 10 FFCDRP CCOC(=O)[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139413544 1035096744 /nfs/dbraw/zinc/09/67/44/1035096744.db2.gz WCHLLTWWZUGVRB-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(C(=O)OC)C3)cc2)CC1 ZINC001140303839 1035426165 /nfs/dbraw/zinc/42/61/65/1035426165.db2.gz BNROVDFICJMJPA-NRFANRHFSA-N 2 0 359.514 2.604 20 10 FFCDRP CCOC(=O)[C@@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140306588 1035428284 /nfs/dbraw/zinc/42/82/84/1035428284.db2.gz UVPZNZRAJSDWBZ-QFIPXVFZSA-N 2 0 373.541 2.994 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)cc1 ZINC000835038347 1035491455 /nfs/dbraw/zinc/49/14/55/1035491455.db2.gz WGBNVOQZFPMKOM-SNAWJCMRSA-N 2 0 356.558 2.914 20 10 FFCDRP Cc1cc(C)c(C[N@H+]2CCCC[C@]23CC(=O)N(CC[NH+](C)C)C3)c(O)c1 ZINC001277204850 1035530145 /nfs/dbraw/zinc/53/01/45/1035530145.db2.gz YSJUELGAAYVGLE-OAQYLSRUSA-N 2 0 359.514 2.528 20 10 FFCDRP COc1cc(O)c(CN(CCC[NH+](C)C)CCC[NH+](C)C)cc1Cl ZINC001232269702 1035541216 /nfs/dbraw/zinc/54/12/16/1035541216.db2.gz HXGSKWUKAMNLKG-UHFFFAOYSA-N 2 0 357.926 2.760 20 10 FFCDRP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1c(O)ccc2ccc(OC)cc21 ZINC001234552843 1037082603 /nfs/dbraw/zinc/08/26/03/1037082603.db2.gz KTZJCXHRSPVEHQ-UHFFFAOYSA-N 2 0 374.481 2.871 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCN(c3cccc(Cl)c3)CC1)C[NH2+]CCO2 ZINC001235473734 1037574538 /nfs/dbraw/zinc/57/45/38/1037574538.db2.gz RDEWCQTUULKILK-UHFFFAOYSA-N 2 0 373.884 2.850 20 10 FFCDRP COc1ccc(Br)c(C[N@H+](C)CC2CC[NH+](C)CC2)c1O ZINC001231552789 1037675997 /nfs/dbraw/zinc/67/59/97/1037675997.db2.gz JOJYXSNILGALOT-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001235726776 1037713061 /nfs/dbraw/zinc/71/30/61/1037713061.db2.gz PPLLYCHKQVTLSU-MRXNPFEDSA-N 2 0 355.457 2.930 20 10 FFCDRP Oc1cc2c(cc1CN1CC[NH2+]C[C@H]1c1ccc(Cl)cc1)C[NH2+]CCO2 ZINC001235814701 1037764212 /nfs/dbraw/zinc/76/42/12/1037764212.db2.gz MLZWYPBBQIHIKT-SFHVURJKSA-N 2 0 373.884 2.674 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCN[C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855684 1037796599 /nfs/dbraw/zinc/79/65/99/1037796599.db2.gz UWISPNSENINJAZ-QFIPXVFZSA-N 2 0 350.510 2.585 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)CC[C@@H]2C1 ZINC001237049046 1038424432 /nfs/dbraw/zinc/42/44/32/1038424432.db2.gz RIIZXQWPVPJDKS-TZIWHRDSSA-N 2 0 362.514 2.685 20 10 FFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@]2(CCC[NH+](CCn3ccnc3)C2)C1 ZINC001278551391 1041112111 /nfs/dbraw/zinc/11/21/11/1041112111.db2.gz ICDRRXONVLBMEN-OAQYLSRUSA-N 2 0 354.498 2.967 20 10 FFCDRP COc1cccc(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4cn[nH]c4)(C2)CCC3)c1O ZINC001278562247 1041178879 /nfs/dbraw/zinc/17/88/79/1041178879.db2.gz BBMLPGNURCKTOJ-UXHICEINSA-N 2 0 356.470 2.849 20 10 FFCDRP COc1ccc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4cn[nH]c4)C3)CC2)c1 ZINC001278570305 1041214231 /nfs/dbraw/zinc/21/42/31/1041214231.db2.gz AUVLWUMSEJGINU-UHFFFAOYSA-N 2 0 356.470 2.612 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(F)ccc3O)(C1)CCC2 ZINC001279197572 1042941799 /nfs/dbraw/zinc/94/17/99/1042941799.db2.gz WGBMVNUCDPKDNO-MOPGFXCFSA-N 2 0 352.450 2.676 20 10 FFCDRP COc1cc(O)c(CN2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1Br ZINC001237418163 1043150675 /nfs/dbraw/zinc/15/06/75/1043150675.db2.gz WOXXGHGTQIRPLN-BXUZGUMPSA-N 2 0 355.276 2.737 20 10 FFCDRP Cc1cc(Cl)cc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c1O ZINC001237687509 1043314590 /nfs/dbraw/zinc/31/45/90/1043314590.db2.gz FHVJMTPIHOARSH-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP CCc1ccc(C[N@H+]2C[C@@H]3CC[NH+](COCCOC)CC[C@@H]3C2)c(O)c1 ZINC001279664029 1043425810 /nfs/dbraw/zinc/42/58/10/1043425810.db2.gz OMLVBRGXMDVQBD-KDURUIRLSA-N 2 0 362.514 2.719 20 10 FFCDRP [NH3+]C[C@@]1(c2ccccc2)C[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC001580334699 1078787708 /nfs/dbraw/zinc/78/77/08/1078787708.db2.gz IPYHXJPOBGTDMX-GRGXKFILSA-N 2 0 351.494 2.672 20 10 FFCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1)c1cnn(C)c1 ZINC000155259551 508960886 /nfs/dbraw/zinc/96/08/86/508960886.db2.gz HUWNITGFPBQSQH-IBGZPJMESA-N 2 0 359.493 2.942 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809145 509306229 /nfs/dbraw/zinc/30/62/29/509306229.db2.gz DXFFJDSHGKHVET-KNKQGSTJSA-N 2 0 374.573 2.526 20 10 FFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c(O)c1 ZINC000186060624 509505066 /nfs/dbraw/zinc/50/50/66/509505066.db2.gz MXUYUALJTKIAFU-MRXNPFEDSA-N 2 0 355.482 2.843 20 10 FFCDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc(F)ccc1O ZINC000185322378 510806528 /nfs/dbraw/zinc/80/65/28/510806528.db2.gz YQTACQSYFYNHEB-CQSZACIVSA-N 2 0 359.445 2.674 20 10 FFCDRP Cc1cc(Cl)cc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000289376533 511099154 /nfs/dbraw/zinc/09/91/54/511099154.db2.gz BUDBADJRZWJJRX-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]2CCC[C@@H]21 ZINC000375785957 512504648 /nfs/dbraw/zinc/50/46/48/512504648.db2.gz CPFQATZMWZXYSJ-FSSWDIPSSA-N 2 0 357.542 2.858 20 10 FFCDRP CC[C@H]([NH2+]CCN1CCC([NH3+])CC1)c1cc(Br)ccc1O ZINC000925813785 738532196 /nfs/dbraw/zinc/53/21/96/738532196.db2.gz YXFFZPUUHYJGLJ-HNNXBMFYSA-N 2 0 356.308 2.619 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2Cc1ccc(Br)cc1O ZINC000824938765 743181828 /nfs/dbraw/zinc/18/18/28/743181828.db2.gz LUULCDPFYKWNSI-INMHGKMJSA-N 2 0 369.303 2.838 20 10 FFCDRP COc1cc(Br)cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1O ZINC000843047421 747756086 /nfs/dbraw/zinc/75/60/86/747756086.db2.gz UVLBTXIRWBQSOB-PBWFPOADSA-N 2 0 355.276 2.878 20 10 FFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000846227110 748434158 /nfs/dbraw/zinc/43/41/58/748434158.db2.gz GSSYBJUFFCGCDH-JQHSSLGASA-N 2 0 350.434 2.595 20 10 FFCDRP CC[C@@H]([NH2+]CCCN1CCN(c2ccc(OC)cc2)CC1)c1cnn(C)c1 ZINC000162784173 971961607 /nfs/dbraw/zinc/96/16/07/971961607.db2.gz XKWWZOXGEWGUEW-OAQYLSRUSA-N 2 0 371.529 2.682 20 10 FFCDRP CCC(=O)Nc1cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc[nH+]1 ZINC001167440489 963391177 /nfs/dbraw/zinc/39/11/77/963391177.db2.gz AZBKGXWGVYUVEU-UHFFFAOYSA-N 2 0 353.470 2.794 20 10 FFCDRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 ZINC000067452966 967688618 /nfs/dbraw/zinc/68/86/18/967688618.db2.gz HVXXJCQGKPVVGL-RTBURBONSA-N 2 0 361.530 2.502 20 10 FFCDRP COc1cc(O)c(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)cc1OC ZINC000904458225 980280991 /nfs/dbraw/zinc/28/09/91/980280991.db2.gz CNXNTQPRHALCRE-UHFFFAOYSA-N 2 0 356.466 2.902 20 10 FFCDRP CCOc1ccc(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391439 988548735 /nfs/dbraw/zinc/54/87/35/988548735.db2.gz CTUJFQVXHWCNKP-AYWYSENESA-N 2 0 362.514 2.750 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000808718620 994228994 /nfs/dbraw/zinc/22/89/94/994228994.db2.gz PNDCKDOQSJZPSZ-HNNXBMFYSA-N 2 0 359.470 2.977 20 10 FFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1O ZINC000846145189 1000218781 /nfs/dbraw/zinc/21/87/81/1000218781.db2.gz NDVYZJRBOLUGOQ-QRFRQXIXSA-N 2 0 370.493 2.934 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCN2CCC([NH+](C)C)CC2)c(C(F)(F)F)c1 ZINC000793047495 1003264958 /nfs/dbraw/zinc/26/49/58/1003264958.db2.gz MXIYBIUMLKJISP-UHFFFAOYSA-N 2 0 372.479 2.887 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CCO)c1ccccc1 ZINC000775698622 1003704190 /nfs/dbraw/zinc/70/41/90/1003704190.db2.gz PMHBCLAMJQATAW-JOCHJYFZSA-N 2 0 353.510 2.994 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1n1ccnc1 ZINC000775738147 1003929514 /nfs/dbraw/zinc/92/95/14/1003929514.db2.gz UFXMLDGXRQWLFC-RXVVDRJESA-N 2 0 353.514 2.718 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]CCOc3cccc(F)c3)cc2F)CC1 ZINC001199564139 1004971471 /nfs/dbraw/zinc/97/14/71/1004971471.db2.gz OFRNZARNVQEJMM-UHFFFAOYSA-N 2 0 361.436 2.885 20 10 FFCDRP COc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(OC)c1 ZINC001199865626 1005047543 /nfs/dbraw/zinc/04/75/43/1005047543.db2.gz RWHQKYZHRNWRKH-UHFFFAOYSA-N 2 0 369.509 2.788 20 10 FFCDRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850031158 1005779854 /nfs/dbraw/zinc/77/98/54/1005779854.db2.gz QYAHTAACIJFYMH-INIZCTEOSA-N 2 0 363.546 2.814 20 10 FFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850508384 1005819126 /nfs/dbraw/zinc/81/91/26/1005819126.db2.gz MDKVNYWUFAYXMF-QAPCUYQASA-N 2 0 356.466 2.818 20 10 FFCDRP C[C@@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000817916678 1007808006 /nfs/dbraw/zinc/80/80/06/1007808006.db2.gz JKXQHYVGFVFPEL-GCJKJVERSA-N 2 0 356.558 2.839 20 10 FFCDRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)NCc2ccc(N(C)C)cc2)CC1 ZINC000114475584 1007916073 /nfs/dbraw/zinc/91/60/73/1007916073.db2.gz OKNJISWWELFSMH-UHFFFAOYSA-N 2 0 374.573 2.813 20 10 FFCDRP C[C@](O)(C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)C(F)(F)F ZINC000819200071 1008064812 /nfs/dbraw/zinc/06/48/12/1008064812.db2.gz IYNVKFQHOKIPLD-SFHVURJKSA-N 2 0 371.447 2.622 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCN(CC(F)F)CC3)cc2)CC1 ZINC000857784788 1008208315 /nfs/dbraw/zinc/20/83/15/1008208315.db2.gz WOTRCKYISLASDR-UHFFFAOYSA-N 2 0 366.500 2.505 20 10 FFCDRP Cc1cccc2c1C[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CO2 ZINC000858216188 1008326710 /nfs/dbraw/zinc/32/67/10/1008326710.db2.gz VKNXUQIHUSLWBW-IBGZPJMESA-N 2 0 351.494 2.840 20 10 FFCDRP COc1cccc2c1C[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CO2 ZINC001173146880 1012292330 /nfs/dbraw/zinc/29/23/30/1012292330.db2.gz DCPLLUZQEQMHGA-GOSISDBHSA-N 2 0 367.493 2.540 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc(C(C)C)cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136352 1032779680 /nfs/dbraw/zinc/77/96/80/1032779680.db2.gz RZBQXBZQWDBHCV-RXVVDRJESA-N 2 0 360.498 2.880 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1 ZINC001118006897 1022016300 /nfs/dbraw/zinc/01/63/00/1022016300.db2.gz PQUFAUKIQWACRV-MSOLQXFVSA-N 2 0 373.541 2.635 20 10 FFCDRP CCOc1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(O)c1 ZINC000757963008 1023892301 /nfs/dbraw/zinc/89/23/01/1023892301.db2.gz DWFBYRSCODDXSN-UHFFFAOYSA-N 2 0 361.530 2.640 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC(=O)N(CC[NH+](C)C)CC2)c(C)n1-c1ccccc1 ZINC001137859199 1033229161 /nfs/dbraw/zinc/22/91/61/1033229161.db2.gz NLXCPOPVSUFWEN-UHFFFAOYSA-N 2 0 368.525 2.690 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000840970314 1029953883 /nfs/dbraw/zinc/95/38/83/1029953883.db2.gz UGSBJFJQXUGTEW-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc2C[NH2+]1 ZINC000841091079 1030030128 /nfs/dbraw/zinc/03/01/28/1030030128.db2.gz XJDIAQGCQFLYED-SFHVURJKSA-N 2 0 350.510 2.937 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)CCc3ccccc3)cc2)CC1 ZINC000784678955 1030752752 /nfs/dbraw/zinc/75/27/52/1030752752.db2.gz FHPDBHGZQJLASO-QFIPXVFZSA-N 2 0 353.510 2.522 20 10 FFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1cc(O)c(O)c(OC)c1 ZINC001204346465 1031242409 /nfs/dbraw/zinc/24/24/09/1031242409.db2.gz QCQOPEULDDQWKM-UHFFFAOYSA-N 2 0 367.534 2.592 20 10 FFCDRP COc1cc(C[N@H+](C)Cc2ccc3c(c2)OCO3)cc(C[NH+](C)C)c1O ZINC001139258605 1035031912 /nfs/dbraw/zinc/03/19/12/1035031912.db2.gz UXARFNKBCOXFTE-UHFFFAOYSA-N 2 0 358.438 2.823 20 10 FFCDRP CCOC(=O)C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001139410872 1035095287 /nfs/dbraw/zinc/09/52/87/1035095287.db2.gz JJONGZGPNIHUBE-UHFFFAOYSA-N 2 0 359.514 2.746 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](CC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001139410968 1035095434 /nfs/dbraw/zinc/09/54/34/1035095434.db2.gz OAWJZTWTVPIKBF-LJQANCHMSA-N 2 0 373.541 2.992 20 10 FFCDRP C[NH+]1CCN(C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)c2ccccc2)CC1 ZINC000834562298 1035407744 /nfs/dbraw/zinc/40/77/44/1035407744.db2.gz IXKNOAAAQYWEEJ-PMACEKPBSA-N 2 0 351.494 2.958 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](CO)(C(F)(F)F)C3)cc2)CC1 ZINC001140302101 1035425183 /nfs/dbraw/zinc/42/51/83/1035425183.db2.gz JTZUEJKWKIVBOY-GOSISDBHSA-N 2 0 371.447 2.575 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](Oc4ccncc4)C3)cc2)CC1 ZINC001140306236 1035427550 /nfs/dbraw/zinc/42/75/50/1035427550.db2.gz QAFNQJZPHRJTQY-QFIPXVFZSA-N 2 0 366.509 2.877 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000835045310 1035492044 /nfs/dbraw/zinc/49/20/44/1035492044.db2.gz UQSKMDUWCWQZIN-WAYWQWQTSA-N 2 0 354.498 2.891 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155290 1037390561 /nfs/dbraw/zinc/39/05/61/1037390561.db2.gz OAGXRAZBRMDRDT-JOCHJYFZSA-N 2 0 356.558 2.793 20 10 FFCDRP Cc1cc(CN2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c(O)cc1Br ZINC001235402678 1037529474 /nfs/dbraw/zinc/52/94/74/1037529474.db2.gz XTIXIFMRGUYGDJ-HOTGVXAUSA-N 2 0 357.267 2.987 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001235726773 1037713201 /nfs/dbraw/zinc/71/32/01/1037713201.db2.gz PPLLYCHKQVTLSU-INIZCTEOSA-N 2 0 355.457 2.930 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccccc3F)cc2)CC1 ZINC001235734787 1037718467 /nfs/dbraw/zinc/71/84/67/1037718467.db2.gz DYYLPCIRNZSDNY-JOCHJYFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001235949981 1037854538 /nfs/dbraw/zinc/85/45/38/1037854538.db2.gz YNPCODWEBHJVOS-KRWDZBQOSA-N 2 0 355.457 2.930 20 10 FFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1c(C)cc(OC)cc1O)C2 ZINC001236809865 1038284285 /nfs/dbraw/zinc/28/42/85/1038284285.db2.gz SVXHNRZGTJDHNG-GCJKJVERSA-N 2 0 374.525 2.890 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cccc(O)c4C3)c(F)c2)CC1 ZINC001236942993 1038371014 /nfs/dbraw/zinc/37/10/14/1038371014.db2.gz OSHDXHVUDRRFAL-UHFFFAOYSA-N 2 0 355.457 2.841 20 10 FFCDRP Oc1ccccc1CN1CCC([NH2+]C2CCC([NH+]3CCOCC3)CC2)CC1 ZINC001256680800 1038600767 /nfs/dbraw/zinc/60/07/67/1038600767.db2.gz DMNMOTBPPSISAQ-UHFFFAOYSA-N 2 0 373.541 2.590 20 10 FFCDRP COc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]CC(=O)N(C)C)(C2)CCC3)cc1C ZINC001279143551 1042917549 /nfs/dbraw/zinc/91/75/49/1042917549.db2.gz SBMPGQRGCCSXJQ-LEWJYISDSA-N 2 0 359.514 2.616 20 10 FFCDRP COCCOC[N@H+]1CC[C@H]2C[NH+](Cc3ccc(N(C)C)cc3)C[C@H]2CC1 ZINC001279149957 1042920453 /nfs/dbraw/zinc/92/04/53/1042920453.db2.gz PJDYOSZEZHRHAJ-BGYRXZFFSA-N 2 0 361.530 2.517 20 10 FFCDRP CN(C)c1ccc(C[N@H+]2[C@@H]3C[C@H]2CN(CC[NH+](C)C)C3)c2ccccc21 ZINC001279222740 1042951224 /nfs/dbraw/zinc/95/12/24/1042951224.db2.gz XVHHPRANZXSZBY-KDURUIRLSA-N 2 0 352.526 2.726 20 10 FFCDRP Cc1cccc(O)c1C[NH+]1CC[C@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2C(C)C)C1 ZINC001237488792 1043202956 /nfs/dbraw/zinc/20/29/56/1043202956.db2.gz QBUPIOPLNQZIHT-HBFSDRIKSA-N 2 0 369.513 2.666 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@H]3C3CCOCC3)cc2F)CC1 ZINC001351781565 1054996098 /nfs/dbraw/zinc/99/60/98/1054996098.db2.gz BSIYGFVBRGJWQB-OALUTQOASA-N 2 0 361.505 2.730 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC001461207059 1061250457 /nfs/dbraw/zinc/25/04/57/1061250457.db2.gz XWZSRMZRNSTSDL-OAHLLOKOSA-N 2 0 365.481 2.871 20 10 FFCDRP Cc1nn(C)c(C)c1C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001461242306 1061263514 /nfs/dbraw/zinc/26/35/14/1061263514.db2.gz PKLBLZIMYINTQH-MRXNPFEDSA-N 2 0 355.530 2.510 20 10 FFCDRP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(O)c1 ZINC001461994300 1061472880 /nfs/dbraw/zinc/47/28/80/1061472880.db2.gz GTJSNIILNDRYHB-IBGZPJMESA-N 2 0 370.493 2.956 20 10 FFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000121239835 509155121 /nfs/dbraw/zinc/15/51/21/509155121.db2.gz BETYFEZBCHWSLW-IBGZPJMESA-N 2 0 374.573 2.527 20 10 FFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3CC(=O)N(C)C)cc1 ZINC000285533859 510945364 /nfs/dbraw/zinc/94/53/64/510945364.db2.gz CTXNPPQSNHZJQT-UPRUFMODSA-N 2 0 372.557 2.877 20 10 FFCDRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1O ZINC000282404465 510962992 /nfs/dbraw/zinc/96/29/92/510962992.db2.gz RUTXQVAQRRUYJN-CYBMUJFWSA-N 2 0 370.335 2.831 20 10 FFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000825246899 743234679 /nfs/dbraw/zinc/23/46/79/743234679.db2.gz KOVJLEMVKCYGAK-CQSZACIVSA-N 2 0 370.335 2.518 20 10 FFCDRP COc1cc(Br)cc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c1O ZINC000843120213 747776820 /nfs/dbraw/zinc/77/68/20/747776820.db2.gz ZGZVOYGWUUQWDJ-UHFFFAOYSA-N 2 0 355.276 2.739 20 10 FFCDRP Cc1cc(Br)cc(C[N@@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c1O ZINC000843125513 747777646 /nfs/dbraw/zinc/77/76/46/747777646.db2.gz XLQKPDYSNUOYFO-CQSZACIVSA-N 2 0 369.303 2.650 20 10 FFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1O ZINC000846227111 748434113 /nfs/dbraw/zinc/43/41/13/748434113.db2.gz GSSYBJUFFCGCDH-KBAYOESNSA-N 2 0 350.434 2.595 20 10 FFCDRP COc1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)sn1 ZINC000877119820 1014480185 /nfs/dbraw/zinc/48/01/85/1014480185.db2.gz AOYRNTYBIYBCDW-UHFFFAOYSA-N 2 0 372.538 2.974 20 10 FFCDRP C[NH2+]Cc1ccc(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc1 ZINC000904513399 980290783 /nfs/dbraw/zinc/29/07/83/980290783.db2.gz DJALOXFIOWVNOU-HXUWFJFHSA-N 2 0 369.513 2.896 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cc1Br ZINC001206011581 1032108334 /nfs/dbraw/zinc/10/83/34/1032108334.db2.gz FAUTZOWZIXJFMR-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206027868 1032114526 /nfs/dbraw/zinc/11/45/26/1032114526.db2.gz WZRJOWQKLFFCQU-HOTGVXAUSA-N 2 0 351.922 2.983 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)c(O)c1 ZINC001144508667 998610193 /nfs/dbraw/zinc/61/01/93/998610193.db2.gz UWBHSDWDHJNGDF-UHFFFAOYSA-N 2 0 358.438 2.885 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515479 998627361 /nfs/dbraw/zinc/62/73/61/998627361.db2.gz PZLQAGGYENWKOX-DLBZAZTESA-N 2 0 354.450 2.757 20 10 FFCDRP C[C@@H](O)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1F ZINC000846017368 1000193802 /nfs/dbraw/zinc/19/38/02/1000193802.db2.gz NTOLWEIYQXSECM-IERDGZPVSA-N 2 0 357.473 2.789 20 10 FFCDRP C[C@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000768465734 1000263788 /nfs/dbraw/zinc/26/37/88/1000263788.db2.gz RLNXPYWOWKHKCA-UWJYYQICSA-N 2 0 357.542 2.729 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205570619 1003950460 /nfs/dbraw/zinc/95/04/60/1003950460.db2.gz MLWLTQJOSQCUGD-HNNXBMFYSA-N 2 0 361.255 2.816 20 10 FFCDRP C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677366 1005003618 /nfs/dbraw/zinc/00/36/18/1005003618.db2.gz ALYUPMOOZROXIG-VAMGGRTRSA-N 2 0 358.574 2.894 20 10 FFCDRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001201625548 1005245287 /nfs/dbraw/zinc/24/52/87/1005245287.db2.gz BNNVBCLYPYCLCH-NRFANRHFSA-N 2 0 352.478 2.868 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cncc(OC)c3)cc2F)CC1 ZINC000850125309 1005788109 /nfs/dbraw/zinc/78/81/09/1005788109.db2.gz FFFSDKYUDBLBLL-UHFFFAOYSA-N 2 0 358.461 2.661 20 10 FFCDRP Cc1noc(C2CCC([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)n1 ZINC000883290577 1006735418 /nfs/dbraw/zinc/73/54/18/1006735418.db2.gz YPNYJWDFCINCSB-UHFFFAOYSA-N 2 0 369.513 2.946 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3COC4(CCCCCC4)O3)cc2)CC1 ZINC000776958279 1008201258 /nfs/dbraw/zinc/20/12/58/1008201258.db2.gz CAMVCXKYOBYWTM-OAQYLSRUSA-N 2 0 373.541 2.994 20 10 FFCDRP Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)nc1 ZINC000858012758 1008277255 /nfs/dbraw/zinc/27/72/55/1008277255.db2.gz LMVIVWGYJUDKPH-OAQYLSRUSA-N 2 0 366.509 2.795 20 10 FFCDRP COc1c[nH+]ccc1N1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000794699522 1010517473 /nfs/dbraw/zinc/51/74/73/1010517473.db2.gz KSJDCURKLPMONN-UHFFFAOYSA-N 2 0 353.466 2.997 20 10 FFCDRP [NH3+][C@H](CC(=O)N(Cc1ccccc1)C1CC[NH2+]CC1)c1ccccc1O ZINC001161428069 1028167518 /nfs/dbraw/zinc/16/75/18/1028167518.db2.gz GBZIICHKBHKRNQ-LJQANCHMSA-N 2 0 353.466 2.563 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3[nH+]ccc(N)c3C)CC2)cc1 ZINC001164328180 1029248098 /nfs/dbraw/zinc/24/80/98/1029248098.db2.gz SHMBSAZWEDZUMB-UHFFFAOYSA-N 2 0 355.486 2.605 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045360 1029999208 /nfs/dbraw/zinc/99/92/08/1029999208.db2.gz KGLCABMQESXADY-VOQZNFBZSA-N 2 0 352.526 2.863 20 10 FFCDRP COC1(C(F)(F)F)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000841888829 1030523151 /nfs/dbraw/zinc/52/31/51/1030523151.db2.gz SHCCUYMBZCQTCS-UHFFFAOYSA-N 2 0 371.447 2.982 20 10 FFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)cc2F)C[C@@H](C)O1 ZINC000843342111 1031335894 /nfs/dbraw/zinc/33/58/94/1031335894.db2.gz JDMMUPWHBYECIC-POGZOPGASA-N 2 0 361.505 2.917 20 10 FFCDRP Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000798960955 1031595983 /nfs/dbraw/zinc/59/59/83/1031595983.db2.gz ONCHFOFHACCDAK-NRFANRHFSA-N 2 0 353.514 2.899 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](c3noc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139254057 1035030778 /nfs/dbraw/zinc/03/07/78/1035030778.db2.gz CLWNMMVNYADXFV-HNNXBMFYSA-N 2 0 360.458 2.533 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@@H]3C[NH+]3CCCC3)cc2)CC1 ZINC001139409909 1035093579 /nfs/dbraw/zinc/09/35/79/1035093579.db2.gz UXPIIOQCENAHSR-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](CC(=O)OC)C3)cc2)CC1 ZINC001140305939 1035427609 /nfs/dbraw/zinc/42/76/09/1035427609.db2.gz IVDYNUXSJXXLPU-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](CCC(=O)OC)C3)cc2)CC1 ZINC001140306600 1035428271 /nfs/dbraw/zinc/42/82/71/1035428271.db2.gz VCFVSYCLEQGCNI-IBGZPJMESA-N 2 0 359.514 2.604 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000835039840 1035491624 /nfs/dbraw/zinc/49/16/24/1035491624.db2.gz KIQABTTXOFDTLO-MFJULSPGSA-N 2 0 365.521 2.992 20 10 FFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001140620388 1035746508 /nfs/dbraw/zinc/74/65/08/1035746508.db2.gz MKONSHJMOMYDBK-DENIHFKCSA-N 2 0 367.493 2.819 20 10 FFCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(N3CCOCC3)cc1F)CC2 ZINC001140664963 1035821324 /nfs/dbraw/zinc/82/13/24/1035821324.db2.gz YIMFUWBZXWMBHC-UHFFFAOYSA-N 2 0 361.505 2.970 20 10 FFCDRP Oc1cc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)cc(O)c1O ZINC001233016757 1036255196 /nfs/dbraw/zinc/25/51/96/1036255196.db2.gz NGJOHJWROBEEJZ-UHFFFAOYSA-N 2 0 354.450 2.901 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@@]34CCC[NH2+]C4)c(F)c2)CC1 ZINC001235180291 1037396165 /nfs/dbraw/zinc/39/61/65/1037396165.db2.gz VCFROCSLSDPIHT-NRFANRHFSA-N 2 0 360.521 2.686 20 10 FFCDRP CC(C)(O)C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236113304 1037937046 /nfs/dbraw/zinc/93/70/46/1037937046.db2.gz RGVNSMOQOGMXMZ-UHFFFAOYSA-N 2 0 353.510 2.869 20 10 FFCDRP COc1ccc(N2CC[NH+](CC3CC4(C3)CC[NH2+]CC4)CC2)c(OC)c1 ZINC001236410728 1038076268 /nfs/dbraw/zinc/07/62/68/1038076268.db2.gz KFSPKWPHHMBACV-UHFFFAOYSA-N 2 0 359.514 2.606 20 10 FFCDRP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC2CCC2)CC1 ZINC001236539221 1038125281 /nfs/dbraw/zinc/12/52/81/1038125281.db2.gz APIHJQBHQXRRMT-WGSAOQKQSA-N 3 0 359.514 2.746 20 10 FFCDRP CC(C)C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1O)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551031 1038126440 /nfs/dbraw/zinc/12/64/40/1038126440.db2.gz JRFILCVVLSBDRY-WGSAOQKQSA-N 3 0 360.546 2.530 20 10 FFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c(OC)c1 ZINC001236923893 1038359133 /nfs/dbraw/zinc/35/91/33/1038359133.db2.gz MQARXMPPXIVDEP-FQEVSTJZSA-N 2 0 362.562 2.657 20 10 FFCDRP Cc1cc(Br)c(O)c(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c1 ZINC001236930495 1038362537 /nfs/dbraw/zinc/36/25/37/1038362537.db2.gz AXISSJJLWQSPFJ-OAHLLOKOSA-N 2 0 370.335 2.579 20 10 FFCDRP COc1ccc(N2CCN(CCC[NH2+][C@@H]3CC[NH2+][C@@H](C(C)C)C3)CC2)cc1 ZINC001246185117 1039268712 /nfs/dbraw/zinc/26/87/12/1039268712.db2.gz SFBFQWJTAWPANX-DENIHFKCSA-N 2 0 374.573 2.574 20 10 FFCDRP Cc1cc(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4O)C[C@H]3CC2)n(C)n1 ZINC001278552229 1041118349 /nfs/dbraw/zinc/11/83/49/1041118349.db2.gz RQXNBGCHKFIKGW-HDICACEKSA-N 2 0 354.498 2.778 20 10 FFCDRP CC[N@H+](C)C(C)(C)C(=O)N1C[C@@H](C)[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1 ZINC001214997924 1041638414 /nfs/dbraw/zinc/63/84/14/1041638414.db2.gz OKHLHDXCDUJYMD-SJLPKXTDSA-N 2 0 361.530 2.670 20 10 FFCDRP COc1cc(O)c(CN2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1Br ZINC001237418165 1043150140 /nfs/dbraw/zinc/15/01/40/1043150140.db2.gz WOXXGHGTQIRPLN-RISCZKNCSA-N 2 0 355.276 2.737 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC001326037772 1046737737 /nfs/dbraw/zinc/73/77/37/1046737737.db2.gz YAPDTALBJNXZTH-IPYPFGDCSA-N 2 0 357.420 2.675 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC(=O)CC[C@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001343047082 1051663770 /nfs/dbraw/zinc/66/37/70/1051663770.db2.gz IVEFZUUJMRHHRZ-LEWJYISDSA-N 2 0 368.525 2.952 20 10 FFCDRP COc1cc(C)c(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c(O)c1 ZINC001474333612 1065494869 /nfs/dbraw/zinc/49/48/69/1065494869.db2.gz QZSWPYVAIUEZFV-QZTJIDSGSA-N 2 0 361.530 2.700 20 10 FFCDRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000093132718 508122781 /nfs/dbraw/zinc/12/27/81/508122781.db2.gz UYJIKRPLYGTOQN-JOCHJYFZSA-N 2 0 356.558 2.889 20 10 FFCDRP COc1ccc(N2CCC([NH2+]CC3CC[NH+](CCN(C)C)CC3)CC2)cc1 ZINC000124431492 508831155 /nfs/dbraw/zinc/83/11/55/508831155.db2.gz YREFUDPSWUDGEA-UHFFFAOYSA-N 2 0 374.573 2.527 20 10 FFCDRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1O ZINC000155594069 509033587 /nfs/dbraw/zinc/03/35/87/509033587.db2.gz AMUAQHDGASJTOY-LJQANCHMSA-N 2 0 355.482 2.925 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000187182089 510107298 /nfs/dbraw/zinc/10/72/98/510107298.db2.gz AOCVTVKNZBRKED-ZIAGYGMSSA-N 2 0 370.335 2.750 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246113616 510301246 /nfs/dbraw/zinc/30/12/46/510301246.db2.gz JWBQLYQBLVSSJW-UGKGYDQZSA-N 2 0 355.526 2.972 20 10 FFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809738329 741338513 /nfs/dbraw/zinc/33/85/13/741338513.db2.gz USNYDXXUNDZKSN-KRWDZBQOSA-N 2 0 369.937 2.902 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](N2CC[NH2+]CC2)C(F)(F)F)c1O ZINC000817973247 742225355 /nfs/dbraw/zinc/22/53/55/742225355.db2.gz RNWZUHGBUMAJGM-SMDDNHRTSA-N 2 0 365.827 2.841 20 10 FFCDRP COCC1(C[NH2+][C@@H](C)c2ccc(Br)cc2O)CC[NH2+]CC1 ZINC000817975034 742225820 /nfs/dbraw/zinc/22/58/20/742225820.db2.gz QBUAXKGVKONERM-LBPRGKRZSA-N 2 0 357.292 2.822 20 10 FFCDRP Oc1cc(Br)ccc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000824555285 743104255 /nfs/dbraw/zinc/10/42/55/743104255.db2.gz DIXVPRCEFSUNJW-UHFFFAOYSA-N 2 0 369.303 2.699 20 10 FFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)cc1Cl ZINC000825903785 743341714 /nfs/dbraw/zinc/34/17/14/743341714.db2.gz ROZVELWUOOLWDP-UHFFFAOYSA-N 2 0 351.922 2.813 20 10 FFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1O ZINC000844910434 748134719 /nfs/dbraw/zinc/13/47/19/748134719.db2.gz IBKRXVCHAFMWRK-BZUAXINKSA-N 2 0 354.878 2.915 20 10 FFCDRP CC[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(C(F)(F)F)cc1O ZINC000854231159 750265728 /nfs/dbraw/zinc/26/57/28/750265728.db2.gz BBIYDYWKTCFZGU-LBPRGKRZSA-N 2 0 356.348 2.606 20 10 FFCDRP OC1CCN(c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000876771004 1014385986 /nfs/dbraw/zinc/38/59/86/1014385986.db2.gz SISHHXBECUKUTH-HXUWFJFHSA-N 2 0 357.542 2.956 20 10 FFCDRP C[NH2+]Cc1cccc(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)c1 ZINC000904510735 980289867 /nfs/dbraw/zinc/28/98/67/980289867.db2.gz SIAOCMDHIJYKQS-FQEVSTJZSA-N 2 0 369.513 2.896 20 10 FFCDRP [NH3+]CC[C@@H]1CN(c2ncnc3sc4c(c32)CC[NH2+]C4)c2ccccc21 ZINC001168545335 985201965 /nfs/dbraw/zinc/20/19/65/985201965.db2.gz OBCHNVXFFNMBTE-GFCCVEGCSA-N 2 0 351.479 2.921 20 10 FFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1 ZINC000922391240 988548875 /nfs/dbraw/zinc/54/88/75/988548875.db2.gz AEVNPGIDRYPAOH-WLRLJWMZSA-N 2 0 362.514 2.750 20 10 FFCDRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CC1 ZINC000917075093 990117536 /nfs/dbraw/zinc/11/75/36/990117536.db2.gz PUVMCLLPJOWTHL-UHFFFAOYSA-N 2 0 360.546 2.564 20 10 FFCDRP CCCN(Cc1ccc(I)cc1O)[C@H]1CC[NH2+]C1 ZINC001236324862 991159015 /nfs/dbraw/zinc/15/90/15/991159015.db2.gz VPYXDJPIQHBSPJ-ZDUSSCGKSA-N 2 0 360.239 2.571 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](O)(C(F)(F)F)CC3)cc2)CC1 ZINC000809705601 994585987 /nfs/dbraw/zinc/58/59/87/994585987.db2.gz WEDUJKIDTDOTAE-SFHVURJKSA-N 2 0 371.447 2.718 20 10 FFCDRP COc1ccc([C@H](C[NH3+])C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000844220941 997711323 /nfs/dbraw/zinc/71/13/23/997711323.db2.gz RCNSXQGIOZMHED-HXUWFJFHSA-N 2 0 369.509 2.706 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)[C@H]2CCC[N@@H+]2C)cc1C ZINC001085152369 999033755 /nfs/dbraw/zinc/03/37/55/999033755.db2.gz CCSPVKOQAZPQHV-GUDVDZBRSA-N 2 0 359.514 2.615 20 10 FFCDRP Cc1c(C[C@@H](C[NH3+])C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cnn1C ZINC000903879881 1016284036 /nfs/dbraw/zinc/28/40/36/1016284036.db2.gz LHJYYSORARGYFK-SFHVURJKSA-N 2 0 355.530 2.577 20 10 FFCDRP COc1cc(O)c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(Br)c1 ZINC001205654891 1004669286 /nfs/dbraw/zinc/66/92/86/1004669286.db2.gz XZRQWSXLBAELNQ-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH+](Cc4ccccc4)CC3)cc2)CC1 ZINC000775633485 1004886286 /nfs/dbraw/zinc/88/62/86/1004886286.db2.gz JWBSGZQMUNVKAA-UHFFFAOYSA-N 2 0 364.537 2.756 20 10 FFCDRP c1nn2c(c1C[NH2+]Cc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CCC2 ZINC000850234732 1005797420 /nfs/dbraw/zinc/79/74/20/1005797420.db2.gz KBCTVRLPFFIPNO-UHFFFAOYSA-N 2 0 365.525 2.651 20 10 FFCDRP COc1cc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000850284961 1005802671 /nfs/dbraw/zinc/80/26/71/1005802671.db2.gz OGBVWSYOYVHHMH-UHFFFAOYSA-N 2 0 363.546 2.814 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850508057 1005819378 /nfs/dbraw/zinc/81/93/78/1005819378.db2.gz KDGYCNHDYQUEST-CRAIPNDOSA-N 2 0 356.466 2.818 20 10 FFCDRP COCCOc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000883283882 1006731051 /nfs/dbraw/zinc/73/10/51/1006731051.db2.gz WVDBXRNBMORYAJ-UHFFFAOYSA-N 2 0 369.509 2.753 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnc(-c4ccccn4)n3)cc2)CC1 ZINC000883286515 1006733775 /nfs/dbraw/zinc/73/37/75/1006733775.db2.gz VQXJBBJYCWWKMD-UHFFFAOYSA-N 2 0 374.492 2.580 20 10 FFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3c(O)ccc4ccncc43)CC2)CC1 ZINC000817372871 1007567973 /nfs/dbraw/zinc/56/79/73/1007567973.db2.gz MSZQGLNRUSBFNL-UHFFFAOYSA-N 2 0 368.525 2.932 20 10 FFCDRP CCOC(=O)C1([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)CC[NH2+]CC1 ZINC000817898171 1007805246 /nfs/dbraw/zinc/80/52/46/1007805246.db2.gz FFZBRQRYGIRVQH-QGZVFWFLSA-N 2 0 359.514 2.698 20 10 FFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942907 1007818189 /nfs/dbraw/zinc/81/81/89/1007818189.db2.gz RMRASBAXCXJMNN-SJBKTWHCSA-N 3 0 366.509 2.598 20 10 FFCDRP O[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)CC(F)(F)F ZINC000819200989 1008065121 /nfs/dbraw/zinc/06/51/21/1008065121.db2.gz YSFNWDKYFDPWPB-GOSISDBHSA-N 2 0 371.447 2.622 20 10 FFCDRP C[C@@H]1[C@H](C)OC[C@]12CC[C@H](C[NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)O2 ZINC000886338482 1008642689 /nfs/dbraw/zinc/64/26/89/1008642689.db2.gz LSZTXCKCBKWZQW-GMQQQROESA-N 2 0 373.541 2.501 20 10 FFCDRP Cc1ccc(C)c(C[N@H+]2CCCC[C@]23CC(=O)N(CC[NH+](C)C)C3)c1O ZINC001275771911 1012991701 /nfs/dbraw/zinc/99/17/01/1012991701.db2.gz TWVHPVJWWHYZNV-OAQYLSRUSA-N 2 0 359.514 2.528 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c1 ZINC000756641464 1023739577 /nfs/dbraw/zinc/73/95/77/1023739577.db2.gz HYDFJVYCMZPQTF-MRXNPFEDSA-N 2 0 361.530 2.978 20 10 FFCDRP Fc1cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)ccc1N1CCOCC1 ZINC000838906438 1026531130 /nfs/dbraw/zinc/53/11/30/1026531130.db2.gz LXUWQVJFBSMBME-UHFFFAOYSA-N 2 0 370.472 2.816 20 10 FFCDRP CC[C@@H]([NH2+]CC1(N2CCOCC2)CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000840833067 1029890135 /nfs/dbraw/zinc/89/01/35/1029890135.db2.gz KNAPZYQAQLQEDX-OAQYLSRUSA-N 2 0 374.573 2.590 20 10 FFCDRP COc1cc(O)c(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1OC ZINC000843429564 1031400790 /nfs/dbraw/zinc/40/07/90/1031400790.db2.gz GOHRYEODSUHZHW-MSOLQXFVSA-N 2 0 356.466 2.844 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2)CC1 ZINC000798957057 1031595464 /nfs/dbraw/zinc/59/54/64/1031595464.db2.gz KGBYQCMJPDIVDR-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP Cc1c(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c2ccccc2n1C ZINC001138259137 1034031025 /nfs/dbraw/zinc/03/10/25/1034031025.db2.gz CFMJELCBUVJNTB-UHFFFAOYSA-N 2 0 354.542 2.946 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)cc1 ZINC000832272944 1034694195 /nfs/dbraw/zinc/69/41/95/1034694195.db2.gz KHNSLJWFNSLXCA-LEWJYISDSA-N 2 0 366.509 2.533 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)CC[C@@H]([NH3+])CC2CCCCC2)cc1 ZINC000832282021 1034699470 /nfs/dbraw/zinc/69/94/70/1034699470.db2.gz XHMAOAZMUGFFHI-QUCCMNQESA-N 2 0 360.546 2.947 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@]1(O)C(F)(F)F ZINC001139408740 1035092277 /nfs/dbraw/zinc/09/22/77/1035092277.db2.gz PWFNIOSZSKAOSX-MAUKXSAKSA-N 2 0 371.447 2.574 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(c4ccccn4)CC3)cc2)CC1 ZINC001140299660 1035423773 /nfs/dbraw/zinc/42/37/73/1035423773.db2.gz DRYUIMYHWQJAFE-UHFFFAOYSA-N 2 0 365.525 2.546 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC4(C3)CC[NH+](C)CC4)cc2)CC1 ZINC001140306026 1035427558 /nfs/dbraw/zinc/42/75/58/1035427558.db2.gz LBBMMTXTMXJSLT-UHFFFAOYSA-N 3 0 356.558 2.746 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](NC(=O)C(C)C)C3)cc2)CC1 ZINC001140309891 1035429799 /nfs/dbraw/zinc/42/97/99/1035429799.db2.gz ZELLXSUNNOQSIV-HXUWFJFHSA-N 2 0 372.557 2.565 20 10 FFCDRP c1cn2c(n1)[C@@H](NCc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CC2 ZINC000834697336 1035431421 /nfs/dbraw/zinc/43/14/21/1035431421.db2.gz ITEZOYDZSWHYPB-FQEVSTJZSA-N 2 0 351.498 2.650 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCCN(C[C@@H]4CCCC[NH2+]4)C3)C2)cc1 ZINC001235494944 1037585844 /nfs/dbraw/zinc/58/58/44/1037585844.db2.gz UKDSXUBVDOECMR-SIKLNZKXSA-N 2 0 373.541 2.756 20 10 FFCDRP COC(=O)CC[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235693126 1037687042 /nfs/dbraw/zinc/68/70/42/1037687042.db2.gz RZUNOWFZYBCSTI-UHFFFAOYSA-N 2 0 367.493 2.662 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCN[C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855545 1037797796 /nfs/dbraw/zinc/79/77/96/1037797796.db2.gz UFROIRYLUIHPAF-HSZRJFAPSA-N 2 0 364.537 2.975 20 10 FFCDRP Cc1ccc([C@@]2(C)C[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)CCO2)cc1 ZINC001235948383 1037850066 /nfs/dbraw/zinc/85/00/66/1037850066.db2.gz MXTQUROUJLMPOZ-JOCHJYFZSA-N 2 0 368.477 2.930 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4ccncc4)C3)c(F)c2)CC1 ZINC001236937748 1038366777 /nfs/dbraw/zinc/36/67/77/1038366777.db2.gz DRRRHXWAJRAQML-SFHVURJKSA-N 2 0 354.473 2.962 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCCN([C@H]4CCCC[NH2+]C4)C3)C2)cc1 ZINC001246704097 1039443633 /nfs/dbraw/zinc/44/36/33/1039443633.db2.gz OQUZRRMRMGREFG-UNMCSNQZSA-N 2 0 373.541 2.756 20 10 FFCDRP Cc1ncsc1CN1CC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001278751151 1040471678 /nfs/dbraw/zinc/47/16/78/1040471678.db2.gz WJTWVPYGDGNRJH-UHFFFAOYSA-N 2 0 359.495 2.961 20 10 FFCDRP COC(=O)Cc1ccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001249201354 1040626509 /nfs/dbraw/zinc/62/65/09/1040626509.db2.gz PLPMXXYFGYETBA-UHFFFAOYSA-N 2 0 360.498 2.662 20 10 FFCDRP [NH3+][C@H](c1ccccc1O)[C@H](N[C@@H]1CC2CC[NH+](CC2)C1)c1ccccc1O ZINC001254843460 1041001491 /nfs/dbraw/zinc/00/14/91/1041001491.db2.gz IOFQATPNUAGIFG-NPFVIJTESA-N 2 0 367.493 2.913 20 10 FFCDRP COc1cccc(C[N@@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001278562236 1041179572 /nfs/dbraw/zinc/17/95/72/1041179572.db2.gz AUIRPUMECDPIIV-NRFANRHFSA-N 2 0 361.530 2.640 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCN(CCN2CCOCC2)C1 ZINC001262031707 1041520566 /nfs/dbraw/zinc/52/05/66/1041520566.db2.gz ZKEIKTCSYVVJJU-QYZOEREBSA-N 2 0 373.541 2.635 20 10 FFCDRP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)[C@@H]2C1 ZINC001279534481 1043232735 /nfs/dbraw/zinc/23/27/35/1043232735.db2.gz XQQLOLFMRZLIKM-RBBKRZOGSA-N 2 0 356.558 2.745 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104157 1052259314 /nfs/dbraw/zinc/25/93/14/1052259314.db2.gz KCGOBNANNGNAKD-ICSRJNTNSA-N 2 0 360.521 2.542 20 10 FFCDRP Cc1ccc(C[N@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c(O)c1 ZINC001308755027 1052495875 /nfs/dbraw/zinc/49/58/75/1052495875.db2.gz NWXNVYJWQQNWTL-UHFFFAOYSA-N 2 0 353.510 2.950 20 10 FFCDRP C[NH+]1CCN(c2cc[nH+]c(NCc3cc(Cl)c(F)cc3O)c2)CC1 ZINC001308895951 1052513194 /nfs/dbraw/zinc/51/31/94/1052513194.db2.gz GAXGTHZUESDCMP-UHFFFAOYSA-N 2 0 350.825 2.944 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(NC(N)=O)cc1 ZINC001461197074 1061247489 /nfs/dbraw/zinc/24/74/89/1061247489.db2.gz RRWXJWPXFIXATD-MRXNPFEDSA-N 2 0 367.497 2.780 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1O ZINC000184679241 510456646 /nfs/dbraw/zinc/45/66/46/510456646.db2.gz ORBCHFRFVUBRRO-UHFFFAOYSA-N 2 0 354.878 2.598 20 10 FFCDRP CC[C@@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cc(Cl)ccc1O ZINC000925857980 738538290 /nfs/dbraw/zinc/53/82/90/738538290.db2.gz RCVGMZMILWBBCD-UKRRQHHQSA-N 2 0 352.862 2.772 20 10 FFCDRP COC(=O)c1csc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000895608077 735031385 /nfs/dbraw/zinc/03/13/85/735031385.db2.gz HHVNHQAYKZDRRF-UHFFFAOYSA-N 2 0 359.495 2.576 20 10 FFCDRP CC(C)C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C(=O)NCC[NH+](C)C ZINC000756855815 736367344 /nfs/dbraw/zinc/36/73/44/736367344.db2.gz AZNXVBBIDALMAD-BBRMVZONSA-N 2 0 355.910 2.789 20 10 FFCDRP C[NH+]1CCN(c2cc[nH+]cc2NCc2cc(Cl)c(F)cc2O)CC1 ZINC000816559783 742042052 /nfs/dbraw/zinc/04/20/52/742042052.db2.gz UXQUPDSLYCUKQM-UHFFFAOYSA-N 2 0 350.825 2.944 20 10 FFCDRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898621 742221261 /nfs/dbraw/zinc/22/12/61/742221261.db2.gz IEMRKNKZDLOIRA-LSDHHAIUSA-N 2 0 357.445 2.600 20 10 FFCDRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898518 742221288 /nfs/dbraw/zinc/22/12/88/742221288.db2.gz IEMRKNKZDLOIRA-CABCVRRESA-N 2 0 357.445 2.600 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)c1O ZINC000841099872 747268980 /nfs/dbraw/zinc/26/89/80/747268980.db2.gz PTGNWCIPQXVQRW-MAUKXSAKSA-N 2 0 354.878 2.773 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]Cc2ccc(C[NH3+])cc2)c1O ZINC000843127317 747777853 /nfs/dbraw/zinc/77/78/53/747777853.db2.gz FCMLOZXYRKWGHO-UHFFFAOYSA-N 2 0 351.244 2.912 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000854231274 750265654 /nfs/dbraw/zinc/26/56/54/750265654.db2.gz IKBLCSPCIQNDKK-CQSZACIVSA-N 2 0 367.921 2.995 20 10 FFCDRP CC[C@H]([NH2+]CCCN1CCN(c2ccc(OC)cc2)CC1)c1cnn(C)c1 ZINC000162784051 971961738 /nfs/dbraw/zinc/96/17/38/971961738.db2.gz XKWWZOXGEWGUEW-NRFANRHFSA-N 2 0 371.529 2.682 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)c2cccc(C[NH+](C)C)c2)[NH+](C)C)cc1 ZINC000891254091 962611993 /nfs/dbraw/zinc/61/19/93/962611993.db2.gz VNPHEJNPVKXQQY-NRFANRHFSA-N 2 0 368.525 2.847 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3cc(O[C@H]4CCOC4)cc[nH+]3)cc2)CC1 ZINC001167436892 963264050 /nfs/dbraw/zinc/26/40/50/963264050.db2.gz FHROAKCAWMLAEE-FQEVSTJZSA-N 2 0 368.481 2.613 20 10 FFCDRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(-n3cc(C[NH3+])nn3)c2)c(O)c1 ZINC000873242406 1013443012 /nfs/dbraw/zinc/44/30/12/1013443012.db2.gz BGUNUEMKOZJDIY-OAHLLOKOSA-N 2 0 351.454 2.899 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)CC1 ZINC001167964366 965148628 /nfs/dbraw/zinc/14/86/28/965148628.db2.gz PPNJJNBTUJFCPQ-BRTIRZTQSA-N 3 0 368.569 2.933 20 10 FFCDRP COc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)s1 ZINC000877119857 1014480893 /nfs/dbraw/zinc/48/08/93/1014480893.db2.gz BEIJWRYMSOSLOL-UHFFFAOYSA-N 2 0 372.538 2.974 20 10 FFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000877152297 1014491288 /nfs/dbraw/zinc/49/12/88/1014491288.db2.gz KPIKCDRHPTUWMR-UHFFFAOYSA-N 2 0 367.493 2.816 20 10 FFCDRP COc1cc(O)c(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1OC ZINC000904472385 980282421 /nfs/dbraw/zinc/28/24/21/980282421.db2.gz FTEZBKODIKPMSO-IERDGZPVSA-N 2 0 370.449 2.755 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(Br)c1 ZINC001206024981 1032112009 /nfs/dbraw/zinc/11/20/09/1032112009.db2.gz LWBYVGJYWDBUOY-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000879648285 1015623526 /nfs/dbraw/zinc/62/35/26/1015623526.db2.gz IKETWWAAGJMAIB-ZIFCJYIRSA-N 2 0 367.493 2.822 20 10 FFCDRP CN(C)c1ccc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)cc1 ZINC000809731179 994583697 /nfs/dbraw/zinc/58/36/97/994583697.db2.gz DECMIIKQIHTDFM-UHFFFAOYSA-N 2 0 372.557 2.567 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514772 998626194 /nfs/dbraw/zinc/62/61/94/998626194.db2.gz RMTHISFIFDPBTN-NRFANRHFSA-N 2 0 354.450 2.901 20 10 FFCDRP CN(Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873305 1016280243 /nfs/dbraw/zinc/28/02/43/1016280243.db2.gz GQWTVYWQLYXILH-HXUWFJFHSA-N 2 0 368.529 2.825 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)C[NH+]2CCCC2)cc1C ZINC001085421616 999501369 /nfs/dbraw/zinc/50/13/69/999501369.db2.gz NTLUNXVTCXBIKU-RTBURBONSA-N 2 0 359.514 2.616 20 10 FFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000846169862 1000215834 /nfs/dbraw/zinc/21/58/34/1000215834.db2.gz GMTMYWBOBLKBMV-OAHLLOKOSA-N 2 0 359.470 2.977 20 10 FFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1O ZINC000846145182 1000218221 /nfs/dbraw/zinc/21/82/21/1000218221.db2.gz NDVYZJRBOLUGOQ-HQRMLTQVSA-N 2 0 370.493 2.934 20 10 FFCDRP C[N@@H+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465832 1000263618 /nfs/dbraw/zinc/26/36/18/1000263618.db2.gz MHIJMCKXQBVYNB-DYESRHJHSA-N 2 0 368.477 2.772 20 10 FFCDRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccccc3CC[NH3+])c2)CC1 ZINC000846681455 1000407271 /nfs/dbraw/zinc/40/72/71/1000407271.db2.gz HWQUQMRVQKCVOU-UHFFFAOYSA-N 2 0 366.509 2.971 20 10 FFCDRP CC[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CN1C(C)=O ZINC000775720215 1003786577 /nfs/dbraw/zinc/78/65/77/1003786577.db2.gz IRRJOAJGLRUHGR-SFTDATJTSA-N 2 0 372.557 2.660 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@H]([NH+]4CCCC4)C3)cc2)CC1 ZINC000775669473 1005024052 /nfs/dbraw/zinc/02/40/52/1005024052.db2.gz KCHWDKWTVNAPCS-QFIPXVFZSA-N 2 0 356.558 2.889 20 10 FFCDRP C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850411952 1005813573 /nfs/dbraw/zinc/81/35/73/1005813573.db2.gz PETOUHDXXILRKS-AVRDEDQJSA-N 2 0 353.510 2.693 20 10 FFCDRP C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850411953 1005813677 /nfs/dbraw/zinc/81/36/77/1005813677.db2.gz PETOUHDXXILRKS-GCJKJVERSA-N 2 0 353.510 2.693 20 10 FFCDRP CC(C)N(C)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000883283857 1006730553 /nfs/dbraw/zinc/73/05/53/1006730553.db2.gz VRQSCRMJPDUBJC-UHFFFAOYSA-N 2 0 367.541 2.968 20 10 FFCDRP CC[C@@H](NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817916273 1007809044 /nfs/dbraw/zinc/80/90/44/1007809044.db2.gz DNYBJRLQOGSYTN-YADHBBJMSA-N 2 0 356.558 2.839 20 10 FFCDRP C[C@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000817972021 1007835595 /nfs/dbraw/zinc/83/55/95/1007835595.db2.gz JGHLGJCABLZYHA-UGSOOPFHSA-N 2 0 371.447 2.758 20 10 FFCDRP C[C@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000817972020 1007835788 /nfs/dbraw/zinc/83/57/88/1007835788.db2.gz JGHLGJCABLZYHA-SCLBCKFNSA-N 2 0 371.447 2.758 20 10 FFCDRP COC(=O)[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779431773 1023843334 /nfs/dbraw/zinc/84/33/34/1023843334.db2.gz DQYYZINGBRURDW-PZJWPPBQSA-N 2 0 359.514 2.650 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cc(C)[nH+]c(C)c3)CC2)cc1 ZINC001164334690 1029249750 /nfs/dbraw/zinc/24/97/50/1029249750.db2.gz XPAHNLLNRVKYCQ-UHFFFAOYSA-N 2 0 354.498 2.753 20 10 FFCDRP C[NH+]1CCC(COC[C@H]2CC[C@@H]3[C@@H](CC[N@@H+]3Cc3ccccc3O)O2)CC1 ZINC001203552161 1030759573 /nfs/dbraw/zinc/75/95/73/1030759573.db2.gz CMULTUUKRNJXRM-KCZVDYSFSA-N 2 0 374.525 2.873 20 10 FFCDRP COc1ccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001203623418 1030791082 /nfs/dbraw/zinc/79/10/82/1030791082.db2.gz QBTIQNGFFVIKQR-WIYYLYMNSA-N 2 0 360.498 2.581 20 10 FFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205579653 1031847917 /nfs/dbraw/zinc/84/79/17/1031847917.db2.gz PPVDWNRICKNGCI-SFHVURJKSA-N 2 0 355.885 2.830 20 10 FFCDRP O=C(Nc1cccc(N2CC[NH2+]CC2)c1)c1cccc([C@H]2CCC[NH2+]2)c1 ZINC001219119534 1033523494 /nfs/dbraw/zinc/52/34/94/1033523494.db2.gz AWZDJLPRHPOQNM-HXUWFJFHSA-N 2 0 350.466 2.773 20 10 FFCDRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3cccc(C[NH3+])c3)c2)CC1 ZINC000831490459 1034102459 /nfs/dbraw/zinc/10/24/59/1034102459.db2.gz KIWIJMISJCPDOV-UHFFFAOYSA-N 2 0 352.482 2.928 20 10 FFCDRP COc1cc(C[NH+]2CCC(c3nnc(C)o3)CC2)cc(C[NH+](C)C)c1O ZINC001139259097 1035031507 /nfs/dbraw/zinc/03/15/07/1035031507.db2.gz HYKPVOXLVQEEGT-UHFFFAOYSA-N 2 0 360.458 2.533 20 10 FFCDRP CCc1nnc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)o1 ZINC001139411991 1035097360 /nfs/dbraw/zinc/09/73/60/1035097360.db2.gz APEZEWZMUQPCEO-UHFFFAOYSA-N 2 0 369.513 2.763 20 10 FFCDRP Cc1ccc(C)c(C[N@@H+]2CCCn3cnc(COCC[NH+](C)C)c3C2)c1O ZINC001140178875 1035369855 /nfs/dbraw/zinc/36/98/55/1035369855.db2.gz AVYSYLIQQMOQMD-UHFFFAOYSA-N 2 0 372.513 2.690 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](C(=O)OC)CC[C@H]3C)cc2)CC1 ZINC001140304073 1035426366 /nfs/dbraw/zinc/42/63/66/1035426366.db2.gz HEPGLZLGFQWBIL-MJGOQNOKSA-N 2 0 359.514 2.602 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](Oc4ccncc4)C3)cc2)CC1 ZINC001140306235 1035427525 /nfs/dbraw/zinc/42/75/25/1035427525.db2.gz QAFNQJZPHRJTQY-JOCHJYFZSA-N 2 0 366.509 2.877 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000835035730 1035491016 /nfs/dbraw/zinc/49/10/16/1035491016.db2.gz KIEXHTOPGGPTIL-SNAWJCMRSA-N 2 0 365.525 2.702 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3cc(F)cc(Cl)c3[O-])C[C@@H]1CC[NH2+]CC2 ZINC001235349473 1037494932 /nfs/dbraw/zinc/49/49/32/1037494932.db2.gz POPMGUJIHNBYSO-UGSOOPFHSA-N 2 0 370.852 2.549 20 10 FFCDRP Fc1ccccc1CN1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235693693 1037690866 /nfs/dbraw/zinc/69/08/66/1037690866.db2.gz ZJFIILBWSWBTMF-UHFFFAOYSA-N 2 0 368.500 2.553 20 10 FFCDRP COc1cc(O)c(C[N@H+](C)CCC2CC[NH2+]CC2)c(Br)c1 ZINC001235717847 1037707526 /nfs/dbraw/zinc/70/75/26/1037707526.db2.gz NPHFEOMPAGPKQC-UHFFFAOYSA-N 2 0 357.292 2.985 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+][C@H](c4ccccc4)C3)c(F)c2)CC1 ZINC001235857496 1037797269 /nfs/dbraw/zinc/79/72/69/1037797269.db2.gz USUDJHCENKJREO-QFIPXVFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Cc1cc(C)c(C[N@H+]2CCc3nnc(CN4CCCCC4)n3CC2)c(O)c1 ZINC001231843839 1037940942 /nfs/dbraw/zinc/94/09/42/1037940942.db2.gz BRQLGLMPUBQCCL-UHFFFAOYSA-N 2 0 369.513 2.645 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[C@@H]([NH+]4CCCCC4)C3)c(F)c2)CC1 ZINC001236939697 1038368445 /nfs/dbraw/zinc/36/84/45/1038368445.db2.gz UERCQSBOORVXFL-HXUWFJFHSA-N 2 0 360.521 2.638 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](COCC4CC4)C3)c(F)c2)CC1 ZINC001236943149 1038370470 /nfs/dbraw/zinc/37/04/70/1038370470.db2.gz QAPUYRQGMCIOSS-GOSISDBHSA-N 2 0 361.505 2.826 20 10 FFCDRP CNC(=O)CN1CCCC12CC[NH+](Cc1ccc(C(C)C)cc1O)CC2 ZINC001237051541 1038424002 /nfs/dbraw/zinc/42/40/02/1038424002.db2.gz MUFDHJDVTUPITN-UHFFFAOYSA-N 2 0 359.514 2.692 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN(C3CCC3)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155896 1038456615 /nfs/dbraw/zinc/45/66/15/1038456615.db2.gz USTAPJDURWXXFU-JOCHJYFZSA-N 2 0 356.558 2.935 20 10 FFCDRP CCc1ccc(C[NH+]2CCC3(C[NH+](CCn4ccnc4)C3)CC2)c(O)c1 ZINC001279663854 1043425411 /nfs/dbraw/zinc/42/54/11/1043425411.db2.gz IAPUSDLZAHSAQY-UHFFFAOYSA-N 2 0 354.498 2.749 20 10 FFCDRP CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001318526761 1044730536 /nfs/dbraw/zinc/73/05/36/1044730536.db2.gz KHWMHLCWUYMWGN-CEXWTWQISA-N 2 0 361.530 2.718 20 10 FFCDRP CCOc1ccc(N2CC[NH+](CCCN3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC001325184200 1046407911 /nfs/dbraw/zinc/40/79/11/1046407911.db2.gz JPGOQYOMCRBSRW-UHFFFAOYSA-N 2 0 374.573 2.623 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1O ZINC001308583661 1052473059 /nfs/dbraw/zinc/47/30/59/1052473059.db2.gz MPHLQXMRPFVYEX-ROUUACIJSA-N 2 0 361.530 2.700 20 10 FFCDRP CCc1cccc(C[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c1O ZINC000848897277 1055323073 /nfs/dbraw/zinc/32/30/73/1055323073.db2.gz HRAKUPQOLOXROI-UHFFFAOYSA-N 2 0 361.530 2.671 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cc2)CC1 ZINC000849350573 1056835448 /nfs/dbraw/zinc/83/54/48/1056835448.db2.gz QUEKZBDACKIILZ-NRFANRHFSA-N 3 0 356.558 2.650 20 10 FFCDRP CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722860 1076063318 /nfs/dbraw/zinc/06/33/18/1076063318.db2.gz DFEIEGXJVXGLSG-UYAOXDASSA-N 2 0 360.546 2.594 20 10 FFCDRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155687345 509052968 /nfs/dbraw/zinc/05/29/68/509052968.db2.gz GGYBREJOEJLVPI-XJKSGUPXSA-N 2 0 370.335 2.831 20 10 FFCDRP OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297592588 511000599 /nfs/dbraw/zinc/00/05/99/511000599.db2.gz HQQNLENNUUCNLM-ZCNNSNEGSA-N 2 0 352.478 2.852 20 10 FFCDRP Cc1cc(Br)cc(C[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c1O ZINC000282522494 511012312 /nfs/dbraw/zinc/01/23/12/511012312.db2.gz ZSDMTGSSZSQPAT-UHFFFAOYSA-N 2 0 370.335 2.579 20 10 FFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000858174737 730418715 /nfs/dbraw/zinc/41/87/15/730418715.db2.gz WMGJIDZOOUWSKA-UHFFFAOYSA-N 2 0 370.335 2.660 20 10 FFCDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Br)ccc1O ZINC000756408298 736328604 /nfs/dbraw/zinc/32/86/04/736328604.db2.gz MDVYVCQUKAKZBK-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP C[NH+](C)CCCCC(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000771057400 737689975 /nfs/dbraw/zinc/68/99/75/737689975.db2.gz IYELTURJEIPCJU-KRWDZBQOSA-N 2 0 367.921 2.858 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCO[C@@]4(CCSC4)C3)cc2)CC1 ZINC000771846931 737760825 /nfs/dbraw/zinc/76/08/25/737760825.db2.gz NXDNZAUWVVXIMH-ICSRJNTNSA-N 2 0 361.555 2.583 20 10 FFCDRP COCC1(C[NH2+][C@H](C)c2ccc(Br)cc2O)CC[NH2+]CC1 ZINC000817975033 742225886 /nfs/dbraw/zinc/22/58/86/742225886.db2.gz QBUAXKGVKONERM-GFCCVEGCSA-N 2 0 357.292 2.822 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]Cc2ccc(CC[NH3+])cc2)c1O ZINC000841032741 747259210 /nfs/dbraw/zinc/25/92/10/747259210.db2.gz WGFJYCGGLWDHTF-UHFFFAOYSA-N 2 0 365.271 2.954 20 10 FFCDRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3cc(Br)ccc3O)CC2)C1 ZINC000841104145 747270138 /nfs/dbraw/zinc/27/01/38/747270138.db2.gz OIRDJZAWGGWMHF-WBVHZDCISA-N 2 0 369.303 2.873 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3cc4c(cc3[N+](=O)[O-])C[NH2+]C4)cc2)CC1 ZINC001167434892 963186964 /nfs/dbraw/zinc/18/69/64/963186964.db2.gz YGMOWBKQWPNSMM-UHFFFAOYSA-N 2 0 367.453 2.562 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1O ZINC000895248586 968750739 /nfs/dbraw/zinc/75/07/39/968750739.db2.gz ONXZLQIPJUQZAM-IBGZPJMESA-N 2 0 356.466 2.566 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895558226 970741610 /nfs/dbraw/zinc/74/16/10/970741610.db2.gz UGEAQJNPVPOZSQ-SFHVURJKSA-N 2 0 366.509 2.753 20 10 FFCDRP CN(C(=O)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000905426723 980438566 /nfs/dbraw/zinc/43/85/66/980438566.db2.gz IJUGPEOIXHVURK-UHFFFAOYSA-N 2 0 366.509 2.581 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cc1Br ZINC001206011582 1032107967 /nfs/dbraw/zinc/10/79/67/1032107967.db2.gz FAUTZOWZIXJFMR-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4ccccc4CC[C@H]3O)cc2)CC1 ZINC000922991236 990782867 /nfs/dbraw/zinc/78/28/67/990782867.db2.gz VXJACLGBARJSIN-YADHBBJMSA-N 2 0 351.494 2.576 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(CO)C[C@H]3c3ccccc3)cc2)CC1 ZINC000810165261 994715542 /nfs/dbraw/zinc/71/55/42/994715542.db2.gz NCYZHGXCACNDJR-XZOQPEGZSA-N 2 0 365.521 2.694 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(O)ccc4C3)cc2)CC1 ZINC000767727519 1000138936 /nfs/dbraw/zinc/13/89/36/1000138936.db2.gz JKHRPQTYBRZWIR-HXUWFJFHSA-N 2 0 351.494 2.791 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@](C)(O)c1ccccc1 ZINC000846036471 1000196382 /nfs/dbraw/zinc/19/63/82/1000196382.db2.gz JSTXPCZJNVHALT-XMSQKQJNSA-N 2 0 353.510 2.824 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000846169860 1000215613 /nfs/dbraw/zinc/21/56/13/1000215613.db2.gz GMTMYWBOBLKBMV-HNNXBMFYSA-N 2 0 359.470 2.977 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CC[C@H]1N1CC[NH+](C)CC1 ZINC000768465731 1000263651 /nfs/dbraw/zinc/26/36/51/1000263651.db2.gz RLNXPYWOWKHKCA-DYESRHJHSA-N 2 0 357.542 2.729 20 10 FFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CC)C(=O)OCC ZINC000792188418 1002939078 /nfs/dbraw/zinc/93/90/78/1002939078.db2.gz ONWXHGPFNLZASP-FQEVSTJZSA-N 2 0 361.530 2.992 20 10 FFCDRP CC(=O)Nc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000794173006 1003576828 /nfs/dbraw/zinc/57/68/28/1003576828.db2.gz TUNIKOLHWVLXAK-UHFFFAOYSA-N 2 0 352.482 2.687 20 10 FFCDRP CCCCNC(=O)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775651000 1004946981 /nfs/dbraw/zinc/94/69/81/1004946981.db2.gz JLXRFSDXHKWDLG-UHFFFAOYSA-N 2 0 372.557 2.567 20 10 FFCDRP CCCCNC(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667295 1005011270 /nfs/dbraw/zinc/01/12/70/1005011270.db2.gz HXRLDUBPLNNHCW-FQEVSTJZSA-N 2 0 372.557 2.567 20 10 FFCDRP CCOc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850357401 1005810650 /nfs/dbraw/zinc/81/06/50/1005810650.db2.gz IMIAPLGRRACHLQ-IBGZPJMESA-N 2 0 356.466 2.647 20 10 FFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(C(=O)CCC[NH2+]C)CC2)cc1 ZINC000854232614 1006734349 /nfs/dbraw/zinc/73/43/49/1006734349.db2.gz VMNPVGGOFMEWOE-QGZVFWFLSA-N 2 0 360.546 2.784 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000854231630 1006734828 /nfs/dbraw/zinc/73/48/28/1006734828.db2.gz NBENYDGZGOLZLN-XJKSGUPXSA-N 2 0 363.477 2.660 20 10 FFCDRP COc1cccc(O)c1C[NH2+]CCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000883342610 1006757328 /nfs/dbraw/zinc/75/73/28/1006757328.db2.gz FTPBCAJBNAFEQK-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817916881 1007808530 /nfs/dbraw/zinc/80/85/30/1007808530.db2.gz MDLJQXYIKJTCMR-RBBKRZOGSA-N 3 0 356.558 2.826 20 10 FFCDRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918327 1007810326 /nfs/dbraw/zinc/81/03/26/1007810326.db2.gz YRSHSKREEJTCKF-VXKWHMMOSA-N 3 0 356.558 2.968 20 10 FFCDRP COc1ccc([C@H](NC[C@H]([NH3+])c2ccc(N(C)C)cc2)[C@H]2CCC[NH2+]2)cc1 ZINC000817942298 1007821347 /nfs/dbraw/zinc/82/13/47/1007821347.db2.gz NVJSTUJWUXBODW-BDTNDASRSA-N 2 0 368.525 2.844 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCCC[C@@]3(CCCC[NH2+]C3)C1)C[NH2+]CCO2 ZINC001222173940 1032802181 /nfs/dbraw/zinc/80/21/81/1032802181.db2.gz ZUVLMZYZMVSAGN-OAQYLSRUSA-N 3 0 359.514 2.620 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272434 1032861470 /nfs/dbraw/zinc/86/14/70/1032861470.db2.gz UFNCIZXAKIKHST-QFIPXVFZSA-N 3 0 356.558 2.794 20 10 FFCDRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(F)ccc1O ZINC000756537295 1023723714 /nfs/dbraw/zinc/72/37/14/1023723714.db2.gz YDHVGTFMTURFOC-INIZCTEOSA-N 2 0 373.476 2.574 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ccncn4)CC3)cc2)CC1 ZINC000840953184 1029941135 /nfs/dbraw/zinc/94/11/35/1029941135.db2.gz HVLITYXNWFJRAX-UHFFFAOYSA-N 2 0 351.498 2.608 20 10 FFCDRP COc1ccc(O)c(CN2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821354 /nfs/dbraw/zinc/82/13/54/1030821354.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 0 360.498 2.724 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000843058449 1031165683 /nfs/dbraw/zinc/16/56/83/1031165683.db2.gz SLJCAKOKHUPWLK-FPOVZHCZSA-N 2 0 372.557 2.613 20 10 FFCDRP Fc1ccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1F ZINC001204878023 1031459504 /nfs/dbraw/zinc/45/95/04/1031459504.db2.gz UBXFRWRNZXEOOM-UHFFFAOYSA-N 2 0 372.463 2.697 20 10 FFCDRP Nc1ccc(N(Cc2ccccc2)C(=O)[C@H]2CCC3(CC[NH2+]CC3)[NH2+]2)cc1 ZINC001218955447 1033426937 /nfs/dbraw/zinc/42/69/37/1033426937.db2.gz LHPYOVLZPLGKCN-HXUWFJFHSA-N 2 0 364.493 2.676 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139260311 1035031516 /nfs/dbraw/zinc/03/15/16/1035031516.db2.gz KZGRAVJONOQQHC-IBGZPJMESA-N 2 0 371.481 2.901 20 10 FFCDRP CCc1nc(C2CC[NH+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)CC2)no1 ZINC001139259064 1035031636 /nfs/dbraw/zinc/03/16/36/1035031636.db2.gz GUUNULATUIDQIT-UHFFFAOYSA-N 2 0 374.485 2.787 20 10 FFCDRP CCN(CC)C(=O)[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139404472 1035091211 /nfs/dbraw/zinc/09/12/11/1035091211.db2.gz IVTIKBQOHMPVLX-HXUWFJFHSA-N 2 0 372.557 2.519 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCc4cc(O)c(O)cc4C3)cc2)CC1 ZINC001139411028 1035095836 /nfs/dbraw/zinc/09/58/36/1035095836.db2.gz QYKWELLJTYXORK-UHFFFAOYSA-N 2 0 367.493 2.798 20 10 FFCDRP C[NH+]1CCC(C[NH+]2CCN(Cc3ccc(C(F)(F)F)cc3O)CC2)CC1 ZINC001233455390 1036634937 /nfs/dbraw/zinc/63/49/37/1036634937.db2.gz ITGKFRNIIIHKAD-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCCC[NH2+]4)CC3)cc2)CC1 ZINC001235229161 1037424916 /nfs/dbraw/zinc/42/49/16/1037424916.db2.gz OOHWTQRGCDCUPK-JOCHJYFZSA-N 3 0 356.558 2.793 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C4CC[NH2+]CC4)CC3)c(F)c2)CC1 ZINC001235701602 1037698898 /nfs/dbraw/zinc/69/88/98/1037698898.db2.gz DVBOQLHCASWFFF-UHFFFAOYSA-N 3 0 374.548 2.789 20 10 FFCDRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]1C2 ZINC001236028040 1037892510 /nfs/dbraw/zinc/89/25/10/1037892510.db2.gz AQVQXBWPTIQENL-IRMTXWDGSA-N 2 0 372.509 2.520 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC[C@H](N3CC(C[NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236081145 1037922372 /nfs/dbraw/zinc/92/23/72/1037922372.db2.gz YZVSDYYFKCFJJW-QFIPXVFZSA-N 2 0 352.526 2.949 20 10 FFCDRP CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236092969 1037931485 /nfs/dbraw/zinc/93/14/85/1037931485.db2.gz CBUNROOGPAESFL-IBGZPJMESA-N 2 0 359.514 2.792 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3cccs3)c(F)c2)CC1 ZINC001236117691 1037937842 /nfs/dbraw/zinc/93/78/42/1037937842.db2.gz XRXNTRJGGQGXHR-LJQANCHMSA-N 2 0 374.529 2.786 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccc(F)cc3)cc2)CC1 ZINC001236125022 1037942040 /nfs/dbraw/zinc/94/20/40/1037942040.db2.gz JEPRIEUDUWTMLB-JOCHJYFZSA-N 2 0 368.500 2.724 20 10 FFCDRP CC[N@H+](CCc1ccc(OC)cc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236302946 1038032405 /nfs/dbraw/zinc/03/24/05/1038032405.db2.gz ITWBYMXBJYUGAE-UHFFFAOYSA-N 2 0 356.466 2.947 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001236433428 1038086601 /nfs/dbraw/zinc/08/66/01/1038086601.db2.gz ICHJUJPIZKYQFO-FQEVSTJZSA-N 2 0 359.514 2.583 20 10 FFCDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175060 1039266342 /nfs/dbraw/zinc/26/63/42/1039266342.db2.gz RXFWBGORYRWSBZ-MRXNPFEDSA-N 2 0 354.454 2.725 20 10 FFCDRP FC(F)(F)Oc1ccc(N2CC[NH+]([C@H]3CCC4(C[NH2+]C4)C3)CC2)cc1 ZINC001246993409 1039567659 /nfs/dbraw/zinc/56/76/59/1039567659.db2.gz HFJROJOTCBGFIB-HNNXBMFYSA-N 2 0 355.404 2.849 20 10 FFCDRP CCC[N@H+](C)CCC(=O)N1C[C@@H](C)[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1 ZINC001216506668 1042044042 /nfs/dbraw/zinc/04/40/42/1042044042.db2.gz LUUUWBXJZXMGRH-IEBWSBKVSA-N 2 0 361.530 2.672 20 10 FFCDRP C[C@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC[N@@H+]1C1CCCCC1 ZINC001237250292 1043075290 /nfs/dbraw/zinc/07/52/90/1043075290.db2.gz URLKSTJCLFRCSP-INIZCTEOSA-N 2 0 359.514 2.713 20 10 FFCDRP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@H+](Cc1cc(Cl)c(O)cc1O)C2 ZINC001279573753 1043280068 /nfs/dbraw/zinc/28/00/68/1043280068.db2.gz YVTMXRPSYPVXPP-LJQANCHMSA-N 2 0 367.921 2.601 20 10 FFCDRP C[NH+](C)CCN1CC[NH+](Cc2cc(-c3ccc(F)cc3)ccc2O)CC1 ZINC001237641267 1043289095 /nfs/dbraw/zinc/28/90/95/1043289095.db2.gz QHBYGLYHKLWFLF-UHFFFAOYSA-N 2 0 357.473 2.878 20 10 FFCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1cc(O)c(Br)cc1O)CC2 ZINC001279663451 1043423761 /nfs/dbraw/zinc/42/37/61/1043423761.db2.gz QCXKFOXLYQAXMF-UHFFFAOYSA-N 2 0 355.276 2.778 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]CCCCC[NH+]3CCCC3)cc2F)CC1 ZINC001324223584 1045925026 /nfs/dbraw/zinc/92/50/26/1045925026.db2.gz WHUUQSKSMGQFHC-UHFFFAOYSA-N 2 0 362.537 2.933 20 10 FFCDRP CN(C)c1cc(F)c(C[NH2+]C(C)(C)CCN2CC[NH+](C)CC2)cc1F ZINC001329155815 1048598826 /nfs/dbraw/zinc/59/88/26/1048598826.db2.gz HDRNPNPMVFKXHW-UHFFFAOYSA-N 2 0 354.489 2.537 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@H]2C1 ZINC001333890610 1049158868 /nfs/dbraw/zinc/15/88/68/1049158868.db2.gz FGCAMXYRLNGRDJ-QKNQBKEWSA-N 2 0 357.542 2.810 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@@H]2C1 ZINC001333890612 1049159062 /nfs/dbraw/zinc/15/90/62/1049159062.db2.gz FGCAMXYRLNGRDJ-SVFBPWRDSA-N 2 0 357.542 2.810 20 10 FFCDRP CN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1F ZINC001308366436 1052450770 /nfs/dbraw/zinc/45/07/70/1052450770.db2.gz MNOPEGXKRSCVDM-IBGZPJMESA-N 2 0 357.473 2.748 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1O ZINC001308583646 1052473131 /nfs/dbraw/zinc/47/31/31/1052473131.db2.gz MPHLQXMRPFVYEX-HDICACEKSA-N 2 0 361.530 2.700 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@H](C)C1 ZINC001334956361 1053165128 /nfs/dbraw/zinc/16/51/28/1053165128.db2.gz PGWCRUSPMBWRAF-NVXWUHKLSA-N 2 0 366.502 2.636 20 10 FFCDRP [NH3+][C@@H](CC[NH2+]Cc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1 ZINC001580127145 1078752615 /nfs/dbraw/zinc/75/26/15/1078752615.db2.gz HLIBKIJUQFNQQW-IBGZPJMESA-N 2 0 357.473 2.712 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc4c(c3)OCCO4)cc2)CC1 ZINC001560255626 1076257036 /nfs/dbraw/zinc/25/70/36/1076257036.db2.gz ARFCOQRGUOFIAT-UHFFFAOYSA-N 2 0 367.493 2.542 20 10 FFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000166057363 509594601 /nfs/dbraw/zinc/59/46/01/509594601.db2.gz AMILYSQKGNWWFL-FUHWJXTLSA-N 2 0 367.509 2.670 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(Br)cc2O)CC1 ZINC000185014163 510634526 /nfs/dbraw/zinc/63/45/26/510634526.db2.gz HPTVUEJSVDURRF-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cc(Br)ccc2O)CC1 ZINC000185013628 510634676 /nfs/dbraw/zinc/63/46/76/510634676.db2.gz HSFMLJHUNQNSLR-CQSZACIVSA-N 2 0 370.335 2.833 20 10 FFCDRP CCOc1cccc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000288705774 511083118 /nfs/dbraw/zinc/08/31/18/511083118.db2.gz YWANPVPANLTKNK-UHFFFAOYSA-N 2 0 359.470 2.806 20 10 FFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000279814131 511225372 /nfs/dbraw/zinc/22/53/72/511225372.db2.gz FPMXTFWJZXEDSR-OAHLLOKOSA-N 2 0 372.479 2.887 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN[C@@H](C)c3cc(C)n(C)n3)cc2F)CC1 ZINC000282127129 512083043 /nfs/dbraw/zinc/08/30/43/512083043.db2.gz JVEWJHFPWXOUDD-INIZCTEOSA-N 2 0 359.493 2.860 20 10 FFCDRP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)CC[NH+](C)C)C1 ZINC000444245530 514165874 /nfs/dbraw/zinc/16/58/74/514165874.db2.gz XPIMQFLQMCAZIG-QGZVFWFLSA-N 2 0 370.541 2.864 20 10 FFCDRP COCC[N@@H+](Cc1cccc(Br)c1[O-])CC1CC[NH+](C)CC1 ZINC000877665234 732408729 /nfs/dbraw/zinc/40/87/29/732408729.db2.gz NHIYSNVEAPDKPE-UHFFFAOYSA-N 2 0 371.319 2.945 20 10 FFCDRP COc1ccc(C[NH2+]CC2(SC)CC[NH+](C)CC2)cc1Cn1cccn1 ZINC000873127768 1013396222 /nfs/dbraw/zinc/39/62/22/1013396222.db2.gz VGZWWGXXUSCKOA-UHFFFAOYSA-N 2 0 374.554 2.857 20 10 FFCDRP Cc1cccc(O)c1C[NH+]1CCC(C(=O)NCCC[NH+]2CCCC2)CC1 ZINC000877522678 1014611204 /nfs/dbraw/zinc/61/12/04/1014611204.db2.gz RWFBOKHZEZWHGQ-UHFFFAOYSA-N 2 0 359.514 2.515 20 10 FFCDRP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729683852 981288756 /nfs/dbraw/zinc/28/87/56/981288756.db2.gz CZGJPPKYLKUJBT-LJQANCHMSA-N 2 0 367.493 2.736 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@H](C(F)(F)F)O1 ZINC000877824058 1014744025 /nfs/dbraw/zinc/74/40/25/1014744025.db2.gz ONVKVJNICKYFIE-YJBOKZPZSA-N 2 0 371.447 2.980 20 10 FFCDRP COc1ccc(Br)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1O ZINC001206011267 1032107612 /nfs/dbraw/zinc/10/76/12/1032107612.db2.gz BDDIDKWUPGYLKO-RYUDHWBXSA-N 2 0 357.292 2.970 20 10 FFCDRP [NH3+]CC[C@@H]1CN(c2cccc3c2NC(=O)C32CC[NH2+]CC2)c2ccccc21 ZINC001168548435 985230863 /nfs/dbraw/zinc/23/08/63/985230863.db2.gz NRRRTWPFLWYTCT-OAHLLOKOSA-N 2 0 362.477 2.844 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000765795384 985853838 /nfs/dbraw/zinc/85/38/38/985853838.db2.gz CCPZFBYICSNTBH-AZUAARDMSA-N 2 0 372.557 2.915 20 10 FFCDRP Cc1ccc(CN(CC[NH+](C)C)Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000809735868 994597714 /nfs/dbraw/zinc/59/77/14/994597714.db2.gz WLQMQVZVOXOGNG-UHFFFAOYSA-N 2 0 370.541 2.904 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CN(C(=O)C34CCC[NH+]3CCC4)C[C@H]2C)cc1C ZINC001082617084 995081174 /nfs/dbraw/zinc/08/11/74/995081174.db2.gz SCGFXWGRJHVMMS-IEBWSBKVSA-N 2 0 371.525 2.569 20 10 FFCDRP CC[NH+]1CCC(N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001169233798 1000032378 /nfs/dbraw/zinc/03/23/78/1000032378.db2.gz UTBNTMBIFQIBGH-NHCUHLMSSA-N 2 0 355.482 2.913 20 10 FFCDRP COCOc1cnc(N2CCCc3ccc(C[NH3+])nc32)cc1/C=C/[NH+](C)C ZINC001169590849 1000060276 /nfs/dbraw/zinc/06/02/76/1000060276.db2.gz QKFRIEQLRXFLJJ-CSKARUKUSA-N 2 0 369.469 2.535 20 10 FFCDRP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444972 1000251203 /nfs/dbraw/zinc/25/12/03/1000251203.db2.gz DHVVIRPBRDVUSS-NRFANRHFSA-N 2 0 357.542 2.873 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000771832947 1001210463 /nfs/dbraw/zinc/21/04/63/1001210463.db2.gz POOHMJGTPNJTFZ-UHFFFAOYSA-N 2 0 354.454 2.679 20 10 FFCDRP [NH3+]CC1CC[NH+](Cc2ccc(NCC(=O)c3ccc(O)c(O)c3)cc2)CC1 ZINC001170322954 1003109634 /nfs/dbraw/zinc/10/96/34/1003109634.db2.gz PPGPWEIZMIXNRH-UHFFFAOYSA-N 2 0 369.465 2.563 20 10 FFCDRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792917193 1003230950 /nfs/dbraw/zinc/23/09/50/1003230950.db2.gz CZNZKCXPFDDFCX-HNNXBMFYSA-N 2 0 372.479 2.887 20 10 FFCDRP COC(=O)c1ccc2c(c1)CN(Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000775685626 1003666644 /nfs/dbraw/zinc/66/66/44/1003666644.db2.gz RECBKEFMTRSPDT-UHFFFAOYSA-N 2 0 365.477 2.741 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCO)[C@H]3CCc4ccccc43)cc2)CC1 ZINC000775697267 1003704631 /nfs/dbraw/zinc/70/46/31/1003704631.db2.gz XZNFZRSMOZDOGO-QHCPKHFHSA-N 2 0 365.521 2.920 20 10 FFCDRP Cc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)n1C ZINC000850234259 1005797512 /nfs/dbraw/zinc/79/75/12/1005797512.db2.gz CRTSZZZVYCAABB-UHFFFAOYSA-N 2 0 353.514 2.550 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3noc4ccccc43)cc2)CC1 ZINC000850342264 1005808662 /nfs/dbraw/zinc/80/86/62/1005808662.db2.gz JNSUDQRVGPYHOY-UHFFFAOYSA-N 2 0 350.466 2.912 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCn4nccc43)cc2F)CC1 ZINC000850432600 1005815488 /nfs/dbraw/zinc/81/54/88/1005815488.db2.gz CHPOSGQXGNYFRV-SFHVURJKSA-N 2 0 357.477 2.789 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]C2CCN(C(=O)CCC[NH2+]C)CC2)cc1 ZINC000853247426 1006349244 /nfs/dbraw/zinc/34/92/44/1006349244.db2.gz PDCIBZAFWPGXGH-UHFFFAOYSA-N 2 0 360.546 2.613 20 10 FFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc4c(cc3O)CCC4)CC2)CC1 ZINC000817374627 1007568328 /nfs/dbraw/zinc/56/83/28/1007568328.db2.gz XZKPMXLFSVZKIT-UHFFFAOYSA-N 2 0 357.542 2.873 20 10 FFCDRP CCCOc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC001177312324 1008557540 /nfs/dbraw/zinc/55/75/40/1008557540.db2.gz NEZUAEPJMWBZQR-UHFFFAOYSA-N 2 0 354.498 2.912 20 10 FFCDRP C[NH+]1CCC(n2cc(NCc3ccc(N4CC[NH+](C)CC4)cc3)cn2)CC1 ZINC000865704613 1010845559 /nfs/dbraw/zinc/84/55/59/1010845559.db2.gz WMDAYRBMEAFKIG-UHFFFAOYSA-N 2 0 368.529 2.514 20 10 FFCDRP COc1cc(CN2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c(O)c(C(C)(C)C)c1 ZINC000827698698 1018618837 /nfs/dbraw/zinc/61/88/37/1018618837.db2.gz AXZILOJZUJYIAW-QGZVFWFLSA-N 2 0 362.514 2.729 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)c1 ZINC001116564934 1021286664 /nfs/dbraw/zinc/28/66/64/1021286664.db2.gz BMZSWVLAAJOWPD-KRWDZBQOSA-N 2 0 369.509 2.999 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3ccccc3CC[NH3+])CC2)cc1 ZINC001164334356 1029250268 /nfs/dbraw/zinc/25/02/68/1029250268.db2.gz PCJOBHFDMIPDAI-UHFFFAOYSA-N 2 0 368.525 2.821 20 10 FFCDRP [NH3+]Cc1cc(N2CC3(CC[NH2+]CC3)c3c2cccc3-c2cccnc2)ncn1 ZINC001166127534 1030266821 /nfs/dbraw/zinc/26/68/21/1030266821.db2.gz NTWHLGYDFZVZKO-UHFFFAOYSA-N 2 0 372.476 2.770 20 10 FFCDRP CCOC(=O)[C@@H]1CCC[N@@H+](C2CCN(Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001203931044 1030989789 /nfs/dbraw/zinc/98/97/89/1030989789.db2.gz MJLXPJQKVZGSBP-LJQANCHMSA-N 2 0 373.541 2.992 20 10 FFCDRP CN1CCCc2cc(CN3CC[NH+](CC4CC[NH+](C)CC4)CC3)ccc21 ZINC001138359304 1034197818 /nfs/dbraw/zinc/19/78/18/1034197818.db2.gz QMVIGCKWLBCXOS-UHFFFAOYSA-N 2 0 356.558 2.528 20 10 FFCDRP COc1cc(C[NH+]2CCC(Oc3cccnc3)CC2)cc(C[NH+](C)C)c1O ZINC001139256718 1035030553 /nfs/dbraw/zinc/03/05/53/1035030553.db2.gz ICMNGLCODKOAMA-UHFFFAOYSA-N 2 0 371.481 2.901 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139257104 1035030678 /nfs/dbraw/zinc/03/06/78/1035030678.db2.gz RMSJKBAFHJASKP-SFHVURJKSA-N 2 0 357.454 2.511 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1c1ccccc1 ZINC001139409603 1035094099 /nfs/dbraw/zinc/09/40/99/1035094099.db2.gz MYZRARGHCDTYLI-HSZRJFAPSA-N 2 0 364.537 2.927 20 10 FFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@H]1Cc2ccccc2O1 ZINC001139411309 1035095680 /nfs/dbraw/zinc/09/56/80/1035095680.db2.gz FPIQBXADDPOVJN-OAQYLSRUSA-N 2 0 351.494 2.874 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001139411489 1035095931 /nfs/dbraw/zinc/09/59/31/1035095931.db2.gz ORZHUTCLVBGRTM-ICSRJNTNSA-N 2 0 373.541 2.850 20 10 FFCDRP Cc1cc(C[N@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)ccc1N(C)C ZINC001139669911 1035193289 /nfs/dbraw/zinc/19/32/89/1035193289.db2.gz DDWYTLQOMGGSQO-UHFFFAOYSA-N 2 0 367.541 2.912 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CCC([NH+]4CCCC4)CC3)cc2)CC1 ZINC001140300084 1035423740 /nfs/dbraw/zinc/42/37/40/1035423740.db2.gz LWAWJSQPALBEMK-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(C(C)(C)C(N)=O)CC3)cc2)CC1 ZINC001140304262 1035426419 /nfs/dbraw/zinc/42/64/19/1035426419.db2.gz LCXUJCQCYKXHDZ-UHFFFAOYSA-N 2 0 372.557 2.552 20 10 FFCDRP C[C@H](Cc1cnccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000834698436 1035431465 /nfs/dbraw/zinc/43/14/65/1035431465.db2.gz ZOAXBHGUGHFYEP-GOSISDBHSA-N 2 0 365.525 2.729 20 10 FFCDRP Cc1ccc(O)c(C[N@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1 ZINC001140620603 1035746335 /nfs/dbraw/zinc/74/63/35/1035746335.db2.gz UTBHIAVIXHQUSV-UHFFFAOYSA-N 2 0 354.498 2.941 20 10 FFCDRP CCC[N@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1 ZINC001229868431 1036947012 /nfs/dbraw/zinc/94/70/12/1036947012.db2.gz GFALNIFYHSRRQL-RTBURBONSA-N 2 0 361.530 2.862 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cc2)CC1 ZINC001235043773 1037324366 /nfs/dbraw/zinc/32/43/66/1037324366.db2.gz HDTWUVOOADUCQG-QFIPXVFZSA-N 3 0 356.558 2.937 20 10 FFCDRP Fc1ccc(O[C@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688873 1037684784 /nfs/dbraw/zinc/68/47/84/1037684784.db2.gz UPSLFHBEUCTKAG-NRFANRHFSA-N 2 0 355.457 2.889 20 10 FFCDRP Oc1cc2c(cc1C[N@@H+]1CCN[C@@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789849 1037745859 /nfs/dbraw/zinc/74/58/59/1037745859.db2.gz KXHKDKLOHCTODS-GOSISDBHSA-N 2 0 373.884 2.674 20 10 FFCDRP c1cc(CC2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)ccn1 ZINC001236098091 1037931358 /nfs/dbraw/zinc/93/13/58/1037931358.db2.gz NKPXCUWCFINOEG-UHFFFAOYSA-N 2 0 350.510 2.946 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)cc2)CC1 ZINC001254583781 1040816447 /nfs/dbraw/zinc/81/64/47/1040816447.db2.gz OCUFZHZUSJOQRO-LJQANCHMSA-N 2 0 366.465 2.604 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001278578450 1041241246 /nfs/dbraw/zinc/24/12/46/1041241246.db2.gz RNGZSLQSMILFCK-NRFANRHFSA-N 2 0 361.530 2.640 20 10 FFCDRP CCOC(=O)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001255339252 1041276236 /nfs/dbraw/zinc/27/62/36/1041276236.db2.gz RSVKQXCXHZEDDW-MOPGFXCFSA-N 2 0 359.514 2.650 20 10 FFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc4c(c3)CCO4)(C1)CCC2 ZINC001279340583 1043012378 /nfs/dbraw/zinc/01/23/78/1043012378.db2.gz QWMSNBBOYLXGLA-RTWAWAEBSA-N 2 0 360.498 2.767 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2ccc(N(CC)CC)cc2)CCC12C[NH2+]C2 ZINC001237413380 1043149280 /nfs/dbraw/zinc/14/92/80/1043149280.db2.gz WVSKBRZHZYZTDT-LJQANCHMSA-N 2 0 359.514 2.507 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC12C[NH2+]C2 ZINC001237428636 1043154843 /nfs/dbraw/zinc/15/48/43/1043154843.db2.gz BOMZFNWKSIMXQP-QGZVFWFLSA-N 2 0 360.498 2.664 20 10 FFCDRP C[NH+](C)CCN1CCC2(C[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC001279534465 1043232379 /nfs/dbraw/zinc/23/23/79/1043232379.db2.gz XLSNMJSXIXYWLN-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP Cc1c(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c2ccccc2n1C ZINC001279541976 1043237675 /nfs/dbraw/zinc/23/76/75/1043237675.db2.gz SEWVQEFLLZHCJN-UHFFFAOYSA-N 2 0 354.542 2.946 20 10 FFCDRP COc1cc(C)c(C[N@@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279666316 1043431612 /nfs/dbraw/zinc/43/16/12/1043431612.db2.gz ALUBFRFPWRGDLS-NRFANRHFSA-N 2 0 361.530 2.559 20 10 FFCDRP COc1cc(CN2CCC[C@]3(CCC[N@H+](C)C3)C2)cc(C[NH+](C)C)c1O ZINC001279698518 1043489775 /nfs/dbraw/zinc/48/97/75/1043489775.db2.gz NEXXJLUUBGRSDR-NRFANRHFSA-N 2 0 361.530 2.770 20 10 FFCDRP CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001318526762 1044729483 /nfs/dbraw/zinc/72/94/83/1044729483.db2.gz KHWMHLCWUYMWGN-GBESFXJTSA-N 2 0 361.530 2.718 20 10 FFCDRP CC[NH+](CC)C[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001337042714 1054434531 /nfs/dbraw/zinc/43/45/31/1054434531.db2.gz SJYGYBABGSFIIQ-LJQANCHMSA-N 3 0 362.537 2.741 20 10 FFCDRP COC(=O)c1c(C[NH+]2CCC(C[NH+](C)C)CC2)c2cc(F)ccc2n1C ZINC001461930070 1061453262 /nfs/dbraw/zinc/45/32/62/1061453262.db2.gz XZKXTYAKQPTONE-UHFFFAOYSA-N 2 0 361.461 2.878 20 10 FFCDRP COc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1F ZINC001560310970 1076262640 /nfs/dbraw/zinc/26/26/40/1076262640.db2.gz DORPBHYOIULSFR-UHFFFAOYSA-N 2 0 357.473 2.918 20 10 FFCDRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(Cl)cc3O)CC2)CC1 ZINC001560740095 1076295497 /nfs/dbraw/zinc/29/54/97/1076295497.db2.gz DABJEOFGKHJPQD-UHFFFAOYSA-N 2 0 351.922 2.895 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066515 508039242 /nfs/dbraw/zinc/03/92/42/508039242.db2.gz JWBQLYQBLVSSJW-DENIHFKCSA-N 2 0 355.526 2.972 20 10 FFCDRP CCOc1cccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c1O ZINC000377691181 512400874 /nfs/dbraw/zinc/40/08/74/512400874.db2.gz FBOPDYUMMBZVGR-DFNIBXOVSA-N 2 0 359.514 2.534 20 10 FFCDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000161228026 509089027 /nfs/dbraw/zinc/08/90/27/509089027.db2.gz YZOFYXVKSIEZHP-KRWDZBQOSA-N 2 0 368.525 2.895 20 10 FFCDRP CC[C@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000274941527 511994510 /nfs/dbraw/zinc/99/45/10/511994510.db2.gz SXAJECOVRTVYCV-ZFWWWQNUSA-N 2 0 357.292 2.652 20 10 FFCDRP C[C@@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000873293728 731897827 /nfs/dbraw/zinc/89/78/27/731897827.db2.gz OYLPUIHXJJCJHD-TZMCWYRMSA-N 2 0 369.303 2.964 20 10 FFCDRP COc1cc(Br)cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000725849326 734396273 /nfs/dbraw/zinc/39/62/73/734396273.db2.gz KNUNCRHANJIZNF-GFCCVEGCSA-N 2 0 357.292 2.983 20 10 FFCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@@H](C)C1 ZINC000894256424 734825969 /nfs/dbraw/zinc/82/59/69/734825969.db2.gz QIASBHGHTJGSMA-FUHWJXTLSA-N 2 0 350.503 2.936 20 10 FFCDRP COc1c([O-])c(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973665 738046269 /nfs/dbraw/zinc/04/62/69/738046269.db2.gz DCWPYCYJRCJKSO-AWEZNQCLSA-N 2 0 351.447 2.911 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccc(Cl)cc3)cc2)CC1 ZINC000814299290 741810013 /nfs/dbraw/zinc/81/00/13/741810013.db2.gz ZLQFELSENAKUHS-FQEVSTJZSA-N 2 0 359.901 2.915 20 10 FFCDRP C[C@@H]1C[C@H]([NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)c2c1c(F)ccc2O ZINC000817973239 742225475 /nfs/dbraw/zinc/22/54/75/742225475.db2.gz RJPVQNNHHNXBOW-OSMZGAPFSA-N 2 0 361.383 2.505 20 10 FFCDRP Cc1cc(O)c(C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825916456 743342647 /nfs/dbraw/zinc/34/26/47/743342647.db2.gz ORDKQUNWGYPIFT-QGZVFWFLSA-N 2 0 351.922 2.954 20 10 FFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1O ZINC000846227112 748433961 /nfs/dbraw/zinc/43/39/61/748433961.db2.gz GSSYBJUFFCGCDH-NXHRZFHOSA-N 2 0 350.434 2.595 20 10 FFCDRP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)cccc1Cl ZINC001275837283 1013065832 /nfs/dbraw/zinc/06/58/32/1013065832.db2.gz FRBWKLVQYYWWHZ-LJQANCHMSA-N 2 0 365.905 2.564 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895555958 970735853 /nfs/dbraw/zinc/73/58/53/970735853.db2.gz DBBGNEMBHGJSSA-GOSISDBHSA-N 2 0 352.482 2.629 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(C)cc(OC)c3O)cn2)CC1 ZINC000894183968 978123128 /nfs/dbraw/zinc/12/31/28/978123128.db2.gz OSEMJBIHWZIHRQ-UHFFFAOYSA-N 2 0 370.497 2.536 20 10 FFCDRP CCOC(=O)C1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000877717587 1014696934 /nfs/dbraw/zinc/69/69/34/1014696934.db2.gz LZQMPZZAUDJMBL-UHFFFAOYSA-N 2 0 359.514 2.650 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@H](C(F)(F)F)O1 ZINC000877824052 1014743567 /nfs/dbraw/zinc/74/35/67/1014743567.db2.gz ONVKVJNICKYFIE-CRAIPNDOSA-N 2 0 371.447 2.980 20 10 FFCDRP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2ccc(C[NH+]3CCCCC3)o2)cc1 ZINC000911666124 983862140 /nfs/dbraw/zinc/86/21/40/983862140.db2.gz HLRXCQNHYGOXMA-IBGZPJMESA-N 2 0 370.497 2.761 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cn2)CC1 ZINC000921539074 985210530 /nfs/dbraw/zinc/21/05/30/985210530.db2.gz FMMHURHMVQJNKC-UHFFFAOYSA-N 2 0 366.509 2.838 20 10 FFCDRP Oc1cc(O)c(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514773 998626114 /nfs/dbraw/zinc/62/61/14/998626114.db2.gz RMTHISFIFDPBTN-OAQYLSRUSA-N 2 0 354.450 2.901 20 10 FFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903878509 1016282582 /nfs/dbraw/zinc/28/25/82/1016282582.db2.gz WJLFPTFGPOQEPD-IBGZPJMESA-N 2 0 357.546 2.824 20 10 FFCDRP CN1Cc2ccccc2[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771860356 1001232541 /nfs/dbraw/zinc/23/25/41/1001232541.db2.gz XSJDPLDSMVSRCC-QFIPXVFZSA-N 2 0 350.510 2.715 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(Br)c1 ZINC001205654886 1004668709 /nfs/dbraw/zinc/66/87/09/1004668709.db2.gz XZRQWSXLBAELNQ-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP CC(C)Oc1ncccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199319473 1004909549 /nfs/dbraw/zinc/90/95/49/1004909549.db2.gz CREOEMRVCMXJGV-UHFFFAOYSA-N 2 0 354.498 2.910 20 10 FFCDRP CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667296 1005011068 /nfs/dbraw/zinc/01/10/68/1005011068.db2.gz HXRLDUBPLNNHCW-HXUWFJFHSA-N 2 0 372.557 2.567 20 10 FFCDRP COc1ccc(N2CC[C@H](C[NH2+]Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC000850330330 1005807229 /nfs/dbraw/zinc/80/72/29/1005807229.db2.gz MSDPHVRUKLSLSN-QGZVFWFLSA-N 2 0 363.465 2.892 20 10 FFCDRP CNC(=O)CC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000850400527 1005813323 /nfs/dbraw/zinc/81/33/23/1005813323.db2.gz JICVYXUVKBOCJC-UHFFFAOYSA-N 2 0 372.557 2.615 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(N4CCCC4)nc3)cc2)CC1 ZINC000883283367 1006730039 /nfs/dbraw/zinc/73/00/39/1006730039.db2.gz CANMLDQUHHJVAT-UHFFFAOYSA-N 2 0 365.525 2.723 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc4c([nH]c3=O)CCCC4)cc2)CC1 ZINC000865878357 1010879525 /nfs/dbraw/zinc/87/95/25/1010879525.db2.gz JMUASOHCKFCWBU-UHFFFAOYSA-N 2 0 366.509 2.708 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccnnc1 ZINC000925676368 1017814703 /nfs/dbraw/zinc/81/47/03/1017814703.db2.gz IMYUGIQFSOFOIO-KRWDZBQOSA-N 2 0 351.498 2.859 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397496630 1020291042 /nfs/dbraw/zinc/29/10/42/1020291042.db2.gz QVDZWHIYWOQKDD-UHFFFAOYSA-N 2 0 353.510 2.869 20 10 FFCDRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548165 1023725570 /nfs/dbraw/zinc/72/55/70/1023725570.db2.gz JAXCOQHTKNZDCE-DOTOQJQBSA-N 2 0 355.482 2.783 20 10 FFCDRP c1cc(N2CCOCC2)ccc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000093735018 1027813871 /nfs/dbraw/zinc/81/38/71/1027813871.db2.gz OBBKRZWLGYFPCX-UHFFFAOYSA-N 2 0 373.541 2.600 20 10 FFCDRP COc1ccc(N2CC[NH+](CCCNc3cccc(C[NH3+])c3)CC2)cc1 ZINC001164330090 1029248425 /nfs/dbraw/zinc/24/84/25/1029248425.db2.gz JSATYWATYWWVBE-UHFFFAOYSA-N 2 0 354.498 2.778 20 10 FFCDRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045362 1030000877 /nfs/dbraw/zinc/00/08/77/1030000877.db2.gz KGLCABMQESXADY-YHYVQYDKSA-N 2 0 352.526 2.863 20 10 FFCDRP C[C@H]1CC[N@H+](Cc2ccc(I)cc2O)CC[C@@H]1C[NH3+] ZINC001205637832 1031894042 /nfs/dbraw/zinc/89/40/42/1031894042.db2.gz JESIJSXGXOCVFN-NWDGAFQWSA-N 2 0 374.266 2.804 20 10 FFCDRP CC[NH+](CC)[C@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832274680 1034696046 /nfs/dbraw/zinc/69/60/46/1034696046.db2.gz XEAVNVUMAPJXRC-SFTDATJTSA-N 2 0 368.525 2.952 20 10 FFCDRP Cc1nnc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)o1 ZINC001139410747 1035095887 /nfs/dbraw/zinc/09/58/87/1035095887.db2.gz BSGPMSYONCXNIH-UHFFFAOYSA-N 2 0 355.486 2.509 20 10 FFCDRP COC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)C1 ZINC001140185138 1035371943 /nfs/dbraw/zinc/37/19/43/1035371943.db2.gz PRVJGGJMGJMJJC-KRWDZBQOSA-N 2 0 360.498 2.858 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cccc(O)c43)cn2)CC1 ZINC000834514685 1035402555 /nfs/dbraw/zinc/40/25/55/1035402555.db2.gz VWCMDERAKDZPEC-GOSISDBHSA-N 2 0 352.482 2.706 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C(=O)OC)[C@H]3C)cc2)CC1 ZINC001140304290 1035426376 /nfs/dbraw/zinc/42/63/76/1035426376.db2.gz LXQWSJNGFMMIEU-YLJYHZDGSA-N 2 0 359.514 2.602 20 10 FFCDRP CCN(C(C)=O)C1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140309342 1035429844 /nfs/dbraw/zinc/42/98/44/1035429844.db2.gz BUMOLDLIPNZGQG-UHFFFAOYSA-N 2 0 372.557 2.661 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000835039837 1035491579 /nfs/dbraw/zinc/49/15/79/1035491579.db2.gz KIQABTTXOFDTLO-CJHOVAGGSA-N 2 0 365.521 2.992 20 10 FFCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000835054387 1035494560 /nfs/dbraw/zinc/49/45/60/1035494560.db2.gz VBGUTXIKZNWRSS-SNAWJCMRSA-N 2 0 356.558 2.725 20 10 FFCDRP Cc1cc(C)c(C[N@H+]2CCCC[C@@]23CC(=O)N(CC[NH+](C)C)C3)c(O)c1 ZINC001277204849 1035529869 /nfs/dbraw/zinc/52/98/69/1035529869.db2.gz YSJUELGAAYVGLE-NRFANRHFSA-N 2 0 359.514 2.528 20 10 FFCDRP C[NH+]1CCC(C[NH+]2CCN(Cc3cccc(C(F)(F)F)c3O)CC2)CC1 ZINC001233419515 1036612813 /nfs/dbraw/zinc/61/28/13/1036612813.db2.gz AHYBWGZLZPPGLG-UHFFFAOYSA-N 2 0 371.447 2.870 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C4CC[NH2+]CC4)CC3)cc2)CC1 ZINC001235700997 1037697992 /nfs/dbraw/zinc/69/79/92/1037697992.db2.gz BGKGFQQJOPZBNK-UHFFFAOYSA-N 3 0 356.558 2.650 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001235714129 1037706064 /nfs/dbraw/zinc/70/60/64/1037706064.db2.gz HHXQQNVKZLQYFS-LJQANCHMSA-N 2 0 351.494 2.866 20 10 FFCDRP C[C@]1(c2ccc(F)cc2)C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCO1 ZINC001235962115 1037862036 /nfs/dbraw/zinc/86/20/36/1037862036.db2.gz JHZCDKIYGDYXPI-JOCHJYFZSA-N 2 0 369.484 2.983 20 10 FFCDRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971777 1037869912 /nfs/dbraw/zinc/86/99/12/1037869912.db2.gz AGVQUZOCEWTKBY-FCHUYYIVSA-N 3 0 356.558 2.935 20 10 FFCDRP c1ccc(C[C@H]2C[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCO2)cc1 ZINC001236070895 1037914943 /nfs/dbraw/zinc/91/49/43/1037914943.db2.gz CBTBNWPMBIBUGE-QFIPXVFZSA-N 2 0 351.494 2.540 20 10 FFCDRP COCC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@@H]2C1 ZINC001231880126 1037974049 /nfs/dbraw/zinc/97/40/49/1037974049.db2.gz GLMILFOZXQEXHJ-WIYYLYMNSA-N 2 0 370.493 2.715 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(N)cc4C3)c(F)c2)CC1 ZINC001236234428 1037996008 /nfs/dbraw/zinc/99/60/08/1037996008.db2.gz PDYMTZXALPHATD-UHFFFAOYSA-N 2 0 354.473 2.718 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(C[C@H]4CCO)CC3)c(F)c2)CC1 ZINC001236936921 1038366578 /nfs/dbraw/zinc/36/65/78/1038366578.db2.gz USYZUKVMFUBPSB-GOSISDBHSA-N 2 0 361.505 2.562 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4cccnc4)C3)c(F)c2)CC1 ZINC001236937424 1038366880 /nfs/dbraw/zinc/36/68/80/1038366880.db2.gz GWLYVBSPZRDQBQ-SFHVURJKSA-N 2 0 354.473 2.962 20 10 FFCDRP COc1cc2c(cn1)CCN(Cc1ccc(N3CC[NH+](C)CC3)cc1F)C2 ZINC001236947356 1038374594 /nfs/dbraw/zinc/37/45/94/1038374594.db2.gz QRSLLQVZGFPRPZ-UHFFFAOYSA-N 2 0 370.472 2.539 20 10 FFCDRP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001246175054 1039267064 /nfs/dbraw/zinc/26/70/64/1039267064.db2.gz RVPJUULFMYMCAC-UNMCSNQZSA-N 2 0 350.510 2.679 20 10 FFCDRP Oc1ccc(O)c(C[NH2+][C@@]23CC[C@@]([NH2+]CCn4ccnc4)(C2)CCC3)c1 ZINC001278750474 1040467599 /nfs/dbraw/zinc/46/75/99/1040467599.db2.gz IUIUAWROXUEXKI-UXHICEINSA-N 3 0 356.470 2.519 20 10 FFCDRP C[NH+](C)CCN1CC2(C1)CCC[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001279229786 1042956338 /nfs/dbraw/zinc/95/63/38/1042956338.db2.gz CBSSONIPOHCKIP-UHFFFAOYSA-N 2 0 356.558 2.746 20 10 FFCDRP Cc1cccc(C[NH+]2CCC3(CC[N@H+](CCn4ccnc4)C3)CC2)c1O ZINC001279290127 1042985410 /nfs/dbraw/zinc/98/54/10/1042985410.db2.gz GKTKQTROTOCVDZ-UHFFFAOYSA-N 2 0 354.498 2.885 20 10 FFCDRP c1ccc2c(c1)CN(Cc1ccc(N3CC[NH2+]CC3)cc1)C21CC[NH2+]CC1 ZINC001237312302 1043104396 /nfs/dbraw/zinc/10/43/96/1043104396.db2.gz YJVJRDDLXHXHHS-UHFFFAOYSA-N 2 0 362.521 2.691 20 10 FFCDRP COc1cc(C)c(C[N@@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279666318 1043431639 /nfs/dbraw/zinc/43/16/39/1043431639.db2.gz ALUBFRFPWRGDLS-OAQYLSRUSA-N 2 0 361.530 2.559 20 10 FFCDRP C[NH2+][C@@]12CC[C@@](NCc3ccc(N4CC[NH+](C)CC4)cc3F)(C1)CCC2 ZINC001279676580 1043449293 /nfs/dbraw/zinc/44/92/93/1043449293.db2.gz ZRSPAWDTULMTLY-LEWJYISDSA-N 2 0 360.521 2.732 20 10 FFCDRP CCN1CC[NH+](CCCC[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000154488887 508795261 /nfs/dbraw/zinc/79/52/61/508795261.db2.gz JMIDOZVQLYHLJY-UHFFFAOYSA-N 2 0 374.573 2.671 20 10 FFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1 ZINC000186060421 509504408 /nfs/dbraw/zinc/50/44/08/509504408.db2.gz LBMVNIXCKGDJEI-HNNXBMFYSA-N 2 0 371.481 2.543 20 10 FFCDRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000181010629 510237588 /nfs/dbraw/zinc/23/75/88/510237588.db2.gz LFEABPOULAKDKW-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(Br)ccc1O ZINC000185366607 510824484 /nfs/dbraw/zinc/82/44/84/510824484.db2.gz ABAPROIKDFGIPS-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)c1O ZINC000925849024 738536090 /nfs/dbraw/zinc/53/60/90/738536090.db2.gz GJLAFVKIXXEXKM-JSGCOSHPSA-N 2 0 352.862 2.690 20 10 FFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](N2CC[NH2+]CC2)C(F)(F)F)cc1 ZINC000817973551 742225372 /nfs/dbraw/zinc/22/53/72/742225372.db2.gz VAXFSFLALWEOMW-YOEHRIQHSA-N 2 0 358.452 2.629 20 10 FFCDRP Clc1nc2c(c(N3CC4(CC[NH2+]CC4)c4ccccc43)n1)C[NH2+]CC2 ZINC001167072480 959498825 /nfs/dbraw/zinc/49/88/25/959498825.db2.gz VSWANPZICMTFRF-UHFFFAOYSA-N 2 0 355.873 2.549 20 10 FFCDRP Cc1ccc(C)n1-c1ccc(C(=O)N(CC[NH+](C)C)CC[NH+](C)C)cc1 ZINC000729436611 965316034 /nfs/dbraw/zinc/31/60/34/965316034.db2.gz WGLCLRZSQYRCOK-UHFFFAOYSA-N 2 0 356.514 2.660 20 10 FFCDRP Cc1cc(CNC(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc(C)n1 ZINC000895410837 970594372 /nfs/dbraw/zinc/59/43/72/970594372.db2.gz JSGSKDIWEPXOJR-FQEVSTJZSA-N 2 0 369.513 2.867 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)CC[C@H]2CCCC[N@@H+]2C)[NH+](C)C)cc1 ZINC001184426890 1002611305 /nfs/dbraw/zinc/61/13/05/1002611305.db2.gz POUJKGIIBXITMR-UXHICEINSA-N 2 0 360.546 2.736 20 10 FFCDRP CC[C@@H]([NH2+][C@@H](Cc1ccccc1)C(=O)NCC[NH+](C)C)c1ccccc1O ZINC000775538845 1004208688 /nfs/dbraw/zinc/20/86/88/1004208688.db2.gz AFCVSPYMHBUMPW-UXHICEINSA-N 2 0 369.509 2.722 20 10 FFCDRP COc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1O ZINC000775664585 1004994315 /nfs/dbraw/zinc/99/43/15/1004994315.db2.gz ZFBGIQWYXPDJOI-UHFFFAOYSA-N 2 0 355.482 2.785 20 10 FFCDRP CCOc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(O)c1 ZINC000883283873 1006730218 /nfs/dbraw/zinc/73/02/18/1006730218.db2.gz WPWWQZHHQPEGQL-UHFFFAOYSA-N 2 0 355.482 2.833 20 10 FFCDRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893842 1007800297 /nfs/dbraw/zinc/80/02/97/1007800297.db2.gz IZXCZAWIFWHQOD-WZONZLPQSA-N 2 0 367.537 2.943 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)ccc1N1CCOCC1 ZINC000925480693 1017763461 /nfs/dbraw/zinc/76/34/61/1017763461.db2.gz MZCAQGGMCHVBLM-AZUAARDMSA-N 2 0 361.505 2.920 20 10 FFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167810 1032799870 /nfs/dbraw/zinc/79/98/70/1032799870.db2.gz RUZSKRXHGMSXNU-JOCHJYFZSA-N 3 0 356.558 2.842 20 10 FFCDRP Oc1cccc2c1[C@H]([NH2+]CCN1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000390893012 1019903325 /nfs/dbraw/zinc/90/33/25/1019903325.db2.gz ZNTZDXRLOCKCSR-HXUWFJFHSA-N 2 0 351.494 2.787 20 10 FFCDRP COc1cccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c1O ZINC000397490190 1020290301 /nfs/dbraw/zinc/29/03/01/1020290301.db2.gz HTAOMIFXSHXZCG-UHFFFAOYSA-N 2 0 356.466 2.518 20 10 FFCDRP C[C@H](CNC(=O)C[NH2+][C@@H](C)c1ccccc1O)[NH2+][C@@H](C)c1ccccc1O ZINC000931555587 1020513147 /nfs/dbraw/zinc/51/31/47/1020513147.db2.gz YVEMKJQVEXVAIO-PMPSAXMXSA-N 2 0 371.481 2.604 20 10 FFCDRP CCN(CC)c1ccc(C[N@@H+]2CCOCC3(CC[NH2+]CC3)C2)c(OC)c1 ZINC001222400875 1032944138 /nfs/dbraw/zinc/94/41/38/1032944138.db2.gz LVSZXBUWRJJDTM-UHFFFAOYSA-N 2 0 361.530 2.743 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC[NH2+]C4)CC3)c(F)c2)CC1 ZINC001222457272 1032985281 /nfs/dbraw/zinc/98/52/81/1032985281.db2.gz GDSTUKUGOMZFNE-UHFFFAOYSA-N 3 0 360.521 2.543 20 10 FFCDRP C[NH+](C)[C@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@@H]2C1 ZINC001120070875 1023228426 /nfs/dbraw/zinc/22/84/26/1023228426.db2.gz CPVQVNSJMPUQAL-ONTIZHBOSA-N 3 0 356.558 2.601 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547803 1023727160 /nfs/dbraw/zinc/72/71/60/1023727160.db2.gz HPKIXVTXZCIKCG-QAPCUYQASA-N 2 0 359.514 2.509 20 10 FFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CN1C1CC1 ZINC000092856005 1027478282 /nfs/dbraw/zinc/47/82/82/1027478282.db2.gz XWJMLOGVISOBEP-WIYYLYMNSA-N 2 0 368.569 2.933 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000841104396 1030042225 /nfs/dbraw/zinc/04/22/25/1030042225.db2.gz QDNIDSWJVXBDTO-UHFFFAOYSA-N 2 0 352.526 2.836 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)CCc3ccccc3)cc2)CC1 ZINC000784678954 1030753031 /nfs/dbraw/zinc/75/30/31/1030753031.db2.gz FHPDBHGZQJLASO-JOCHJYFZSA-N 2 0 353.510 2.522 20 10 FFCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001203552744 1030762305 /nfs/dbraw/zinc/76/23/05/1030762305.db2.gz RVJSVSVJFMYEFV-TZIWHRDSSA-N 2 0 353.466 2.510 20 10 FFCDRP COc1cccc(CN2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001203594366 1030778959 /nfs/dbraw/zinc/77/89/59/1030778959.db2.gz WVIBRMWVQCWBRF-AZUAARDMSA-N 2 0 360.498 2.724 20 10 FFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@]1(O)CCc2ccccc21 ZINC000843420610 1031394196 /nfs/dbraw/zinc/39/41/96/1031394196.db2.gz IVXFMVCTGUEUOX-QHCPKHFHSA-N 2 0 365.521 2.704 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCN(c4nccs4)CC3)cc2)CC1 ZINC000798503406 1031436418 /nfs/dbraw/zinc/43/64/18/1031436418.db2.gz JKQIMCXLXPMCBX-UHFFFAOYSA-N 2 0 371.554 2.654 20 10 FFCDRP Cc1cccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001204864552 1031457314 /nfs/dbraw/zinc/45/73/14/1031457314.db2.gz XVPMLCWGLCJRAC-UHFFFAOYSA-N 2 0 350.510 2.727 20 10 FFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cc1Br ZINC001205638272 1031895796 /nfs/dbraw/zinc/89/57/96/1031895796.db2.gz LVAZEYYOJNZBHH-NEPJUHHUSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(C[NH+]2CCC(n3nccc3C)CC2)cc(C[NH+](C)C)c1O ZINC001139260686 1035033288 /nfs/dbraw/zinc/03/32/88/1035033288.db2.gz PNXKQZMLEJBBKX-UHFFFAOYSA-N 2 0 358.486 2.804 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cc5c(cc4C3)OCO5)cc2)CC1 ZINC001139408675 1035092287 /nfs/dbraw/zinc/09/22/87/1035092287.db2.gz OVBSSROGXSSOJR-UHFFFAOYSA-N 2 0 365.477 2.725 20 10 FFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@H]1Cc2ccccc2O1 ZINC001139411308 1035094958 /nfs/dbraw/zinc/09/49/58/1035094958.db2.gz FPIQBXADDPOVJN-NRFANRHFSA-N 2 0 351.494 2.874 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](CC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001139410967 1035096085 /nfs/dbraw/zinc/09/60/85/1035096085.db2.gz OAWJZTWTVPIKBF-IBGZPJMESA-N 2 0 373.541 2.992 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C(C)C)[C@@H]3CCN(C(C)=O)C3)cc2)CC1 ZINC001140309549 1035429659 /nfs/dbraw/zinc/42/96/59/1035429659.db2.gz LFEPLJVDFDFURC-JOCHJYFZSA-N 2 0 372.557 2.660 20 10 FFCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC(N(C)C)=NO3)CC2)c(O)c1 ZINC001140852141 1036285400 /nfs/dbraw/zinc/28/54/00/1036285400.db2.gz DAKFPAGMSLSSOJ-UHFFFAOYSA-N 2 0 360.502 2.868 20 10 FFCDRP COc1cc(O)c(C[N@H+](C)CC2CC[NH+](C)CC2)cc1Br ZINC001233139874 1036388151 /nfs/dbraw/zinc/38/81/51/1036388151.db2.gz SHTIMVKISVPORI-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP CCOC(=O)c1c(CN2C[C@@H]3C[N@@H+](CC)C[C@@H]3C2)c2ccccc2n1C ZINC001233273765 1036480363 /nfs/dbraw/zinc/48/03/63/1036480363.db2.gz QZSVVFIPVMXUAG-IYBDPMFKSA-N 2 0 355.482 2.739 20 10 FFCDRP Cc1ccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3C(C)C)C2)c(O)c1 ZINC001140949618 1036546766 /nfs/dbraw/zinc/54/67/66/1036546766.db2.gz FQZXHNCXOFOKNV-AABGKKOBSA-N 2 0 369.513 2.666 20 10 FFCDRP CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236092970 1037932159 /nfs/dbraw/zinc/93/21/59/1037932159.db2.gz CBUNROOGPAESFL-LJQANCHMSA-N 2 0 359.514 2.792 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(N)cc4C3)cc2)CC1 ZINC001236232050 1037994548 /nfs/dbraw/zinc/99/45/48/1037994548.db2.gz LRCVYBWTMJUFAV-UHFFFAOYSA-N 2 0 350.510 2.969 20 10 FFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236279875 1038019826 /nfs/dbraw/zinc/01/98/26/1038019826.db2.gz SKTRPCBWJOIITD-UHFFFAOYSA-N 2 0 368.525 2.890 20 10 FFCDRP COC[C@@]12CCC[C@@H]1C[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1F)C2 ZINC001236935944 1038367371 /nfs/dbraw/zinc/36/73/71/1038367371.db2.gz OULKXMIXYUNHDG-NQIIRXRSSA-N 2 0 361.505 2.826 20 10 FFCDRP CCOC(=O)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001237114167 1038447721 /nfs/dbraw/zinc/44/77/21/1038447721.db2.gz CKAKZFZITGDDBQ-MJGOQNOKSA-N 2 0 359.514 2.507 20 10 FFCDRP C[NH+]1CCC2(CC1)C[N@H+](Cc1c(O)cc(O)cc1O)Cc1ccccc12 ZINC001278425838 1039191056 /nfs/dbraw/zinc/19/10/56/1039191056.db2.gz HNIRDDKLVFQMMY-UHFFFAOYSA-N 2 0 354.450 2.783 20 10 FFCDRP COC(=O)c1ccc(C[C@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001246173740 1039266102 /nfs/dbraw/zinc/26/61/02/1039266102.db2.gz MEYSJJIBYFSPDE-KRWDZBQOSA-N 2 0 367.493 2.604 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCC[N@@H+]([C@@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701982 1039441912 /nfs/dbraw/zinc/44/19/12/1039441912.db2.gz JQPWEGGSBQMSNI-UZKOGDIHSA-N 2 0 373.541 2.755 20 10 FFCDRP COc1ccc(N2CCOC[C@@]3(CCCN([C@@H]4CCCC[NH2+]C4)C3)C2)cc1 ZINC001246704091 1039444185 /nfs/dbraw/zinc/44/41/85/1039444185.db2.gz OQUZRRMRMGREFG-IFMALSPDSA-N 2 0 373.541 2.756 20 10 FFCDRP Cc1cc(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)ccc1N(C)C ZINC001278686090 1039766954 /nfs/dbraw/zinc/76/69/54/1039766954.db2.gz JBEQKLGOUZLNGQ-UHFFFAOYSA-N 2 0 358.574 2.911 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)CC1 ZINC001262044507 1041527791 /nfs/dbraw/zinc/52/77/91/1041527791.db2.gz KXBWAUOCNZZXIJ-OAQYLSRUSA-N 2 0 366.509 2.535 20 10 FFCDRP CCOC(=O)[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC12C[NH2+]C2 ZINC001237431090 1043156376 /nfs/dbraw/zinc/15/63/76/1043156376.db2.gz MXKZYFDYJCMHOZ-GOSISDBHSA-N 2 0 354.450 2.520 20 10 FFCDRP COC(=O)c1c(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c2ccccc2n1C ZINC001279594964 1043311202 /nfs/dbraw/zinc/31/12/02/1043311202.db2.gz GTWLVVZEGMFOOV-UHFFFAOYSA-N 2 0 355.482 2.883 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279672002 1043440933 /nfs/dbraw/zinc/44/09/33/1043440933.db2.gz KGBBRRZAKPHSSW-NRFANRHFSA-N 2 0 361.530 2.640 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCCO4)CC3)cc2F)CC1 ZINC001320576225 1045430904 /nfs/dbraw/zinc/43/09/04/1045430904.db2.gz SCVQHIGPNCHOKF-OAQYLSRUSA-N 2 0 361.505 2.969 20 10 FFCDRP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cc2F)CC1 ZINC001329428567 1048715624 /nfs/dbraw/zinc/71/56/24/1048715624.db2.gz SQBDJABPOCDCPE-HXUWFJFHSA-N 2 0 360.521 2.542 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@@H](O)c1ccccc1 ZINC001329836866 1048933073 /nfs/dbraw/zinc/93/30/73/1048933073.db2.gz YROIZRHEFKQYER-HRAATJIYSA-N 2 0 357.473 2.789 20 10 FFCDRP [NH3+][C@H](CC[NH2+]Cc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1 ZINC001580127158 1078752689 /nfs/dbraw/zinc/75/26/89/1078752689.db2.gz HLIBKIJUQFNQQW-LJQANCHMSA-N 2 0 357.473 2.712 20 10 FFCDRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000295938880 511561461 /nfs/dbraw/zinc/56/14/61/511561461.db2.gz KSVIWDQRCONHPN-FQEVSTJZSA-N 2 0 351.494 2.917 20 10 FFCDRP C[NH2+][C@H](C)Cc1noc(Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)n1 ZINC000572521775 518231178 /nfs/dbraw/zinc/23/11/78/518231178.db2.gz SHNSRDUKQPVGEJ-OAHLLOKOSA-N 2 0 367.497 2.990 20 10 FFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H](C(N)=O)C2)c1O ZINC000808693098 741252558 /nfs/dbraw/zinc/25/25/58/741252558.db2.gz WAPVYKFEGHJBID-UONOGXRCSA-N 2 0 353.894 2.592 20 10 FFCDRP CC[C@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000817972543 742225553 /nfs/dbraw/zinc/22/55/53/742225553.db2.gz MRVFJHJWENLJPF-DLBZAZTESA-N 2 0 358.452 2.629 20 10 FFCDRP COc1cc(Br)cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1O ZINC000843126312 747777724 /nfs/dbraw/zinc/77/77/24/747777724.db2.gz IUTPYXKOKWILBG-TXEJJXNPSA-N 2 0 355.276 2.595 20 10 FFCDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901916 748131720 /nfs/dbraw/zinc/13/17/20/748131720.db2.gz IWIDOMYMRZTBGS-SRCQZFHVSA-N 2 0 369.303 2.873 20 10 FFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000846227109 748433865 /nfs/dbraw/zinc/43/38/65/748433865.db2.gz GSSYBJUFFCGCDH-CGTJXYLNSA-N 2 0 350.434 2.595 20 10 FFCDRP C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1cc(Br)ccc1O ZINC000850353997 749350612 /nfs/dbraw/zinc/35/06/12/749350612.db2.gz RUBNWHUXFQIXKS-ZDUSSCGKSA-N 2 0 358.324 2.516 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000854231603 750265912 /nfs/dbraw/zinc/26/59/12/750265912.db2.gz MITKNDQTRRZCIG-CYBMUJFWSA-N 2 0 353.894 2.687 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000894786535 965695950 /nfs/dbraw/zinc/69/59/50/965695950.db2.gz JSMWTYXJJWGPPY-UHFFFAOYSA-N 2 0 359.470 2.725 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(O)cc1Br ZINC001206025656 1032112507 /nfs/dbraw/zinc/11/25/07/1032112507.db2.gz OPQHEGFPEZRGIR-VXGBXAGGSA-N 2 0 357.292 2.970 20 10 FFCDRP Cc1ccc([C@H](O)[C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796480307 1015303793 /nfs/dbraw/zinc/30/37/93/1015303793.db2.gz CQECVHOHRNZBSB-XMSQKQJNSA-N 2 0 353.510 2.959 20 10 FFCDRP Cc1ccc([C@@H](O)[C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796480303 1015304204 /nfs/dbraw/zinc/30/42/04/1015304204.db2.gz CQECVHOHRNZBSB-GCJKJVERSA-N 2 0 353.510 2.959 20 10 FFCDRP Cc1ccc([C@@H](O)[C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000796480301 1015304305 /nfs/dbraw/zinc/30/43/05/1015304305.db2.gz CQECVHOHRNZBSB-AVRDEDQJSA-N 2 0 353.510 2.959 20 10 FFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000809756528 994605965 /nfs/dbraw/zinc/60/59/65/994605965.db2.gz SCPAQUPJVNBOIV-IBGZPJMESA-N 2 0 361.505 2.826 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCC4)[C@@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811518198 995162803 /nfs/dbraw/zinc/16/28/03/995162803.db2.gz GSDMGGMAYZBFTC-RTWAWAEBSA-N 2 0 355.526 2.972 20 10 FFCDRP Fc1cc(C[NH2+]Cc2cccc3c2CC[NH2+]C3)ccc1N1CCOCC1 ZINC000903922529 1016307261 /nfs/dbraw/zinc/30/72/61/1016307261.db2.gz YUYOZKXVXCRWGY-UHFFFAOYSA-N 2 0 355.457 2.598 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@](C)(O)c1ccccc1 ZINC000846036465 1000196269 /nfs/dbraw/zinc/19/62/69/1000196269.db2.gz JSTXPCZJNVHALT-PGRDOPGGSA-N 2 0 353.510 2.824 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(=O)Nc3ccc(Cl)cc3)cc2)CC1 ZINC000771823421 1001220554 /nfs/dbraw/zinc/22/05/54/1001220554.db2.gz ARCRZVOSNJNKIK-UHFFFAOYSA-N 2 0 372.900 2.820 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H](O)C(F)(F)F)CC3)cc2)CC1 ZINC000775726459 1003839601 /nfs/dbraw/zinc/83/96/01/1003839601.db2.gz RSJUMYGGBXPHNM-GOSISDBHSA-N 2 0 371.447 2.574 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3ccc(Cl)cn3)cc2)CC1 ZINC001201398313 1005205587 /nfs/dbraw/zinc/20/55/87/1005205587.db2.gz HNEFLPGPZVTWGX-UHFFFAOYSA-N 2 0 360.889 2.655 20 10 FFCDRP Cc1cnn(-c2cc[nH+]cc2NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000776253087 1005314526 /nfs/dbraw/zinc/31/45/26/1005314526.db2.gz RXFCLZUZHINSKM-UHFFFAOYSA-N 2 0 362.481 2.940 20 10 FFCDRP COc1cncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1 ZINC000850235388 1005797634 /nfs/dbraw/zinc/79/76/34/1005797634.db2.gz XOJMGYZJFZKKTE-UHFFFAOYSA-N 2 0 366.509 2.912 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cccnc4CC3)cc2)CC1 ZINC000883282988 1006730758 /nfs/dbraw/zinc/73/07/58/1006730758.db2.gz NIVAJIJGLJDGBP-FQEVSTJZSA-N 2 0 350.510 2.871 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc4c(cc[nH]c4=O)o3)cc2)CC1 ZINC000883283142 1006731016 /nfs/dbraw/zinc/73/10/16/1006731016.db2.gz RVSJQJMVXZOXOX-UHFFFAOYSA-N 2 0 352.438 2.575 20 10 FFCDRP CCOC(=O)C1([C@H](C)[NH2+]Cc2ccc(N(CC)CC)cc2)CC[NH2+]CC1 ZINC000817887851 1007784635 /nfs/dbraw/zinc/78/46/35/1007784635.db2.gz GBYPBCSXMLPXJO-KRWDZBQOSA-N 2 0 361.530 2.944 20 10 FFCDRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817917587 1007808873 /nfs/dbraw/zinc/80/88/73/1007808873.db2.gz SEJPHCXGRIWFBA-XMSQKQJNSA-N 3 0 356.558 2.696 20 10 FFCDRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc(F)c1N1CCOCC1 ZINC000817937307 1007815716 /nfs/dbraw/zinc/81/57/16/1007815716.db2.gz XVZBWAISXBHCMA-ZYSHUDEJSA-N 2 0 365.468 2.812 20 10 FFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@@H+]1C ZINC000773145602 1009667968 /nfs/dbraw/zinc/66/79/68/1009667968.db2.gz KELGADJYXUYIDH-GHTZIAJQSA-N 3 0 356.558 2.791 20 10 FFCDRP CC[C@H](C(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1)[NH+](C)C ZINC001093857659 1010633327 /nfs/dbraw/zinc/63/33/27/1010633327.db2.gz QLGUHDZCRXGWLI-BHIYHBOVSA-N 2 0 361.530 2.528 20 10 FFCDRP COC(=O)[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001172768130 1012004464 /nfs/dbraw/zinc/00/44/64/1012004464.db2.gz OTCRSTPTCNECJL-OALUTQOASA-N 2 0 359.514 2.650 20 10 FFCDRP Cc1ccc(C)c(C[N@H+]2CCCC[C@@]23CC(=O)N(CC[NH+](C)C)C3)c1O ZINC001275771909 1012991859 /nfs/dbraw/zinc/99/18/59/1012991859.db2.gz TWVHPVJWWHYZNV-NRFANRHFSA-N 2 0 359.514 2.528 20 10 FFCDRP C[C@@H](CCn1cccn1)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000159200843 1022631936 /nfs/dbraw/zinc/63/19/36/1022631936.db2.gz JKMXLRUWXHNESO-IBGZPJMESA-N 2 0 367.541 2.984 20 10 FFCDRP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cc(F)ccc1O ZINC000756509370 1023721112 /nfs/dbraw/zinc/72/11/12/1023721112.db2.gz BFVNWEUYGDQZNY-MRXNPFEDSA-N 2 0 358.461 2.789 20 10 FFCDRP CCN(CC)c1ccc(C[NH2+]C2CCC([NH+]3CCNCC3)CC2)cc1F ZINC000841087407 1030028076 /nfs/dbraw/zinc/02/80/76/1030028076.db2.gz NLEWKLZYAUAWSN-UHFFFAOYSA-N 2 0 362.537 2.978 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000841104883 1030038837 /nfs/dbraw/zinc/03/88/37/1030038837.db2.gz WDIVNJBEWYUISE-UHFFFAOYSA-N 2 0 370.516 2.975 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3C[C@@H](c4ccccc4F)[C@H]([NH3+])C3)cc2)CC1 ZINC000841102980 1030039966 /nfs/dbraw/zinc/03/99/66/1030039966.db2.gz BKKOCSJLHWRQKS-RBBKRZOGSA-N 2 0 368.500 2.504 20 10 FFCDRP COc1ccc(CC[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1OC ZINC001204870348 1031457328 /nfs/dbraw/zinc/45/73/28/1031457328.db2.gz QIQNZDRYUKDMRN-UHFFFAOYSA-N 2 0 369.509 2.788 20 10 FFCDRP CN(C)c1ccc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c(C(F)(F)F)c1 ZINC000799347108 1031744225 /nfs/dbraw/zinc/74/42/25/1031744225.db2.gz WUHMJXFRVKENTC-UHFFFAOYSA-N 2 0 372.479 2.887 20 10 FFCDRP COc1cc(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)cc(C[NH+](C)C)c1O ZINC001139252843 1035030390 /nfs/dbraw/zinc/03/03/90/1035030390.db2.gz BADCDMMYPCIWAM-HXUWFJFHSA-N 2 0 369.509 2.951 20 10 FFCDRP CCOC(=O)C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139407750 1035092921 /nfs/dbraw/zinc/09/29/21/1035092921.db2.gz CLIWVYYCPDKITR-LJQANCHMSA-N 2 0 359.514 2.604 20 10 FFCDRP Cc1c[nH+]ccc1N1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC001140287441 1035419438 /nfs/dbraw/zinc/41/94/38/1035419438.db2.gz SLRZHTHQCTXHSP-UHFFFAOYSA-N 2 0 366.509 2.673 20 10 FFCDRP Cc1ccc(O)c(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3C(C)C)C2)c1 ZINC001140621081 1035748407 /nfs/dbraw/zinc/74/84/07/1035748407.db2.gz GXHKUMRHWIVGIY-HOJAQTOUSA-N 2 0 369.513 2.666 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CCCCC34CC[NH2+]CC4)c(F)c2)CC1 ZINC001235191085 1037401950 /nfs/dbraw/zinc/40/19/50/1037401950.db2.gz KTCFOGIHFVZLQR-UHFFFAOYSA-N 2 0 360.521 2.686 20 10 FFCDRP Fc1ccc(O[C@@H]2CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688874 1037684904 /nfs/dbraw/zinc/68/49/04/1037684904.db2.gz UPSLFHBEUCTKAG-OAQYLSRUSA-N 2 0 355.457 2.889 20 10 FFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001235714127 1037706242 /nfs/dbraw/zinc/70/62/42/1037706242.db2.gz HHXQQNVKZLQYFS-IBGZPJMESA-N 2 0 351.494 2.866 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccccc3F)cc2)CC1 ZINC001235734788 1037717316 /nfs/dbraw/zinc/71/73/16/1037717316.db2.gz DYYLPCIRNZSDNY-QFIPXVFZSA-N 2 0 368.500 2.724 20 10 FFCDRP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)CC2CCC2)CC1 ZINC001236541749 1038125134 /nfs/dbraw/zinc/12/51/34/1038125134.db2.gz SRRCOCCBOISQPF-MXVIHJGJSA-N 3 0 372.557 2.674 20 10 FFCDRP C[NH+](C)CCN(Cc1cc2c3c(c1)CCCN3CCC2)[C@H]1CCC[NH2+]C1 ZINC001236932827 1038364698 /nfs/dbraw/zinc/36/46/98/1038364698.db2.gz OEIJGRBBJPFFQK-NRFANRHFSA-N 2 0 356.558 2.501 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@H]3COC)C2)c(O)c1 ZINC001237040340 1038418177 /nfs/dbraw/zinc/41/81/77/1038418177.db2.gz HKCFZNBYUHTKFN-UGKGYDQZSA-N 2 0 374.525 2.971 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccccc3)c(F)c2)CC1 ZINC001210227754 1039437601 /nfs/dbraw/zinc/43/76/01/1039437601.db2.gz QCHHHOUIQFCLOP-QFIPXVFZSA-N 2 0 368.500 2.724 20 10 FFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCCN(CCN2CCOCC2)C1 ZINC001262031705 1041521076 /nfs/dbraw/zinc/52/10/76/1041521076.db2.gz ZKEIKTCSYVVJJU-GUDVDZBRSA-N 2 0 373.541 2.635 20 10 FFCDRP Cc1c(O)ccc(C[N@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001279313697 1042996320 /nfs/dbraw/zinc/99/63/20/1042996320.db2.gz PMJADAWZUXWTRW-OAQYLSRUSA-N 2 0 361.530 2.646 20 10 FFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001279513228 1043208579 /nfs/dbraw/zinc/20/85/79/1043208579.db2.gz BUYRIHHPKGJYQN-IYBDPMFKSA-N 2 0 357.420 2.621 20 10 FFCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](n2cncn2)C1 ZINC001333594637 1048996089 /nfs/dbraw/zinc/99/60/89/1048996089.db2.gz CFPQQBIDTDLPPJ-QMMLZNLJSA-N 2 0 368.529 2.549 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)cc2F)CC1 ZINC001330781281 1049324920 /nfs/dbraw/zinc/32/49/20/1049324920.db2.gz WFMGPEBJQWMGIH-FQEVSTJZSA-N 2 0 374.548 2.789 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1O ZINC001334359710 1049388142 /nfs/dbraw/zinc/38/81/42/1049388142.db2.gz PZAHGSGRCHEKGE-FQEVSTJZSA-N 2 0 370.493 2.956 20 10 FFCDRP C[C@H]1Cc2ccccc2N1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308234151 1052435146 /nfs/dbraw/zinc/43/51/46/1052435146.db2.gz OGSDURIJPOVDKE-IBGZPJMESA-N 2 0 364.537 2.979 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001308493615 1052460535 /nfs/dbraw/zinc/46/05/35/1052460535.db2.gz XJKDNLVJFKXROK-HDICACEKSA-N 2 0 359.514 2.648 20 10 FFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCCN2CC[NH+](C)CC2)c1O ZINC000186948839 509968765 /nfs/dbraw/zinc/96/87/65/509968765.db2.gz ZGVAIYHKAJUVKZ-CQSZACIVSA-N 2 0 370.335 2.751 20 10 FFCDRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1O ZINC000185367367 510824199 /nfs/dbraw/zinc/82/41/99/510824199.db2.gz BJIRLGIAMCSBBR-AWEZNQCLSA-N 2 0 370.335 2.833 20 10 FFCDRP CC(C)[N@H+](C)CCNC(=O)Cn1c2ccccc2c2c1CC[NH+](C(C)C)C2 ZINC000444228581 514160452 /nfs/dbraw/zinc/16/04/52/514160452.db2.gz XSUQAZAWKXXLKD-UHFFFAOYSA-N 2 0 370.541 2.864 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCO[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000883283699 733360003 /nfs/dbraw/zinc/36/00/03/733360003.db2.gz PCSNAKKGLFQCSL-WBVHZDCISA-N 2 0 357.420 2.638 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCSC4(CCOCC4)C3)cc2)CC1 ZINC000770665565 737650560 /nfs/dbraw/zinc/65/05/60/737650560.db2.gz JZELJWUTEUUWKB-UHFFFAOYSA-N 2 0 361.555 2.536 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391142 738136045 /nfs/dbraw/zinc/13/60/45/738136045.db2.gz SWKFEMZFDMTBCV-WCZJQEMASA-N 2 0 356.869 2.754 20 10 FFCDRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000841099517 747268818 /nfs/dbraw/zinc/26/88/18/747268818.db2.gz KIVZMHRCLFCQHD-NVXWUHKLSA-N 2 0 369.303 2.873 20 10 FFCDRP CCOc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccc1O ZINC000895608212 970783283 /nfs/dbraw/zinc/78/32/83/970783283.db2.gz ZIWWMEWUBQEDEQ-UHFFFAOYSA-N 2 0 355.482 2.833 20 10 FFCDRP CC(C)OC(=O)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000895830093 970994741 /nfs/dbraw/zinc/99/47/41/970994741.db2.gz YRRCHGMEZRWKBG-UHFFFAOYSA-N 2 0 359.514 2.602 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCC[NH+](C)C2)C1 ZINC000683479817 960769724 /nfs/dbraw/zinc/76/97/24/960769724.db2.gz LUUKJYKJZLTWAM-KRWDZBQOSA-N 2 0 368.525 2.618 20 10 FFCDRP CCc1nccn1[C@@H](C)CC(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891245343 962556804 /nfs/dbraw/zinc/55/68/04/962556804.db2.gz CVQTWQJTIUUSSC-QFBILLFUSA-N 2 0 371.529 2.882 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)Nc2cccc(C[NH3+])c2)[NH+](C)C)cc1 ZINC000904504275 980288005 /nfs/dbraw/zinc/28/80/05/980288005.db2.gz OTKJXTQUZWUBNV-IBGZPJMESA-N 2 0 355.486 2.636 20 10 FFCDRP Oc1ccccc1C[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000809700737 994574619 /nfs/dbraw/zinc/57/46/19/994574619.db2.gz NISJATHZPUINLV-OAQYLSRUSA-N 2 0 351.494 2.784 20 10 FFCDRP CCOC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824861099 997111659 /nfs/dbraw/zinc/11/16/59/997111659.db2.gz HWNKGYBTFISZBM-UXHICEINSA-N 2 0 359.514 2.650 20 10 FFCDRP Oc1ccccc1C[N@@H+](C[C@H]1CC2(CO1)CC[NH2+]CC2)C[C@@H]1CCCO1 ZINC000903719176 1016149484 /nfs/dbraw/zinc/14/94/84/1016149484.db2.gz WJRCFTNDNHXMLX-RBUKOAKNSA-N 2 0 360.498 2.532 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(O)ccc4C3)cc2)CC1 ZINC000767727518 1000138948 /nfs/dbraw/zinc/13/89/48/1000138948.db2.gz JKHRPQTYBRZWIR-FQEVSTJZSA-N 2 0 351.494 2.791 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc[nH]c(=O)c3)cc2F)CC1 ZINC000788596652 1001829480 /nfs/dbraw/zinc/82/94/80/1001829480.db2.gz ZITGOZOUCHNNSB-OAHLLOKOSA-N 2 0 358.461 2.919 20 10 FFCDRP CCOC(=O)NC1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000791010727 1002541660 /nfs/dbraw/zinc/54/16/60/1002541660.db2.gz IVROQHLMHWWZOW-UHFFFAOYSA-N 2 0 374.529 2.585 20 10 FFCDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775724562 1003830250 /nfs/dbraw/zinc/83/02/50/1003830250.db2.gz LWMWYHXRNSAUSM-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP COCC[N@H+](Cc1ccc(C)o1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775726840 1003860732 /nfs/dbraw/zinc/86/07/32/1003860732.db2.gz YLILVASWSJDXGZ-UHFFFAOYSA-N 2 0 357.498 2.988 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3COC4(CCCCC4)O3)cc2)CC1 ZINC001201685871 1005258574 /nfs/dbraw/zinc/25/85/74/1005258574.db2.gz WGKZCJLYQAVMJP-FQEVSTJZSA-N 2 0 359.514 2.604 20 10 FFCDRP COc1cc(C[NH2+]C2CCN(CC[NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850026301 1005779396 /nfs/dbraw/zinc/77/93/96/1005779396.db2.gz VLGQANKSQFVZHZ-UHFFFAOYSA-N 2 0 363.546 2.814 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000850419679 1005814339 /nfs/dbraw/zinc/81/43/39/1005814339.db2.gz GTJBASVOBLLNII-UHFFFAOYSA-N 3 0 356.558 2.650 20 10 FFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H](c3cc(N4CC[NH2+]CC4)n[nH]3)C2)cc1C ZINC000853248316 1006350309 /nfs/dbraw/zinc/35/03/09/1006350309.db2.gz DBWUDCSPAGXGKK-KRWDZBQOSA-N 2 0 369.513 2.521 20 10 FFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817898487 1007802695 /nfs/dbraw/zinc/80/26/95/1007802695.db2.gz HGIGSYUHNAUKDV-USJZOSNVSA-N 2 0 369.456 2.599 20 10 FFCDRP CCOC(=O)C1([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)CC[NH2+]CC1 ZINC000817898170 1007804734 /nfs/dbraw/zinc/80/47/34/1007804734.db2.gz FFZBRQRYGIRVQH-KRWDZBQOSA-N 2 0 359.514 2.698 20 10 FFCDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555306 1007884501 /nfs/dbraw/zinc/88/45/01/1007884501.db2.gz ZLCONSAGUCNOAL-LJQANCHMSA-N 2 0 371.481 2.901 20 10 FFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccnnc1 ZINC000925676369 1017815434 /nfs/dbraw/zinc/81/54/34/1017815434.db2.gz IMYUGIQFSOFOIO-QGZVFWFLSA-N 2 0 351.498 2.859 20 10 FFCDRP CCOC(=O)[C@@H]1CC2(C[N@@H+]1Cc1ccc3c(c1)CCCN3C)CC[NH2+]CC2 ZINC001222221565 1032832760 /nfs/dbraw/zinc/83/27/60/1032832760.db2.gz NZYWPWINGZCJTC-FQEVSTJZSA-N 2 0 371.525 2.576 20 10 FFCDRP CCOc1cccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c1O ZINC000397628151 1020292599 /nfs/dbraw/zinc/29/25/99/1020292599.db2.gz LUOHZDOMJQPJLN-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)cc2F)CC1 ZINC000155321389 1022240854 /nfs/dbraw/zinc/24/08/54/1022240854.db2.gz TVLNOZVBUKECAA-KRWDZBQOSA-N 3 0 362.537 2.788 20 10 FFCDRP COc1cccc(C[NH2+]CCC2(O)CC[NH+](Cc3ccccc3)CC2)c1O ZINC000717986641 1025255061 /nfs/dbraw/zinc/25/50/61/1025255061.db2.gz VOTSFYJTXXAETH-UHFFFAOYSA-N 2 0 370.493 2.908 20 10 FFCDRP C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc2C[NH2+]1 ZINC000841091077 1030029987 /nfs/dbraw/zinc/02/99/87/1030029987.db2.gz XJDIAQGCQFLYED-GOSISDBHSA-N 2 0 350.510 2.937 20 10 FFCDRP CCN(Cc1ccccc1)c1ccc(C[NH+]2CCC(O)(C[NH3+])CC2)cc1 ZINC000841107307 1030043818 /nfs/dbraw/zinc/04/38/18/1030043818.db2.gz FSBGSVJFFQWJDR-UHFFFAOYSA-N 2 0 353.510 2.999 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@]3(CO)CCCc4ccccc43)cc2)CC1 ZINC000799345096 1031742037 /nfs/dbraw/zinc/74/20/37/1031742037.db2.gz RASWAESVUVOJLM-HSZRJFAPSA-N 2 0 365.521 2.752 20 10 FFCDRP COc1cc(C[N@H+](C)CCCC(=O)c2cccnc2)cc(C[NH+](C)C)c1O ZINC001139257427 1035030086 /nfs/dbraw/zinc/03/00/86/1035030086.db2.gz BFHQUQGSESRAHF-UHFFFAOYSA-N 2 0 371.481 2.952 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCN(c4ccccn4)CC3)cc2)CC1 ZINC001139404368 1035090978 /nfs/dbraw/zinc/09/09/78/1035090978.db2.gz CHARUWFIFNRFGQ-UHFFFAOYSA-N 2 0 365.525 2.546 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CCC(=O)O4)C3)cc2)CC1 ZINC001140305577 1035427411 /nfs/dbraw/zinc/42/74/11/1035427411.db2.gz CRCDAOWSIKOWSF-OAQYLSRUSA-N 2 0 357.498 2.500 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3CC[NH+](C4CCCC4)CC3)cc2)CC1 ZINC001140305393 1035427697 /nfs/dbraw/zinc/42/76/97/1035427697.db2.gz XNLMBNBPQDFIID-UHFFFAOYSA-N 2 0 356.558 2.889 20 10 FFCDRP COc1ccc2ccc(O)c(C[NH+]3CCN(CCC[NH+](C)C)CC3)c2c1 ZINC001234562446 1037088493 /nfs/dbraw/zinc/08/84/93/1037088493.db2.gz NVDWQWPLAKVXMT-UHFFFAOYSA-N 2 0 357.498 2.623 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)C[N@H+](C)C(C)C)cc1C ZINC001230284574 1037195290 /nfs/dbraw/zinc/19/52/90/1037195290.db2.gz LMJXXTYUCCLAIZ-RTBURBONSA-N 2 0 361.530 2.861 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155291 1037390055 /nfs/dbraw/zinc/39/00/55/1037390055.db2.gz OAGXRAZBRMDRDT-QFIPXVFZSA-N 2 0 356.558 2.793 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCN[C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855550 1037798308 /nfs/dbraw/zinc/79/83/08/1037798308.db2.gz UFROIRYLUIHPAF-QHCPKHFHSA-N 2 0 364.537 2.975 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235887654 1037819464 /nfs/dbraw/zinc/81/94/64/1037819464.db2.gz IDXDIKSQLOGDCA-OAQYLSRUSA-N 3 0 360.521 2.542 20 10 FFCDRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971778 1037869084 /nfs/dbraw/zinc/86/90/84/1037869084.db2.gz AGVQUZOCEWTKBY-VXKWHMMOSA-N 3 0 356.558 2.935 20 10 FFCDRP Cc1cccnc1O[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236535416 1038122074 /nfs/dbraw/zinc/12/20/74/1038122074.db2.gz HJHSENZJRORSGG-NRFANRHFSA-N 2 0 366.509 2.843 20 10 FFCDRP Cc1ccnc(O[C@@H]2CCC[N@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)c1 ZINC001236533686 1038122950 /nfs/dbraw/zinc/12/29/50/1038122950.db2.gz YBLQIURFTUWBII-GOSISDBHSA-N 2 0 369.465 2.621 20 10 FFCDRP CC[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)Cc1ccc2c(c1)OCO2 ZINC001236662123 1038179241 /nfs/dbraw/zinc/17/92/41/1038179241.db2.gz IJLDUUCIZWQURU-UHFFFAOYSA-N 2 0 353.466 2.847 20 10 FFCDRP Cc1cccc(O[C@H]2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)n1 ZINC001236847299 1038307377 /nfs/dbraw/zinc/30/73/77/1038307377.db2.gz IZIFXWGCDBSHAY-NRFANRHFSA-N 2 0 366.509 2.843 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ncccn4)CC3)c(F)c2)CC1 ZINC001236939477 1038368197 /nfs/dbraw/zinc/36/81/97/1038368197.db2.gz RIPMWYDAYCGWMU-UHFFFAOYSA-N 2 0 369.488 2.747 20 10 FFCDRP CC[NH+]1CCN(c2ccc(CN3Cc4ccccc4C[C@H]3C[NH3+])cc2)CC1 ZINC001237029430 1038411975 /nfs/dbraw/zinc/41/19/75/1038411975.db2.gz YGVXPHRBQFHNCW-QHCPKHFHSA-N 2 0 364.537 2.714 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN(C3CCC3)[C@@H]3CCC[NH2+]C3)c(F)c2)CC1 ZINC001237157619 1038458428 /nfs/dbraw/zinc/45/84/28/1038458428.db2.gz TYUMDELHHOOKDQ-HXUWFJFHSA-N 2 0 360.521 2.684 20 10 FFCDRP Oc1ccc(Br)cc1C[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256684277 1038601700 /nfs/dbraw/zinc/60/17/00/1038601700.db2.gz OXISBSNSMJKXMF-UHFFFAOYSA-N 2 0 369.303 2.888 20 10 FFCDRP C[NH+]1CCN(c2ccc(-c3nc4ccccc4n3[C@@H]3CC[NH2+]C3)cc2)CC1 ZINC001247050057 1039588350 /nfs/dbraw/zinc/58/83/50/1039588350.db2.gz ZGZSTEWPLHEPIJ-LJQANCHMSA-N 2 0 361.493 2.990 20 10 FFCDRP Oc1ccc([C@H](O)C[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1O ZINC001255382896 1041311011 /nfs/dbraw/zinc/31/10/11/1041311011.db2.gz YDJYRHVAUKMVSE-WIYYLYMNSA-N 2 0 356.466 2.776 20 10 FFCDRP CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C1)[NH+](C)C ZINC001264486790 1042693475 /nfs/dbraw/zinc/69/34/75/1042693475.db2.gz GHDBIGYCGUPDPC-IPMKNSEASA-N 2 0 361.530 2.718 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC12C[NH2+]C2 ZINC001237432299 1043158315 /nfs/dbraw/zinc/15/83/15/1043158315.db2.gz XGCXLRXSEJQWIT-KRWDZBQOSA-N 2 0 360.498 2.664 20 10 FFCDRP CN1CCN(c2ccc(C[NH2+]Cc3ccc4c[nH+]cn4c3)cc2F)CC1 ZINC001325383624 1046491336 /nfs/dbraw/zinc/49/13/36/1046491336.db2.gz RMDOVVQKYYELFW-UHFFFAOYSA-N 2 0 353.445 2.515 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@](C)(CO)Cc3ccc(F)cc3)cc2)CC1 ZINC001308480304 1052459615 /nfs/dbraw/zinc/45/96/15/1052459615.db2.gz VMXMPYCUCQVWII-QFIPXVFZSA-N 2 0 371.500 2.661 20 10 FFCDRP C[NH+]1CCN(c2ccc(CNc3ccc([C@H]4C[NH2+]CCO4)cc3)cc2)CC1 ZINC000849351939 1056836910 /nfs/dbraw/zinc/83/69/10/1056836910.db2.gz GAJWBOGTFQVCFS-JOCHJYFZSA-N 2 0 366.509 2.711 20 10 FFCDRP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000155739607 509062561 /nfs/dbraw/zinc/06/25/61/509062561.db2.gz LTYBGQVKVVOBCE-CJNGLKHVSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c(O)c1 ZINC000186060638 509504185 /nfs/dbraw/zinc/50/41/85/509504185.db2.gz MXUYUALJTKIAFU-INIZCTEOSA-N 2 0 355.482 2.843 20 10 FFCDRP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCC[NH+](C)CC2)C1 ZINC000443916699 514071635 /nfs/dbraw/zinc/07/16/35/514071635.db2.gz GHDFNKQLLHBIHV-UHFFFAOYSA-N 2 0 368.525 2.572 20 10 FFCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1O ZINC000530240418 517648512 /nfs/dbraw/zinc/64/85/12/517648512.db2.gz ZYYWGVDKSRXPHS-KRWDZBQOSA-N 2 0 366.889 2.839 20 10 FFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1cc(Br)ccc1O ZINC000216114777 729545189 /nfs/dbraw/zinc/54/51/89/729545189.db2.gz PLFJQGBNHPXGNU-UHFFFAOYSA-N 2 0 372.351 2.860 20 10 FFCDRP Fc1cc(C[NH2+]Cc2cc3c(s2)CC[NH2+]C3)ccc1N1CCOCC1 ZINC000873213376 731891829 /nfs/dbraw/zinc/89/18/29/731891829.db2.gz XEFDUSHKKHAVIQ-UHFFFAOYSA-N 2 0 361.486 2.659 20 10 FFCDRP CC[NH+](CC)CCOCC[NH2+]Cc1cc(Br)cc(C)c1O ZINC000757942938 736437708 /nfs/dbraw/zinc/43/77/08/736437708.db2.gz NGPVAHOXZTZKAY-UHFFFAOYSA-N 2 0 359.308 2.911 20 10 FFCDRP COc1cc(Br)cc(C[NH+]2CCC(C[NH+](C)C)CC2)c1O ZINC000768303546 737412653 /nfs/dbraw/zinc/41/26/53/737412653.db2.gz QEFMWSSCBJVQGB-UHFFFAOYSA-N 2 0 357.292 2.937 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4SCCS[C@@H]34)cc2)CC1 ZINC000771863929 737762451 /nfs/dbraw/zinc/76/24/51/737762451.db2.gz GZVHDIZUBULENX-QYZOEREBSA-N 2 0 363.596 2.908 20 10 FFCDRP C[NH+]1CCN(c2cc[nH+]cc2NCc2c(O)ccc(Cl)c2F)CC1 ZINC000790982800 739521176 /nfs/dbraw/zinc/52/11/76/739521176.db2.gz JPRAFPBSAPREJY-UHFFFAOYSA-N 2 0 350.825 2.944 20 10 FFCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3cc(O)c(Br)cc3O)C[C@H]2CC1 ZINC001279663259 968010223 /nfs/dbraw/zinc/01/02/23/968010223.db2.gz IRULIFZJGWWWDN-TXEJJXNPSA-N 2 0 355.276 2.634 20 10 FFCDRP Cc1ccc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)c(O)c1 ZINC000877523299 1014611253 /nfs/dbraw/zinc/61/12/53/1014611253.db2.gz XFVBQJVEWGXSJK-UHFFFAOYSA-N 2 0 359.514 2.515 20 10 FFCDRP C[C@H]1C[N@H+](Cc2ccc(I)cc2O)CCC[C@H]1C[NH3+] ZINC001206014487 1032107354 /nfs/dbraw/zinc/10/73/54/1032107354.db2.gz WXHFNSGQAPMGPR-RYUDHWBXSA-N 2 0 374.266 2.804 20 10 FFCDRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2)C1 ZINC000922240861 988235033 /nfs/dbraw/zinc/23/50/33/988235033.db2.gz SBESXTKSERYFON-OAQYLSRUSA-N 2 0 352.478 2.868 20 10 FFCDRP CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388493 988534906 /nfs/dbraw/zinc/53/49/06/988534906.db2.gz FGMYHSSWSVYOKW-RSPOEFSDSA-N 2 0 367.484 2.600 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(CO)C[C@@H]3c3ccccc3)cc2)CC1 ZINC000810165260 994714802 /nfs/dbraw/zinc/71/48/02/994714802.db2.gz NCYZHGXCACNDJR-PKTZIBPZSA-N 2 0 365.521 2.694 20 10 FFCDRP Cc1cccc2c1OC[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000810178616 994723830 /nfs/dbraw/zinc/72/38/30/994723830.db2.gz SQAPVZGUSADPKF-HXUWFJFHSA-N 2 0 351.494 2.840 20 10 FFCDRP COc1ccc([C@@H](C[NH3+])C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000844220940 997711833 /nfs/dbraw/zinc/71/18/33/997711833.db2.gz RCNSXQGIOZMHED-FQEVSTJZSA-N 2 0 369.509 2.706 20 10 FFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CCC[N@@H+]2C)cc1C ZINC001085152370 999034355 /nfs/dbraw/zinc/03/43/55/999034355.db2.gz CCSPVKOQAZPQHV-QRVBRYPASA-N 2 0 359.514 2.615 20 10 FFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1O ZINC000846145185 1000218731 /nfs/dbraw/zinc/21/87/31/1000218731.db2.gz NDVYZJRBOLUGOQ-ILZDJORESA-N 2 0 370.493 2.934 20 10 FFCDRP CCOc1ccc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c(O)c1 ZINC000769536926 1000544642 /nfs/dbraw/zinc/54/46/42/1000544642.db2.gz FTNQUJDCUCLHJZ-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP COC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771841215 1001211930 /nfs/dbraw/zinc/21/19/30/1001211930.db2.gz FWYCZTIFGWDTHX-NRFANRHFSA-N 2 0 353.510 2.786 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)C(=O)Nc3ccccc3)cc2)CC1 ZINC000771845997 1001214019 /nfs/dbraw/zinc/21/40/19/1001214019.db2.gz MRVXQIXZSQUMBE-UHFFFAOYSA-N 2 0 366.509 2.945 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](c3ccco3)N3CCCC3)cc2)CC1 ZINC000771822724 1001220614 /nfs/dbraw/zinc/22/06/14/1001220614.db2.gz HWMSOLTYGMXEHO-OAQYLSRUSA-N 2 0 368.525 2.958 20 10 FFCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(I)cc2O)CC1 ZINC001232978725 1036210419 /nfs/dbraw/zinc/21/04/19/1036210419.db2.gz LTMZLPDBJCEEAE-UHFFFAOYSA-N 2 0 374.266 2.770 20 10 FFCDRP C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775659059 1004974741 /nfs/dbraw/zinc/97/47/41/1004974741.db2.gz UNCODFSCEAXNJW-LJQANCHMSA-N 2 0 353.510 2.821 20 10 FFCDRP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677367 1005003968 /nfs/dbraw/zinc/00/39/68/1005003968.db2.gz ALYUPMOOZROXIG-ZCNNSNEGSA-N 2 0 358.574 2.894 20 10 FFCDRP COC(=O)[C@@H]1C[C@H]1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000850235108 1005797524 /nfs/dbraw/zinc/79/75/24/1005797524.db2.gz RQHXWOHIDRDAHQ-ORYQWCPZSA-N 2 0 371.525 2.506 20 10 FFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](c3cc(N4CC[NH2+]CC4)n[nH]3)C2)cc1C ZINC000853248321 1006349762 /nfs/dbraw/zinc/34/97/62/1006349762.db2.gz DBWUDCSPAGXGKK-QGZVFWFLSA-N 2 0 369.513 2.521 20 10 FFCDRP C[NH2+]CCCC(=O)N1CCC([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000854231627 1006734372 /nfs/dbraw/zinc/73/43/72/1006734372.db2.gz NBENYDGZGOLZLN-BBRMVZONSA-N 2 0 363.477 2.660 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](c3cccnc3)C(C)(C)CO)cc2)CC1 ZINC000816637378 1007142780 /nfs/dbraw/zinc/14/27/80/1007142780.db2.gz AVNJOKGQIHARTC-OAQYLSRUSA-N 2 0 368.525 2.683 20 10 FFCDRP C[C@@H]1OC[C@]2(CC[C@@H](C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)O2)[C@H]1C ZINC000886338485 1008642798 /nfs/dbraw/zinc/64/27/98/1008642798.db2.gz LSZTXCKCBKWZQW-YHDSQAASSA-N 2 0 373.541 2.501 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)[NH+](C)C)cc1 ZINC001180178842 1009572989 /nfs/dbraw/zinc/57/29/89/1009572989.db2.gz GGXIFKTVHUOJFQ-FQEVSTJZSA-N 2 0 374.573 2.984 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3c(O)ccc4ccccc43)C[C@@H]1C[NH2+]CCC2 ZINC001222136034 1032780490 /nfs/dbraw/zinc/78/04/90/1032780490.db2.gz LKMPEFGOJRJHDW-JTSKRJEESA-N 2 0 368.477 2.910 20 10 FFCDRP c1cc(N2CCC[N@@H+](Cc3ccc(N4CCOCC4)cc3)CC2)cc[nH+]1 ZINC000930806037 1020195704 /nfs/dbraw/zinc/19/57/04/1020195704.db2.gz MBTLZZPELLERRS-UHFFFAOYSA-N 2 0 352.482 2.631 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC34CC[NH+](C)CC4)cc2F)CC1 ZINC001116739990 1021387282 /nfs/dbraw/zinc/38/72/82/1021387282.db2.gz DAWXONXZGKYSJX-UHFFFAOYSA-N 2 0 360.521 2.638 20 10 FFCDRP CN(C)c1ccc([C@H](CNC(=O)C[C@H]([NH3+])c2ccccc2)[NH+](C)C)cc1 ZINC001122414010 1023253640 /nfs/dbraw/zinc/25/36/40/1023253640.db2.gz ITNDQLOPGIFQTO-PMACEKPBSA-N 2 0 354.498 2.562 20 10 FFCDRP CCCNC(=O)C1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000779168005 1023284284 /nfs/dbraw/zinc/28/42/84/1023284284.db2.gz BDHIHODAHDDQCZ-UHFFFAOYSA-N 2 0 372.557 2.757 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(OC)ccc3O)cn2)CC1 ZINC000756432496 1023710680 /nfs/dbraw/zinc/71/06/80/1023710680.db2.gz IXPLGOIPBMATKX-INIZCTEOSA-N 2 0 370.497 2.789 20 10 FFCDRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547797 1023727356 /nfs/dbraw/zinc/72/73/56/1023727356.db2.gz HPKIXVTXZCIKCG-CRAIPNDOSA-N 2 0 359.514 2.509 20 10 FFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)c1 ZINC000756855110 1023760191 /nfs/dbraw/zinc/76/01/91/1023760191.db2.gz CMQWFAXXNXFTNT-XLIONFOSSA-N 2 0 369.509 2.640 20 10 FFCDRP COc1cc(C)cc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000758253979 1023998635 /nfs/dbraw/zinc/99/86/35/1023998635.db2.gz PGUUXUXCFXTUHU-UHFFFAOYSA-N 2 0 361.530 2.559 20 10 FFCDRP C[N@H+](Cc1ccco1)[C@@H]1COC2(C1)CC[NH+](Cc1ccc(O)c(O)c1)CC2 ZINC001203878352 1030951806 /nfs/dbraw/zinc/95/18/06/1030951806.db2.gz SCNJEVNKNJIEEM-KRWDZBQOSA-N 2 0 372.465 2.946 20 10 FFCDRP CC(C)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(CO)CC=CC1 ZINC000843433463 1031400747 /nfs/dbraw/zinc/40/07/47/1031400747.db2.gz ZPJJNNJOJGKWDB-NRFANRHFSA-N 2 0 357.542 2.881 20 10 FFCDRP C[NH+](C)CCCC[C@H]([NH3+])C(=O)N(Cc1ccccc1)c1ccc(N)cc1 ZINC001218954969 1033425237 /nfs/dbraw/zinc/42/52/37/1033425237.db2.gz IFVIKNUNMRXIPN-FQEVSTJZSA-N 2 0 354.498 2.861 20 10 FFCDRP Cc1c[nH+]ccc1N1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001138499778 1034340950 /nfs/dbraw/zinc/34/09/50/1034340950.db2.gz IXIBPEVLDKVOFS-UHFFFAOYSA-N 2 0 352.482 2.549 20 10 FFCDRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)o1 ZINC000832279541 1034697921 /nfs/dbraw/zinc/69/79/21/1034697921.db2.gz JQQCBBDXUMFVST-SFHVURJKSA-N 2 0 358.486 2.617 20 10 FFCDRP COc1cc(C[NH+]2CCC(c3ccn(C)n3)CC2)cc(C[NH+](C)C)c1O ZINC001139258948 1035031370 /nfs/dbraw/zinc/03/13/70/1035031370.db2.gz BOJKYZRMJYSYMB-UHFFFAOYSA-N 2 0 358.486 2.576 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)cc(C[NH+](C)C)c1O ZINC001139260412 1035031572 /nfs/dbraw/zinc/03/15/72/1035031572.db2.gz LOKKGMXJBRLJLD-GOSISDBHSA-N 2 0 371.481 2.819 20 10 FFCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000835054385 1035494440 /nfs/dbraw/zinc/49/44/40/1035494440.db2.gz VBGUTXIKZNWRSS-PLNGDYQASA-N 2 0 356.558 2.725 20 10 FFCDRP CCOC(=O)[C@@]12C[N@H+](Cc3ccc4ccccc4c3O)C[C@@H]1CC[NH2+]CC2 ZINC001235351121 1037497068 /nfs/dbraw/zinc/49/70/68/1037497068.db2.gz DNRAVIUBLVAAME-AVRDEDQJSA-N 2 0 368.477 2.910 20 10 FFCDRP CC(C)(C)OC(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235694385 1037690319 /nfs/dbraw/zinc/69/03/19/1037690319.db2.gz DSAUNZLEAXDHDQ-SFHVURJKSA-N 2 0 359.514 2.650 20 10 FFCDRP Oc1cc2c(cc1CN1CC[NH2+]C[C@@H]1c1ccc(Cl)cc1)C[NH2+]CCO2 ZINC001235814699 1037764905 /nfs/dbraw/zinc/76/49/05/1037764905.db2.gz MLZWYPBBQIHIKT-GOSISDBHSA-N 2 0 373.884 2.674 20 10 FFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)c(C)c1 ZINC001236367261 1038060477 /nfs/dbraw/zinc/06/04/77/1038060477.db2.gz LPUNUFLBZDDNHL-UHFFFAOYSA-N 2 0 351.494 2.972 20 10 FFCDRP COc1ccc2ccc(O)c(CN(CC[NH+](C)C)[C@@H]3CCC[NH2+]C3)c2c1 ZINC001236931446 1038363716 /nfs/dbraw/zinc/36/37/16/1038363716.db2.gz HCFIOLQREYVCQB-QGZVFWFLSA-N 2 0 357.498 2.670 20 10 FFCDRP C[NH+]1CCN(c2ccc(CN3CC[C@H]([NH+]4CCCCC4)C3)c(F)c2)CC1 ZINC001236939689 1038368617 /nfs/dbraw/zinc/36/86/17/1038368617.db2.gz UERCQSBOORVXFL-FQEVSTJZSA-N 2 0 360.521 2.638 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC4(CC[NH2+]CC4)CC3)cc2)CC1 ZINC001246182412 1039268883 /nfs/dbraw/zinc/26/88/83/1039268883.db2.gz BAYCTGPEVIJBSQ-UHFFFAOYSA-N 3 0 356.558 2.840 20 10 FFCDRP COc1ccc(N2CCOC[C@]3(CCC[N@@H+]([C@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701973 1039442097 /nfs/dbraw/zinc/44/20/97/1039442097.db2.gz JQPWEGGSBQMSNI-CBQOVEMMSA-N 2 0 373.541 2.755 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249237515 1040643838 /nfs/dbraw/zinc/64/38/38/1040643838.db2.gz GHTXXEXLVILORE-RBUKOAKNSA-N 2 0 371.525 2.787 20 10 FFCDRP CCOc1cccc(C[NH2+][C@@]23CC[C@@](NCC[NH+](C)C)(C2)CCC3)c1O ZINC001278576067 1041237590 /nfs/dbraw/zinc/23/75/90/1041237590.db2.gz DYJPZBHYHFKGOQ-RTWAWAEBSA-N 2 0 361.530 2.877 20 10 FFCDRP COc1cccc([C@H](O)C[NH2+]C2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC001250737564 1041335340 /nfs/dbraw/zinc/33/53/40/1041335340.db2.gz XREZDWQACOASEP-OAQYLSRUSA-N 2 0 356.466 2.688 20 10 FFCDRP c1ccc2c(c1)CNC21CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001237367320 1043123228 /nfs/dbraw/zinc/12/32/28/1043123228.db2.gz XZACBZSWORZEJA-UHFFFAOYSA-N 2 0 362.521 2.691 20 10 FFCDRP CCOC(=O)[C@@H]1C[N@H+](Cc2cc3ccccc3cc2O)CCC12C[NH2+]C2 ZINC001237430131 1043156177 /nfs/dbraw/zinc/15/61/77/1043156177.db2.gz IXALVDVZDKLGGV-SFHVURJKSA-N 2 0 354.450 2.520 20 10 FFCDRP CC[C@@H]1[C@@H](C(=O)NCC[C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@@H+]1C ZINC001281713930 1045030868 /nfs/dbraw/zinc/03/08/68/1045030868.db2.gz JSHXOEYDTOHBRQ-YTQUADARSA-N 2 0 361.530 2.718 20 10 FFCDRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3ccccc3C[NH3+])c2)CC1 ZINC001341033859 1051369949 /nfs/dbraw/zinc/36/99/49/1051369949.db2.gz ZCMQIMOZAYHMIW-UHFFFAOYSA-N 2 0 352.482 2.928 20 10 FFCDRP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104158 1052260047 /nfs/dbraw/zinc/26/00/47/1052260047.db2.gz KCGOBNANNGNAKD-QUCCMNQESA-N 2 0 360.521 2.542 20 10 FFCDRP CCc1cccc(C[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1O ZINC000848892604 1055311659 /nfs/dbraw/zinc/31/16/59/1055311659.db2.gz BONHUYAOXSGCCR-UHFFFAOYSA-N 2 0 353.510 2.992 20 10 FFCDRP CC(C)OC(=O)C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000848927748 1055380959 /nfs/dbraw/zinc/38/09/59/1055380959.db2.gz MNGRFGDTNIPYLR-HXUWFJFHSA-N 2 0 361.530 2.894 20 10 FFCDRP COCC[N@@H+](Cc1cc(F)c(N(C)C)cc1F)CC1CC[NH+](C)CC1 ZINC001462493859 1061646654 /nfs/dbraw/zinc/64/66/54/1061646654.db2.gz XJDLROLPJLRUAB-UHFFFAOYSA-N 2 0 355.473 2.821 20 10 FFCDRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935381 1065424304 /nfs/dbraw/zinc/42/43/04/1065424304.db2.gz CLXGXMYOORLTQB-PMACEKPBSA-N 3 0 358.574 2.896 20 10 FFCDRP CCC[NH2+]CCNC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC001577556920 1078375717 /nfs/dbraw/zinc/37/57/17/1078375717.db2.gz KRYGSKPTTHHVAF-UHFFFAOYSA-N 2 0 356.514 2.524 20 10 FFCDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1O ZINC000185648153 509284363 /nfs/dbraw/zinc/28/43/63/509284363.db2.gz YZNUGOOBPYLWCV-ZDUSSCGKSA-N 2 0 370.335 2.831 20 10 FFCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000187182070 510106917 /nfs/dbraw/zinc/10/69/17/510106917.db2.gz AOCVTVKNZBRKED-KBPBESRZSA-N 2 0 370.335 2.750 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cn(C)nc3C)cc2F)CC1 ZINC000177971587 510353002 /nfs/dbraw/zinc/35/30/02/510353002.db2.gz QUTPHUUJQYEDMJ-HNNXBMFYSA-N 2 0 359.493 2.860 20 10 FFCDRP CCOc1cccc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000271222779 511126555 /nfs/dbraw/zinc/12/65/55/511126555.db2.gz PKXWTWQCXYWAGK-UHFFFAOYSA-N 2 0 361.530 2.781 20 10 FFCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000375786512 512506409 /nfs/dbraw/zinc/50/64/09/512506409.db2.gz MSVKTZYLUJLQNL-HOJAQTOUSA-N 2 0 361.505 2.749 20 10 FFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000761203846 736707388 /nfs/dbraw/zinc/70/73/88/736707388.db2.gz MSXZCJSRBRHNGH-INIZCTEOSA-N 2 0 356.894 2.987 20 10 FFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)c1O ZINC000841099873 747268760 /nfs/dbraw/zinc/26/87/60/747268760.db2.gz PTGNWCIPQXVQRW-QAPCUYQASA-N 2 0 354.878 2.773 20 10 FFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1O ZINC000894317660 964684714 /nfs/dbraw/zinc/68/47/14/964684714.db2.gz OJRFNVYYZZBOAK-UHFFFAOYSA-N 2 0 370.493 2.956 20 10 FFCDRP CN(C)c1ccc([C@@H](CNC2CC[NH+](C[C@H]3CCCO3)CC2)[NH+](C)C)cc1 ZINC000898448142 976459680 /nfs/dbraw/zinc/45/96/80/976459680.db2.gz PYAFZLHTRZLDTB-FGZHOGPDSA-N 2 0 374.573 2.588 20 10 FFCDRP CC[C@@H]1[C@@H](C(=O)N(CC)CC[NH2+]Cc2ccc(OC)c(C)c2)CC[N@@H+]1C ZINC001482924029 981590904 /nfs/dbraw/zinc/59/09/04/981590904.db2.gz CNWQGJHMUXFSKY-RBUKOAKNSA-N 2 0 361.530 2.672 20 10 FFCDRP CC(C)[C@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388481 988534306 /nfs/dbraw/zinc/53/43/06/988534306.db2.gz FGMYHSSWSVYOKW-AFYVEPGGSA-N 2 0 367.484 2.600 20 10 FFCDRP CCOc1cccc(C[NH2+][C@@H]2C[C@@]3(C[N@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1O ZINC000922394144 988556768 /nfs/dbraw/zinc/55/67/68/988556768.db2.gz VNDSXXHFBSHVFO-DGQTTZFYSA-N 2 0 362.514 2.750 20 10 FFCDRP CCOc1cccc(C[NH2+][C@@H]2C[C@]3(C[N@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1O ZINC000922394345 988556838 /nfs/dbraw/zinc/55/68/38/988556838.db2.gz VNDSXXHFBSHVFO-SGLNWRHMSA-N 2 0 362.514 2.750 20 10 FFCDRP CC[NH+](CC)CC(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1 ZINC001106785010 989056590 /nfs/dbraw/zinc/05/65/90/989056590.db2.gz RXSPMDIBBMSQPR-IEBWSBKVSA-N 2 0 361.530 2.530 20 10 FFCDRP COC(=O)Nc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000796492288 1015458847 /nfs/dbraw/zinc/45/88/47/1015458847.db2.gz ZHOMKOUFCPQTPK-UHFFFAOYSA-N 2 0 368.481 2.907 20 10 FFCDRP C[N@H+](CCN1CCN(Cc2ccccc2)CC1)Cc1cc(F)ccc1O ZINC000809695122 994570973 /nfs/dbraw/zinc/57/09/73/994570973.db2.gz ZHKFJTMTELYCPU-UHFFFAOYSA-N 2 0 357.473 2.781 20 10 FFCDRP COC(=O)c1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000809730242 994584126 /nfs/dbraw/zinc/58/41/26/994584126.db2.gz GNKCDXGJXFVBEI-UHFFFAOYSA-N 2 0 353.466 2.515 20 10 FFCDRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000809732926 994584564 /nfs/dbraw/zinc/58/45/64/994584564.db2.gz RYAXVLAHUJDLCC-UHFFFAOYSA-N 2 0 361.530 2.761 20 10 FFCDRP COc1ccc2ccc(O)c(C[NH+]3CCN([C@@H]4CCC[N@H+](C)C4)CC3)c2c1 ZINC000738215046 999622749 /nfs/dbraw/zinc/62/27/49/999622749.db2.gz RRFYQHNMSKAFPP-GOSISDBHSA-N 2 0 369.509 2.766 20 10 FFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1O ZINC000846166541 1000214922 /nfs/dbraw/zinc/21/49/22/1000214922.db2.gz YZLRJICRDJIKTO-YJBOKZPZSA-N 2 0 356.466 2.818 20 10 FFCDRP COC(=O)C(C)(C)CC[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000793027994 1003269598 /nfs/dbraw/zinc/26/95/98/1003269598.db2.gz PZBCQAAXUQRCMP-UHFFFAOYSA-N 2 0 373.541 2.898 20 10 FFCDRP CCc1nn(C)c(CC)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283384 1006730910 /nfs/dbraw/zinc/73/09/10/1006730910.db2.gz CPPIFURFXMSEKD-UHFFFAOYSA-N 2 0 355.530 2.587 20 10 FFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817893873 1007801096 /nfs/dbraw/zinc/80/10/96/1007801096.db2.gz JLMUZRKULZESAN-YSIASYRMSA-N 2 0 361.505 2.797 20 10 FFCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249904 1008915339 /nfs/dbraw/zinc/91/53/39/1008915339.db2.gz WJJXAMLBSFWWLD-NRFANRHFSA-N 3 0 358.574 2.896 20 10 FFCDRP CCN(C)c1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000773842349 1009593084 /nfs/dbraw/zinc/59/30/84/1009593084.db2.gz XYERYPABSXGMEG-UHFFFAOYSA-N 2 0 358.574 2.992 20 10 FFCDRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773143533 1009690682 /nfs/dbraw/zinc/69/06/82/1009690682.db2.gz AUAMWQOXZXXOKW-MBSDFSHPSA-N 2 0 368.569 2.791 20 10 FFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cn2c(n1)CCCC2 ZINC000926855506 1018270524 /nfs/dbraw/zinc/27/05/24/1018270524.db2.gz VFGIJBSAHSHABF-KRWDZBQOSA-N 2 0 353.514 2.822 20 10 FFCDRP CCCn1cc([C@@H](C)NCc2ccc(N3CC[NH+](CC)CC3)c(F)c2)nn1 ZINC000902795355 1020481765 /nfs/dbraw/zinc/48/17/65/1020481765.db2.gz DOVGYEHZCYARSV-MRXNPFEDSA-N 2 0 374.508 2.820 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@@H]2C1 ZINC001120070868 1023228799 /nfs/dbraw/zinc/22/87/99/1023228799.db2.gz CPVQVNSJMPUQAL-JAXLGGSGSA-N 3 0 356.558 2.601 20 10 FFCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@H]2C1 ZINC001120072576 1023230498 /nfs/dbraw/zinc/23/04/98/1023230498.db2.gz XHBKQSKFQLHNEF-GUDVDZBRSA-N 2 0 361.505 2.824 20 10 FFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000756511667 1023721383 /nfs/dbraw/zinc/72/13/83/1023721383.db2.gz ZIOATHXUIWWVNA-SFHVURJKSA-N 2 0 354.498 2.959 20 10 FFCDRP [NH3+]Cc1cn([C@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)nn1 ZINC000841100081 1030036770 /nfs/dbraw/zinc/03/67/70/1030036770.db2.gz SYGGHHFETCLHKE-FQEVSTJZSA-N 2 0 354.502 2.564 20 10 FFCDRP CCOc1cccc(C[N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@@H]3COC)C2)c1O ZINC001203608409 1030783756 /nfs/dbraw/zinc/78/37/56/1030783756.db2.gz OIHLTKXBUPVLDX-KNQAVFIVSA-N 2 0 374.525 2.971 20 10 FFCDRP Fc1cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128885 1031196587 /nfs/dbraw/zinc/19/65/87/1031196587.db2.gz YIXGTLZIKMJBAJ-RTBURBONSA-N 2 0 361.505 2.874 20 10 FFCDRP [NH3+]C[C@@]1(O)CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001205240360 1031620988 /nfs/dbraw/zinc/62/09/88/1031620988.db2.gz JGRGHBMBXWOXTN-OAQYLSRUSA-N 2 0 356.466 2.647 20 10 FFCDRP COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(O)cc1Br ZINC001205653038 1031906517 /nfs/dbraw/zinc/90/65/17/1031906517.db2.gz SFAHNZSWDHFGFM-NWDGAFQWSA-N 2 0 357.292 2.970 20 10 FFCDRP COc1cc(C[N@@H+]2CCC[C@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139256457 1035029727 /nfs/dbraw/zinc/02/97/27/1035029727.db2.gz CFIPPKQLPXTETM-IBGZPJMESA-N 2 0 371.481 2.901 20 10 FFCDRP COc1cc(CN2CCCC[C@@H]2C[NH+]2CCCC2)cc(C[NH+](C)C)c1O ZINC001139256708 1035030575 /nfs/dbraw/zinc/03/05/75/1035030575.db2.gz HUFNMFIECPMSLX-LJQANCHMSA-N 2 0 361.530 2.913 20 10 FFCDRP COc1cc(CN2CCC(C)([NH+]3CCCC3)CC2)cc(C[NH+](C)C)c1O ZINC001139260644 1035031603 /nfs/dbraw/zinc/03/16/03/1035031603.db2.gz OAUNAAUALCQNLE-UHFFFAOYSA-N 2 0 361.530 2.913 20 10 FFCDRP CCN(CC)C(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139404471 1035091780 /nfs/dbraw/zinc/09/17/80/1035091780.db2.gz IVTIKBQOHMPVLX-FQEVSTJZSA-N 2 0 372.557 2.519 20 10 FFCDRP Cc1nc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)no1 ZINC001139408626 1035092072 /nfs/dbraw/zinc/09/20/72/1035092072.db2.gz AYCYZWYTSGJBFW-UHFFFAOYSA-N 2 0 355.486 2.509 20 10 FFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(NC(=O)C(C)C)CC3)cc2)CC1 ZINC001140304728 1035426140 /nfs/dbraw/zinc/42/61/40/1035426140.db2.gz ZQCCUUVKSHYUSM-UHFFFAOYSA-N 2 0 372.557 2.565 20 10 FFCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@H]2C1 ZINC001140309874 1035429380 /nfs/dbraw/zinc/42/93/80/1035429380.db2.gz XZPADNBKTOLSGF-NHCUHLMSSA-N 3 0 356.558 2.602 20 10 FFCDRP CCC(=O)N(C)C1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140309431 1035429560 /nfs/dbraw/zinc/42/95/60/1035429560.db2.gz GGRYPFFOUDXUTN-UHFFFAOYSA-N 2 0 372.557 2.661 20 10 FFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001233453906 1036633719 /nfs/dbraw/zinc/63/37/19/1036633719.db2.gz YIQKASBRYRUTHN-JKSUJKDBSA-N 2 0 357.420 2.621 20 10 FFCDRP Oc1cc(O)c(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc1O ZINC001233484600 1036653560 /nfs/dbraw/zinc/65/35/60/1036653560.db2.gz QREOMUKQJKKSEQ-UHFFFAOYSA-N 2 0 369.465 2.687 20 10 FFCDRP Oc1cc(O)c(CN2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487296 1036655660 /nfs/dbraw/zinc/65/56/60/1036655660.db2.gz XWAHNSRBHGLXHL-SJLPKXTDSA-N 2 0 354.450 2.757 20 10 FFCDRP Oc1cc2c(cc1C[NH+]1CCC3(CNc4ccccc43)CC1)C[NH2+]CCO2 ZINC001235143572 1037384051 /nfs/dbraw/zinc/38/40/51/1037384051.db2.gz KYEBRLIYPVWNDM-UHFFFAOYSA-N 2 0 365.477 2.834 20 10 FFCDRP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@H+](Cc1c(C)cccc1O)C2 ZINC001235326197 1037478027 /nfs/dbraw/zinc/47/80/27/1037478027.db2.gz RJWMWFGAYFWYRT-SIKLNZKXSA-N 2 0 372.509 2.846 20 10 FFCDRP CN1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1c1ccccc1 ZINC001235675512 1037677775 /nfs/dbraw/zinc/67/77/75/1037677775.db2.gz YURQAWQOOPHJHB-QFIPXVFZSA-N 2 0 350.510 2.585 20 10 FFCDRP Cc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c1O ZINC001231591351 1037707096 /nfs/dbraw/zinc/70/70/96/1037707096.db2.gz ASIKRVWPSSEXBN-WOJBJXKFSA-N 2 0 371.525 2.608 20 10 FFCDRP CCOC(=O)[C@]12C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]1C[NH2+]CC2 ZINC001236040869 1037902263 /nfs/dbraw/zinc/90/22/63/1037902263.db2.gz PGZCOIGOTMZEEI-DYESRHJHSA-N 2 0 360.498 2.664 20 10 FFCDRP CCOc1ccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001237039670 1038417153 /nfs/dbraw/zinc/41/71/53/1038417153.db2.gz BOFWLCUUOUWJOZ-DENIHFKCSA-N 2 0 374.525 2.971 20 10 FFCDRP Cc1ccccc1OC[C@@H](O)C[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001251742517 1039282154 /nfs/dbraw/zinc/28/21/54/1039282154.db2.gz HCWIILSLEHXWHJ-FQEVSTJZSA-N 2 0 370.493 2.695 20 10 FFCDRP Cc1cc(C[N@@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)ccc1N(C)C ZINC001278686337 1039773717 /nfs/dbraw/zinc/77/37/17/1039773717.db2.gz LZDBBLKVXOKZBD-JOCHJYFZSA-N 2 0 358.574 2.911 20 10 FFCDRP Oc1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccc[nH]4)C3)CC2)cc(O)c1O ZINC001279681547 1043460369 /nfs/dbraw/zinc/46/03/69/1043460369.db2.gz BIXAPHOJAKUBPP-UHFFFAOYSA-N 2 0 357.454 2.620 20 10 FFCDRP C[NH+]1CCN(c2cc(C[NH2+]Cc3ccc(N4CCCC4)cc3)ccn2)CC1 ZINC001308203854 1052430564 /nfs/dbraw/zinc/43/05/64/1052430564.db2.gz SUJVNTUFKWROGW-UHFFFAOYSA-N 2 0 365.525 2.723 20 10 FFCDRP [NH3+][C@@H](CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)Cc1ccccc1 ZINC001580127858 1078754065 /nfs/dbraw/zinc/75/40/65/1078754065.db2.gz NXZRYSCYORPDPN-FQEVSTJZSA-N 2 0 353.510 2.697 20 10 FFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)c3cccc(F)c3)cc2)CC1 ZINC001560595648 1076282754 /nfs/dbraw/zinc/28/27/54/1076282754.db2.gz JBNVTLRVEMIWNR-OAQYLSRUSA-N 2 0 357.473 2.575 20 10 FFCDRP COc1cc(C)c(C[NH2+]CCc2ccc(N3CC[NH+](C)CC3)cc2)c(O)c1 ZINC001561055864 1076326205 /nfs/dbraw/zinc/32/62/05/1076326205.db2.gz ZYGWGCCPQRKTRE-UHFFFAOYSA-N 2 0 369.509 2.793 20 10 FFCDRP